data_15805_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15805
_Entry.PDB_ID 2K4N
_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 13 . 1 1 1 A 2 2 ASN HA H 2 4.980 4.932 0.048 1
1 18 . 1 1 1 A 2 2 ASN C C 2 176.300 176.888 -0.588 1
1 19 . 1 1 1 A 2 2 ASN CA C 2 52.500 52.407 0.093 1
1 20 . 1 1 1 A 2 2 ASN CB C 2 40.900 39.390 1.510 1
1 22 . 1 1 1 A 3 3 SER H H 3 9.940 9.677 0.263 1
1 23 . 1 1 1 A 3 3 SER HA H 3 3.720 4.054 -0.334 1
1 26 . 1 1 1 A 3 3 SER C C 3 175.900 176.444 -0.544 1
1 27 . 1 1 1 A 3 3 SER CA C 3 63.300 61.747 1.553 1
1 28 . 1 1 1 A 3 3 SER CB C 3 61.700 62.889 -1.189 1
1 29 . 1 1 1 A 3 3 SER N N 3 118.200 116.574 1.626 1
1 30 . 1 1 1 A 4 4 GLU H H 4 8.450 8.110 0.340 1
1 31 . 1 1 1 A 4 4 GLU HA H 4 4.010 4.051 -0.041 1
1 36 . 1 1 1 A 4 4 GLU C C 4 178.800 179.127 -0.327 1
1 37 . 1 1 1 A 4 4 GLU CA C 4 60.300 58.976 1.324 1
1 38 . 1 1 1 A 4 4 GLU CB C 4 29.100 29.471 -0.371 1
1 40 . 1 1 1 A 4 4 GLU N N 4 123.600 122.450 1.150 1
1 41 . 1 1 1 A 5 5 VAL H H 5 7.590 7.781 -0.191 1
1 42 . 1 1 1 A 5 5 VAL HA H 5 3.850 3.628 0.222 1
1 50 . 1 1 1 A 5 5 VAL C C 5 179.100 178.552 0.548 1
1 51 . 1 1 1 A 5 5 VAL CA C 5 65.800 66.338 -0.538 1
1 52 . 1 1 1 A 5 5 VAL CB C 5 32.300 31.570 0.730 1
1 55 . 1 1 1 A 5 5 VAL N N 5 119.300 120.242 -0.942 1
1 56 . 1 1 1 A 6 6 ILE H H 6 7.240 7.937 -0.697 1
1 57 . 1 1 1 A 6 6 ILE HA H 6 3.580 3.690 -0.110 1
1 67 . 1 1 1 A 6 6 ILE C C 6 177.000 177.868 -0.868 1
1 68 . 1 1 1 A 6 6 ILE CA C 6 65.300 65.543 -0.243 1
1 69 . 1 1 1 A 6 6 ILE CB C 6 37.900 37.678 0.222 1
1 73 . 1 1 1 A 6 6 ILE N N 6 120.300 120.893 -0.593 1
1 74 . 1 1 1 A 7 7 LYS H H 7 8.050 7.867 0.183 1
1 75 . 1 1 1 A 7 7 LYS HA H 7 3.570 3.774 -0.204 1
1 84 . 1 1 1 A 7 7 LYS C C 7 178.700 179.836 -1.136 1
1 85 . 1 1 1 A 7 7 LYS CA C 7 61.300 60.223 1.077 1
1 86 . 1 1 1 A 7 7 LYS CB C 7 32.200 31.715 0.485 1
1 90 . 1 1 1 A 7 7 LYS N N 7 119.200 119.136 0.064 1
1 91 . 1 1 1 A 8 8 GLU H H 8 8.100 7.844 0.256 1
1 92 . 1 1 1 A 8 8 GLU HA H 8 4.000 4.108 -0.108 1
1 97 . 1 1 1 A 8 8 GLU C C 8 178.500 179.015 -0.515 1
1 98 . 1 1 1 A 8 8 GLU CA C 8 59.700 59.038 0.662 1
1 99 . 1 1 1 A 8 8 GLU CB C 8 29.600 29.537 0.063 1
1 101 . 1 1 1 A 8 8 GLU N N 8 119.400 120.524 -1.124 1
1 102 . 1 1 1 A 9 9 PHE H H 9 7.720 8.192 -0.472 1
1 103 . 1 1 1 A 9 9 PHE HA H 9 4.160 4.130 0.030 1
1 109 . 1 1 1 A 9 9 PHE C C 9 176.900 176.663 0.237 1
1 110 . 1 1 1 A 9 9 PHE CA C 9 61.300 61.294 0.006 1
1 111 . 1 1 1 A 9 9 PHE CB C 9 39.400 39.224 0.176 1
1 115 . 1 1 1 A 9 9 PHE N N 9 121.300 121.881 -0.581 1
1 116 . 1 1 1 A 10 10 LEU H H 10 8.060 8.721 -0.661 1
1 117 . 1 1 1 A 10 10 LEU HA H 10 3.660 3.840 -0.180 1
1 127 . 1 1 1 A 10 10 LEU C C 10 179.000 179.246 -0.246 1
1 128 . 1 1 1 A 10 10 LEU CA C 10 58.000 57.652 0.348 1
1 129 . 1 1 1 A 10 10 LEU CB C 10 41.400 41.048 0.352 1
1 133 . 1 1 1 A 10 10 LEU N N 10 118.000 118.888 -0.888 1
1 134 . 1 1 1 A 11 11 GLU H H 11 7.990 8.451 -0.461 1
1 135 . 1 1 1 A 11 11 GLU HA H 11 4.110 3.933 0.177 1
1 140 . 1 1 1 A 11 11 GLU C C 11 174.200 178.190 -3.990 1
1 141 . 1 1 1 A 11 11 GLU CA C 11 59.200 59.792 -0.592 1
1 142 . 1 1 1 A 11 11 GLU CB C 11 29.300 29.198 0.102 1
1 144 . 1 1 1 A 11 11 GLU N N 11 118.300 120.901 -2.601 1
1 145 . 1 1 1 A 12 12 ASP H H 12 8.080 7.986 0.094 1
1 146 . 1 1 1 A 12 12 ASP HA H 12 4.340 4.319 0.021 1
1 149 . 1 1 1 A 12 12 ASP C C 12 178.900 178.249 0.651 1
1 150 . 1 1 1 A 12 12 ASP CA C 12 57.600 57.827 -0.227 1
1 151 . 1 1 1 A 12 12 ASP CB C 12 41.000 41.498 -0.498 1
1 152 . 1 1 1 A 12 12 ASP N N 12 121.800 120.136 1.664 1
1 153 . 1 1 1 A 13 13 ILE H H 13 7.610 7.512 0.098 1
1 154 . 1 1 1 A 13 13 ILE HA H 13 4.240 3.934 0.306 1
1 164 . 1 1 1 A 13 13 ILE C C 13 176.800 176.770 0.030 1
1 165 . 1 1 1 A 13 13 ILE CA C 13 62.100 61.478 0.622 1
1 166 . 1 1 1 A 13 13 ILE CB C 13 38.300 38.477 -0.177 1
1 170 . 1 1 1 A 13 13 ILE N N 13 110.800 112.883 -2.083 1
1 171 . 1 1 1 A 14 14 GLY H H 14 7.640 8.576 -0.936 1
1 172 . 1 1 1 A 14 14 GLY HA2 H 14 3.810 3.940 -0.130 1
1 173 . 1 1 1 A 14 14 GLY HA3 H 14 3.880 3.947 -0.067 1
1 174 . 1 1 1 A 14 14 GLY C C 14 175.200 173.735 1.465 1
1 175 . 1 1 1 A 14 14 GLY CA C 14 46.900 46.383 0.517 1
1 176 . 1 1 1 A 14 14 GLY N N 14 111.800 113.030 -1.230 1
1 177 . 1 1 1 A 15 15 GLU H H 15 7.870 7.838 0.032 1
1 178 . 1 1 1 A 15 15 GLU HA H 15 4.680 4.916 -0.236 1
1 183 . 1 1 1 A 15 15 GLU C C 15 175.100 174.217 0.883 1
1 184 . 1 1 1 A 15 15 GLU CA C 15 54.800 54.727 0.073 1
1 185 . 1 1 1 A 15 15 GLU CB C 15 32.200 33.545 -1.345 1
1 187 . 1 1 1 A 15 15 GLU N N 15 119.200 119.037 0.163 1
1 188 . 1 1 1 A 16 16 ASP H H 16 8.220 8.798 -0.578 1
1 189 . 1 1 1 A 16 16 ASP HA H 16 4.680 5.241 -0.561 1
1 192 . 1 1 1 A 16 16 ASP C C 16 174.600 175.392 -0.792 1
1 193 . 1 1 1 A 16 16 ASP CA C 16 53.600 52.919 0.681 1
1 194 . 1 1 1 A 16 16 ASP CB C 16 42.900 43.090 -0.190 1
1 195 . 1 1 1 A 16 16 ASP N N 16 120.600 125.484 -4.884 1
1 196 . 1 1 1 A 17 17 TYR H H 17 7.540 8.740 -1.200 1
1 197 . 1 1 1 A 17 17 TYR HA H 17 4.910 5.813 -0.903 1
1 202 . 1 1 1 A 17 17 TYR C C 17 173.600 174.548 -0.948 1
1 203 . 1 1 1 A 17 17 TYR CA C 17 56.200 55.249 0.951 1
1 204 . 1 1 1 A 17 17 TYR CB C 17 41.100 41.673 -0.573 1
1 207 . 1 1 1 A 17 17 TYR N N 17 112.700 119.285 -6.585 1
1 208 . 1 1 1 A 18 18 ILE H H 18 7.950 9.022 -1.072 1
1 209 . 1 1 1 A 18 18 ILE HA H 18 4.330 4.613 -0.283 1
1 219 . 1 1 1 A 18 18 ILE C C 18 174.700 174.509 0.191 1
1 220 . 1 1 1 A 18 18 ILE CA C 18 60.300 60.578 -0.278 1
1 221 . 1 1 1 A 18 18 ILE CB C 18 41.000 37.542 3.458 1
1 225 . 1 1 1 A 18 18 ILE N N 18 120.400 123.266 -2.866 1
1 226 . 1 1 1 A 19 19 GLU H H 19 8.760 9.067 -0.307 1
1 227 . 1 1 1 A 19 19 GLU HA H 19 5.200 5.220 -0.020 1
1 232 . 1 1 1 A 19 19 GLU C C 19 175.200 176.466 -1.266 1
1 233 . 1 1 1 A 19 19 GLU CA C 19 55.500 55.601 -0.101 1
1 234 . 1 1 1 A 19 19 GLU CB C 19 32.400 31.382 1.018 1
1 236 . 1 1 1 A 19 19 GLU N N 19 129.000 128.585 0.415 1
1 237 . 1 1 1 A 20 20 LEU H H 20 8.730 9.512 -0.782 1
1 238 . 1 1 1 A 20 20 LEU HA H 20 4.620 4.584 0.036 1
1 248 . 1 1 1 A 20 20 LEU C C 20 176.200 176.170 0.030 1
1 249 . 1 1 1 A 20 20 LEU CA C 20 54.100 54.052 0.048 1
1 250 . 1 1 1 A 20 20 LEU CB C 20 44.400 41.583 2.817 1
1 254 . 1 1 1 A 20 20 LEU N N 20 128.400 129.321 -0.921 1
1 255 . 1 1 1 A 21 21 GLU H H 21 8.700 8.368 0.332 1
1 256 . 1 1 1 A 21 21 GLU HA H 21 3.870 3.987 -0.117 1
1 261 . 1 1 1 A 21 21 GLU C C 21 176.100 175.424 0.676 1
1 262 . 1 1 1 A 21 21 GLU CA C 21 58.800 57.284 1.516 1
1 263 . 1 1 1 A 21 21 GLU CB C 21 28.200 28.906 -0.706 1
1 265 . 1 1 1 A 21 21 GLU N N 21 122.600 117.989 4.611 1
1 266 . 1 1 1 A 22 22 ASN H H 22 8.640 8.543 0.097 1
1 267 . 1 1 1 A 22 22 ASN HA H 22 4.540 4.279 0.261 1
1 272 . 1 1 1 A 22 22 ASN C C 22 173.800 173.927 -0.127 1
1 273 . 1 1 1 A 22 22 ASN CA C 22 54.600 55.012 -0.412 1
1 274 . 1 1 1 A 22 22 ASN CB C 22 38.400 36.998 1.402 1
1 275 . 1 1 1 A 22 22 ASN N N 22 118.000 118.054 -0.054 1
1 277 . 1 1 1 A 23 23 GLU H H 23 7.740 7.730 0.010 1
1 278 . 1 1 1 A 23 23 GLU HA H 23 5.430 4.859 0.571 1
1 283 . 1 1 1 A 23 23 GLU C C 23 175.400 175.332 0.068 1
1 284 . 1 1 1 A 23 23 GLU CA C 23 54.900 54.947 -0.047 1
1 285 . 1 1 1 A 23 23 GLU CB C 23 34.500 31.736 2.764 1
1 287 . 1 1 1 A 23 23 GLU N N 23 116.400 118.235 -1.835 1
1 288 . 1 1 1 A 24 24 ILE H H 24 9.050 8.979 0.071 1
1 289 . 1 1 1 A 24 24 ILE HA H 24 4.810 4.764 0.046 1
1 299 . 1 1 1 A 24 24 ILE C C 24 174.600 175.076 -0.476 1
1 300 . 1 1 1 A 24 24 ILE CA C 24 60.700 60.347 0.353 1
1 301 . 1 1 1 A 24 24 ILE CB C 24 41.300 38.317 2.983 1
1 305 . 1 1 1 A 24 24 ILE N N 24 122.800 125.928 -3.128 1
1 306 . 1 1 1 A 25 25 HIS H H 25 9.490 9.641 -0.151 1
1 307 . 1 1 1 A 25 25 HIS HA H 25 5.090 5.426 -0.336 1
1 312 . 1 1 1 A 25 25 HIS C C 25 176.100 175.057 1.043 1
1 313 . 1 1 1 A 25 25 HIS CA C 25 56.100 55.455 0.645 1
1 314 . 1 1 1 A 25 25 HIS CB C 25 33.100 30.852 2.248 1
1 317 . 1 1 1 A 25 25 HIS N N 25 127.300 126.796 0.504 1
1 318 . 1 1 1 A 26 26 LEU H H 26 8.820 8.826 -0.006 1
1 319 . 1 1 1 A 26 26 LEU HA H 26 5.160 4.968 0.192 1
1 329 . 1 1 1 A 26 26 LEU C C 26 178.000 175.955 2.045 1
1 330 . 1 1 1 A 26 26 LEU CA C 26 52.900 53.477 -0.577 1
1 331 . 1 1 1 A 26 26 LEU CB C 26 48.100 43.871 4.229 1
1 335 . 1 1 1 A 26 26 LEU N N 26 121.600 125.008 -3.408 1
1 336 . 1 1 1 A 27 27 LYS H H 27 8.990 8.831 0.159 1
1 337 . 1 1 1 A 27 27 LYS HA H 27 4.630 4.580 0.050 1
1 345 . 1 1 1 A 27 27 LYS CA C 27 55.700 54.347 1.353 1
1 346 . 1 1 1 A 27 27 LYS CB C 27 31.900 32.321 -0.421 1
1 350 . 1 1 1 A 27 27 LYS N N 27 125.900 120.682 5.218 1
1 351 . 1 1 1 A 28 28 PRO HA H 28 4.500 4.448 0.052 1
1 358 . 1 1 1 A 28 28 PRO C C 28 177.900 179.128 -1.228 1
1 359 . 1 1 1 A 28 28 PRO CA C 28 67.400 65.907 1.493 1
1 360 . 1 1 1 A 28 28 PRO CB C 28 32.100 31.894 0.206 1
1 363 . 1 1 1 A 29 29 GLU H H 29 9.880 8.415 1.465 1
1 364 . 1 1 1 A 29 29 GLU HA H 29 4.140 4.236 -0.096 1
1 369 . 1 1 1 A 29 29 GLU C C 29 178.800 179.218 -0.418 1
1 370 . 1 1 1 A 29 29 GLU CA C 29 60.600 59.474 1.126 1
1 371 . 1 1 1 A 29 29 GLU CB C 29 29.200 29.276 -0.076 1
1 373 . 1 1 1 A 29 29 GLU N N 29 117.100 117.812 -0.712 1
1 374 . 1 1 1 A 30 30 VAL H H 30 7.050 7.477 -0.427 1
1 375 . 1 1 1 A 30 30 VAL HA H 30 3.850 3.784 0.066 1
1 383 . 1 1 1 A 30 30 VAL C C 30 177.700 178.513 -0.813 1
1 384 . 1 1 1 A 30 30 VAL CA C 30 65.600 66.321 -0.721 1
1 385 . 1 1 1 A 30 30 VAL CB C 30 32.100 31.978 0.122 1
1 388 . 1 1 1 A 30 30 VAL N N 30 120.900 120.898 0.002 1
1 389 . 1 1 1 A 31 31 PHE H H 31 8.980 8.865 0.115 1
1 390 . 1 1 1 A 31 31 PHE HA H 31 3.870 4.268 -0.398 1
1 394 . 1 1 1 A 31 31 PHE C C 31 176.700 177.273 -0.573 1
1 395 . 1 1 1 A 31 31 PHE CA C 31 62.200 62.050 0.150 1
1 396 . 1 1 1 A 31 31 PHE CB C 31 39.300 38.944 0.356 1
1 398 . 1 1 1 A 31 31 PHE N N 31 121.100 120.474 0.626 1
1 399 . 1 1 1 A 32 32 TYR H H 32 8.640 8.585 0.055 1
1 400 . 1 1 1 A 32 32 TYR HA H 32 3.880 4.568 -0.688 1
1 405 . 1 1 1 A 32 32 TYR C C 32 176.000 178.355 -2.355 1
1 406 . 1 1 1 A 32 32 TYR CA C 32 63.300 62.107 1.193 1
1 407 . 1 1 1 A 32 32 TYR CB C 32 39.100 39.104 -0.004 1
1 410 . 1 1 1 A 32 32 TYR N N 32 117.400 120.850 -3.450 1
1 411 . 1 1 1 A 33 33 GLU H H 33 7.400 7.808 -0.408 1
1 412 . 1 1 1 A 33 33 GLU HA H 33 4.050 4.305 -0.255 1
1 417 . 1 1 1 A 33 33 GLU C C 33 180.200 179.307 0.893 1
1 418 . 1 1 1 A 33 33 GLU CA C 33 59.500 59.058 0.442 1
1 419 . 1 1 1 A 33 33 GLU CB C 33 29.300 30.093 -0.793 1
1 421 . 1 1 1 A 33 33 GLU N N 33 116.100 118.887 -2.787 1
1 422 . 1 1 1 A 34 34 VAL H H 34 8.530 7.992 0.538 1
1 423 . 1 1 1 A 34 34 VAL HA H 34 3.350 3.577 -0.227 1
1 431 . 1 1 1 A 34 34 VAL C C 34 175.800 178.400 -2.600 1
1 432 . 1 1 1 A 34 34 VAL CA C 34 66.400 66.197 0.203 1
1 433 . 1 1 1 A 34 34 VAL CB C 34 32.200 31.629 0.571 1
1 436 . 1 1 1 A 34 34 VAL N N 34 120.600 120.364 0.236 1
1 437 . 1 1 1 A 35 35 TRP H H 35 9.100 8.464 0.636 1
1 438 . 1 1 1 A 35 35 TRP HA H 35 3.340 3.591 -0.251 1
1 447 . 1 1 1 A 35 35 TRP C C 35 178.000 178.226 -0.226 1
1 448 . 1 1 1 A 35 35 TRP CA C 35 61.800 60.769 1.031 1
1 449 . 1 1 1 A 35 35 TRP CB C 35 27.900 29.245 -1.345 1
1 455 . 1 1 1 A 35 35 TRP N N 35 121.700 121.846 -0.146 1
1 457 . 1 1 1 A 36 36 LYS H H 36 7.970 7.667 0.303 1
1 458 . 1 1 1 A 36 36 LYS HA H 36 3.330 3.500 -0.170 1
1 467 . 1 1 1 A 36 36 LYS C C 36 180.000 178.288 1.712 1
1 468 . 1 1 1 A 36 36 LYS CA C 36 59.000 58.575 0.425 1
1 469 . 1 1 1 A 36 36 LYS CB C 36 31.800 31.853 -0.053 1
1 473 . 1 1 1 A 36 36 LYS N N 36 116.300 118.305 -2.005 1
1 474 . 1 1 1 A 37 37 TYR H H 37 7.750 7.809 -0.059 1
1 475 . 1 1 1 A 37 37 TYR HA H 37 3.940 3.929 0.011 1
1 480 . 1 1 1 A 37 37 TYR C C 37 177.600 177.593 0.007 1
1 481 . 1 1 1 A 37 37 TYR CA C 37 61.200 60.921 0.279 1
1 482 . 1 1 1 A 37 37 TYR CB C 37 38.800 38.468 0.332 1
1 485 . 1 1 1 A 37 37 TYR N N 37 122.700 121.540 1.160 1
1 486 . 1 1 1 A 38 38 VAL H H 38 7.660 7.253 0.407 1
1 487 . 1 1 1 A 38 38 VAL HA H 38 3.870 3.879 -0.009 1
1 495 . 1 1 1 A 38 38 VAL C C 38 175.600 175.709 -0.109 1
1 496 . 1 1 1 A 38 38 VAL CA C 38 61.100 61.162 -0.062 1
1 497 . 1 1 1 A 38 38 VAL CB C 38 30.700 31.286 -0.586 1
1 500 . 1 1 1 A 38 38 VAL N N 38 108.200 112.818 -4.618 1
1 501 . 1 1 1 A 39 39 GLY H H 39 7.090 7.455 -0.365 1
1 502 . 1 1 1 A 39 39 GLY HA2 H 39 3.320 3.659 -0.339 1
1 503 . 1 1 1 A 39 39 GLY HA3 H 39 3.730 3.702 0.028 1
1 504 . 1 1 1 A 39 39 GLY C C 39 173.600 174.253 -0.653 1
1 505 . 1 1 1 A 39 39 GLY CA C 39 46.100 45.026 1.074 1
1 506 . 1 1 1 A 39 39 GLY N N 39 107.600 110.023 -2.423 1
1 507 . 1 1 1 A 40 40 GLU H H 40 7.730 8.154 -0.424 1
1 508 . 1 1 1 A 40 40 GLU HA H 40 1.090 3.246 -2.156 1
1 513 . 1 1 1 A 40 40 GLU CA C 40 55.700 56.348 -0.648 1
1 514 . 1 1 1 A 40 40 GLU CB C 40 27.200 26.112 1.088 1
1 516 . 1 1 1 A 40 40 GLU N N 40 114.400 118.091 -3.691 1
1 517 . 1 1 1 A 41 41 PRO HA H 41 4.310 4.587 -0.277 1
1 524 . 1 1 1 A 41 41 PRO CA C 41 62.300 62.305 -0.005 1
1 525 . 1 1 1 A 41 41 PRO CB C 41 32.700 32.843 -0.143 1
1 528 . 1 1 1 A 42 42 GLU H H 42 8.110 8.721 -0.611 1
1 529 . 1 1 1 A 42 42 GLU C C 42 175.800 176.284 -0.484 1
1 530 . 1 1 1 A 42 42 GLU CA C 42 57.800 56.775 1.025 1
1 531 . 1 1 1 A 42 42 GLU CB C 42 30.600 30.515 0.085 1
1 533 . 1 1 1 A 42 42 GLU N N 42 119.100 120.265 -1.165 1
1 534 . 1 1 1 A 43 43 LEU H H 43 8.140 8.680 -0.540 1
1 535 . 1 1 1 A 43 43 LEU HA H 43 4.840 4.843 -0.003 1
1 545 . 1 1 1 A 43 43 LEU C C 43 177.300 175.822 1.478 1
1 546 . 1 1 1 A 43 43 LEU CA C 43 53.700 53.290 0.410 1
1 547 . 1 1 1 A 43 43 LEU CB C 43 43.900 44.240 -0.340 1
1 551 . 1 1 1 A 43 43 LEU N N 43 124.700 124.926 -0.226 1
1 552 . 1 1 1 A 44 44 LYS H H 44 8.640 8.632 0.008 1
1 553 . 1 1 1 A 44 44 LYS HA H 44 4.500 4.813 -0.313 1
1 562 . 1 1 1 A 44 44 LYS C C 44 174.500 175.307 -0.807 1
1 563 . 1 1 1 A 44 44 LYS CA C 44 54.700 54.501 0.199 1
1 564 . 1 1 1 A 44 44 LYS CB C 44 36.200 33.936 2.264 1
1 568 . 1 1 1 A 44 44 LYS N N 44 123.300 123.562 -0.262 1
1 569 . 1 1 1 A 45 45 THR H H 45 7.990 8.747 -0.757 1
1 570 . 1 1 1 A 45 45 THR HA H 45 5.700 5.300 0.400 1
1 575 . 1 1 1 A 45 45 THR C C 45 175.100 173.751 1.349 1
1 576 . 1 1 1 A 45 45 THR CA C 45 59.600 59.887 -0.287 1
1 577 . 1 1 1 A 45 45 THR CB C 45 73.400 70.424 2.976 1
1 579 . 1 1 1 A 45 45 THR N N 45 106.900 116.815 -9.915 1
1 580 . 1 1 1 A 46 46 TYR H H 46 8.470 9.265 -0.795 1
1 581 . 1 1 1 A 46 46 TYR HA H 46 4.930 5.692 -0.762 1
1 586 . 1 1 1 A 46 46 TYR C C 46 172.400 173.585 -1.185 1
1 587 . 1 1 1 A 46 46 TYR CA C 46 57.100 55.316 1.784 1
1 588 . 1 1 1 A 46 46 TYR CB C 46 40.200 42.025 -1.825 1
1 591 . 1 1 1 A 46 46 TYR N N 46 117.100 119.047 -1.947 1
1 592 . 1 1 1 A 47 47 VAL H H 47 8.430 8.935 -0.505 1
1 593 . 1 1 1 A 47 47 VAL HA H 47 4.890 4.541 0.349 1
1 601 . 1 1 1 A 47 47 VAL C C 47 175.800 174.234 1.566 1
1 602 . 1 1 1 A 47 47 VAL CA C 47 60.800 61.339 -0.539 1
1 603 . 1 1 1 A 47 47 VAL CB C 47 34.800 33.290 1.510 1
1 606 . 1 1 1 A 47 47 VAL N N 47 119.200 121.187 -1.987 1
1 607 . 1 1 1 A 48 48 ILE H H 48 8.680 8.986 -0.306 1
1 608 . 1 1 1 A 48 48 ILE HA H 48 4.560 4.832 -0.272 1
1 618 . 1 1 1 A 48 48 ILE C C 48 174.500 174.206 0.294 1
1 619 . 1 1 1 A 48 48 ILE CA C 48 59.700 59.698 0.002 1
1 620 . 1 1 1 A 48 48 ILE CB C 48 41.500 41.487 0.013 1
1 624 . 1 1 1 A 48 48 ILE N N 48 124.400 129.127 -4.727 1
1 625 . 1 1 1 A 49 49 GLU H H 49 8.320 8.949 -0.629 1
1 626 . 1 1 1 A 49 49 GLU C C 49 175.500 174.957 0.543 1
1 627 . 1 1 1 A 49 49 GLU CA C 49 55.500 56.215 -0.715 1
1 628 . 1 1 1 A 49 49 GLU CB C 49 31.800 29.712 2.088 1
1 630 . 1 1 1 A 49 49 GLU N N 49 123.400 128.824 -5.424 1
1 631 . 1 1 1 A 50 50 ASP H H 50 8.610 9.261 -0.651 1
1 632 . 1 1 1 A 50 50 ASP C C 50 175.100 174.454 0.646 1
1 633 . 1 1 1 A 50 50 ASP CA C 50 53.100 52.547 0.553 1
1 634 . 1 1 1 A 50 50 ASP CB C 50 44.000 42.829 1.171 1
1 635 . 1 1 1 A 50 50 ASP N N 50 124.300 127.123 -2.823 1
1 636 . 1 1 1 A 51 51 GLU H H 51 8.450 8.838 -0.388 1
1 637 . 1 1 1 A 51 51 GLU C C 51 175.900 175.436 0.464 1
1 638 . 1 1 1 A 51 51 GLU CA C 51 56.000 55.859 0.141 1
1 639 . 1 1 1 A 51 51 GLU CB C 51 31.700 31.016 0.684 1
1 640 . 1 1 1 A 51 51 GLU N N 51 121.300 126.173 -4.873 1
1 641 . 1 1 1 A 52 52 ILE H H 52 8.480 8.718 -0.238 1
1 642 . 1 1 1 A 52 52 ILE C C 52 175.400 174.877 0.523 1
1 643 . 1 1 1 A 52 52 ILE CA C 52 60.400 60.635 -0.235 1
1 644 . 1 1 1 A 52 52 ILE CB C 52 40.000 39.425 0.575 1
1 645 . 1 1 1 A 52 52 ILE N N 52 122.700 126.061 -3.361 1
1 646 . 1 1 1 A 53 53 VAL H H 53 8.140 8.589 -0.449 1
1 647 . 1 1 1 A 53 53 VAL C C 53 175.600 175.199 0.401 1
1 648 . 1 1 1 A 53 53 VAL CA C 53 61.900 60.839 1.061 1
1 649 . 1 1 1 A 53 53 VAL CB C 53 33.200 33.309 -0.109 1
1 650 . 1 1 1 A 53 53 VAL N N 53 124.400 128.861 -4.461 1
1 651 . 1 1 1 A 54 54 GLU H H 54 8.540 8.486 0.054 1
1 652 . 1 1 1 A 54 54 GLU CA C 54 55.600 54.370 1.230 1
1 653 . 1 1 1 A 54 54 GLU CB C 54 34.300 30.262 4.038 1
1 654 . 1 1 1 A 54 54 GLU N N 54 125.900 124.650 1.250 1
1 655 . 1 1 1 A 55 55 PRO C C 55 177.500 177.261 0.239 1
1 656 . 1 1 1 A 55 55 PRO CA C 55 63.400 65.240 -1.840 1
1 657 . 1 1 1 A 55 55 PRO CB C 55 32.300 31.767 0.533 1
1 658 . 1 1 1 A 56 56 GLY H H 56 8.420 7.373 1.047 1
1 659 . 1 1 1 A 56 56 GLY HA2 H 56 3.830 3.920 -0.090 1
1 660 . 1 1 1 A 56 56 GLY HA3 H 56 4.000 3.995 0.005 1
1 661 . 1 1 1 A 56 56 GLY C C 56 174.500 174.238 0.262 1
1 662 . 1 1 1 A 56 56 GLY CA C 56 45.400 45.069 0.331 1
1 663 . 1 1 1 A 56 56 GLY N N 56 109.700 105.926 3.774 1
1 664 . 1 1 1 A 57 57 GLU H H 57 8.180 7.835 0.345 1
1 665 . 1 1 1 A 57 57 GLU C C 57 176.300 175.609 0.691 1
1 666 . 1 1 1 A 57 57 GLU CA C 57 57.500 56.623 0.877 1
1 667 . 1 1 1 A 57 57 GLU CB C 57 30.400 30.306 0.094 1
1 668 . 1 1 1 A 57 57 GLU N N 57 120.900 120.332 0.568 1
1 669 . 1 1 1 A 58 58 TYR H H 58 8.020 9.008 -0.988 1
1 670 . 1 1 1 A 58 58 TYR C C 58 175.100 175.275 -0.175 1
1 671 . 1 1 1 A 58 58 TYR CA C 58 57.400 56.905 0.495 1
1 672 . 1 1 1 A 58 58 TYR CB C 58 38.900 37.181 1.719 1
1 673 . 1 1 1 A 58 58 TYR N N 58 118.800 124.961 -6.161 1
1 674 . 1 1 1 A 59 59 ASP H H 59 7.950 8.870 -0.920 1
1 675 . 1 1 1 A 59 59 ASP CA C 59 52.700 55.521 -2.821 1
1 676 . 1 1 1 A 59 59 ASP CB C 59 41.000 43.532 -2.532 1
1 677 . 1 1 1 A 59 59 ASP N N 59 123.500 126.346 -2.846 1
1 678 . 1 1 1 A 61 61 PRO HA H 61 4.510 4.552 -0.042 1
1 685 . 1 1 1 A 61 61 PRO C C 61 176.500 176.580 -0.080 1
1 686 . 1 1 1 A 61 61 PRO CA C 61 63.700 62.886 0.814 1
1 687 . 1 1 1 A 61 61 PRO CB C 61 34.200 31.854 2.346 1
1 690 . 1 1 1 A 62 62 GLU H H 62 8.490 8.583 -0.093 1
1 691 . 1 1 1 A 62 62 GLU N N 62 124.600 122.260 2.340 1
1 692 . 1 1 1 A 64 64 LYS C C 64 176.300 175.135 1.165 1
1 693 . 1 1 1 A 64 64 LYS CA C 64 57.000 56.395 0.605 1
1 694 . 1 1 1 A 64 64 LYS CB C 64 33.100 33.619 -0.519 1
1 695 . 1 1 1 A 65 65 TYR H H 65 7.960 8.869 -0.909 1
1 696 . 1 1 1 A 65 65 TYR C C 65 176.000 175.051 0.949 1
1 697 . 1 1 1 A 65 65 TYR CA C 65 57.800 55.436 2.364 1
1 698 . 1 1 1 A 65 65 TYR CB C 65 38.800 41.159 -2.359 1
1 699 . 1 1 1 A 65 65 TYR N N 65 119.300 124.368 -5.068 1
1 700 . 1 1 1 A 66 66 THR H H 66 7.820 8.511 -0.691 1
1 701 . 1 1 1 A 66 66 THR HA H 66 4.280 4.180 0.100 1
1 706 . 1 1 1 A 66 66 THR C C 66 174.100 175.026 -0.926 1
1 707 . 1 1 1 A 66 66 THR CA C 66 62.100 62.305 -0.205 1
1 708 . 1 1 1 A 66 66 THR CB C 66 70.000 69.626 0.374 1
1 710 . 1 1 1 A 66 66 THR N N 66 113.900 120.884 -6.984 1
1 711 . 1 1 1 A 67 67 ASN H H 67 8.270 8.945 -0.675 1
1 712 . 1 1 1 A 67 67 ASN C C 67 174.100 174.189 -0.089 1
1 713 . 1 1 1 A 67 67 ASN CA C 67 53.400 51.430 1.970 1
1 714 . 1 1 1 A 67 67 ASN CB C 67 39.300 42.092 -2.792 1
1 715 . 1 1 1 A 67 67 ASN N N 67 121.400 120.320 1.080 1
1 716 . 1 1 1 A 68 68 VAL H H 68 7.660 8.577 -0.917 1
1 717 . 1 1 1 A 68 68 VAL C C 68 175.500 175.472 0.028 1
1 718 . 1 1 1 A 68 68 VAL CA C 68 61.800 61.677 0.123 1
1 719 . 1 1 1 A 68 68 VAL CB C 68 33.700 32.838 0.862 1
1 720 . 1 1 1 A 68 68 VAL N N 68 119.400 118.742 0.658 1
1 721 . 1 1 1 A 69 69 LYS H H 69 8.690 8.282 0.408 1
1 722 . 1 1 1 A 69 69 LYS C C 69 175.200 174.953 0.247 1
1 723 . 1 1 1 A 69 69 LYS CA C 69 55.200 54.540 0.660 1
1 724 . 1 1 1 A 69 69 LYS CB C 69 35.200 35.715 -0.515 1
1 725 . 1 1 1 A 69 69 LYS N N 69 126.500 122.264 4.236 1
1 726 . 1 1 1 A 70 70 LYS H H 70 8.230 8.690 -0.460 1
1 727 . 1 1 1 A 70 70 LYS C C 70 176.400 174.899 1.501 1
1 728 . 1 1 1 A 70 70 LYS CA C 70 55.600 55.758 -0.158 1
1 729 . 1 1 1 A 70 70 LYS CB C 70 33.800 33.351 0.449 1
1 730 . 1 1 1 A 70 70 LYS N N 70 122.700 124.481 -1.781 1
1 731 . 1 1 1 A 71 71 VAL H H 71 8.530 8.684 -0.154 1
1 732 . 1 1 1 A 71 71 VAL HA H 71 4.510 4.461 0.049 1
1 733 . 1 1 1 A 71 71 VAL C C 71 174.700 175.134 -0.434 1
1 734 . 1 1 1 A 71 71 VAL CA C 71 60.900 61.859 -0.959 1
1 735 . 1 1 1 A 71 71 VAL CB C 71 34.800 31.175 3.625 1
1 738 . 1 1 1 A 71 71 VAL N N 71 121.200 127.980 -6.780 1
1 739 . 1 1 1 A 72 72 LYS H H 72 8.210 8.391 -0.181 1
1 740 . 1 1 1 A 72 72 LYS HA H 72 4.800 4.534 0.266 1
1 747 . 1 1 1 A 72 72 LYS C C 72 176.200 175.235 0.965 1
1 748 . 1 1 1 A 72 72 LYS CA C 72 55.700 55.561 0.139 1
1 749 . 1 1 1 A 72 72 LYS CB C 72 33.700 32.491 1.209 1
1 752 . 1 1 1 A 72 72 LYS N N 72 123.600 125.212 -1.612 1
1 753 . 1 1 1 A 73 73 ILE H H 73 8.890 8.835 0.055 1
1 754 . 1 1 1 A 73 73 ILE C C 73 174.400 174.063 0.337 1
1 755 . 1 1 1 A 73 73 ILE CA C 73 60.400 59.801 0.599 1
1 756 . 1 1 1 A 73 73 ILE CB C 73 40.800 40.700 0.100 1
1 760 . 1 1 1 A 73 73 ILE N N 73 125.100 126.183 -1.083 1
1 761 . 1 1 1 A 74 74 LYS H H 74 8.420 8.943 -0.523 1
1 762 . 1 1 1 A 74 74 LYS HA H 74 4.800 4.834 -0.034 1
1 771 . 1 1 1 A 74 74 LYS C C 74 175.600 175.138 0.462 1
1 772 . 1 1 1 A 74 74 LYS CA C 74 56.200 55.115 1.085 1
1 773 . 1 1 1 A 74 74 LYS CB C 74 34.300 33.890 0.410 1
1 777 . 1 1 1 A 74 74 LYS N N 74 126.400 130.549 -4.149 1
1 778 . 1 1 1 A 75 75 LYS H H 75 9.090 8.779 0.311 1
1 779 . 1 1 1 A 75 75 LYS HA H 75 4.800 4.960 -0.160 1
1 788 . 1 1 1 A 75 75 LYS C C 75 174.900 174.649 0.251 1
1 789 . 1 1 1 A 75 75 LYS CA C 75 53.200 54.360 -1.160 1
1 790 . 1 1 1 A 75 75 LYS CB C 75 34.200 35.887 -1.687 1
1 794 . 1 1 1 A 75 75 LYS N N 75 127.500 126.004 1.496 1
1 795 . 1 1 1 A 76 76 VAL H H 76 8.610 8.704 -0.094 1
1 796 . 1 1 1 A 76 76 VAL HA H 76 5.340 4.918 0.422 1
1 804 . 1 1 1 A 76 76 VAL C C 76 171.400 173.797 -2.397 1
1 805 . 1 1 1 A 76 76 VAL CA C 76 58.000 59.465 -1.465 1
1 806 . 1 1 1 A 76 76 VAL CB C 76 36.400 35.289 1.111 1
1 809 . 1 1 1 A 76 76 VAL N N 76 120.100 120.860 -0.760 1
1 810 . 1 1 1 A 77 77 TYR H H 77 9.110 8.891 0.219 1
1 811 . 1 1 1 A 77 77 TYR HA H 77 6.150 5.718 0.432 1
1 816 . 1 1 1 A 77 77 TYR C C 77 173.600 173.049 0.551 1
1 817 . 1 1 1 A 77 77 TYR CA C 77 56.200 55.741 0.459 1
1 818 . 1 1 1 A 77 77 TYR CB C 77 44.000 40.877 3.123 1
1 821 . 1 1 1 A 77 77 TYR N N 77 121.300 121.919 -0.619 1
1 822 . 1 1 1 A 78 78 PHE H H 78 8.190 8.696 -0.506 1
1 823 . 1 1 1 A 78 78 PHE HA H 78 5.130 5.694 -0.564 1
1 829 . 1 1 1 A 78 78 PHE C C 78 173.600 172.982 0.618 1
1 830 . 1 1 1 A 78 78 PHE CA C 78 55.900 55.231 0.669 1
1 831 . 1 1 1 A 78 78 PHE CB C 78 42.500 42.812 -0.312 1
1 835 . 1 1 1 A 78 78 PHE N N 78 112.700 117.002 -4.302 1
1 836 . 1 1 1 A 79 79 GLU H H 79 8.920 8.876 0.044 1
1 837 . 1 1 1 A 79 79 GLU HA H 79 5.390 5.151 0.239 1
1 842 . 1 1 1 A 79 79 GLU C C 79 177.000 176.878 0.122 1
1 843 . 1 1 1 A 79 79 GLU CA C 79 54.900 55.259 -0.359 1
1 844 . 1 1 1 A 79 79 GLU CB C 79 33.600 31.574 2.026 1
1 846 . 1 1 1 A 79 79 GLU N N 79 120.500 119.960 0.540 1
1 847 . 1 1 1 A 80 80 THR H H 80 8.970 8.921 0.049 1
1 848 . 1 1 1 A 80 80 THR HA H 80 4.700 4.842 -0.142 1
1 854 . 1 1 1 A 80 80 THR C C 80 177.000 176.100 0.900 1
1 855 . 1 1 1 A 80 80 THR CA C 80 61.300 60.735 0.565 1
1 856 . 1 1 1 A 80 80 THR CB C 80 70.500 71.801 -1.301 1
1 858 . 1 1 1 A 80 80 THR N N 80 113.200 115.771 -2.571 1
1 859 . 1 1 1 A 81 81 LEU H H 81 8.610 8.956 -0.346 1
1 860 . 1 1 1 A 81 81 LEU HA H 81 4.230 4.053 0.177 1
1 870 . 1 1 1 A 81 81 LEU C C 81 177.400 177.768 -0.368 1
1 871 . 1 1 1 A 81 81 LEU CA C 81 57.700 57.447 0.253 1
1 872 . 1 1 1 A 81 81 LEU CB C 81 42.400 41.624 0.776 1
1 876 . 1 1 1 A 81 81 LEU N N 81 120.900 122.190 -1.290 1
1 877 . 1 1 1 A 82 82 ASP H H 82 8.850 7.917 0.933 1
1 878 . 1 1 1 A 82 82 ASP HA H 82 4.670 4.745 -0.075 1
1 881 . 1 1 1 A 82 82 ASP C C 82 174.100 175.116 -1.016 1
1 882 . 1 1 1 A 82 82 ASP CA C 82 52.700 53.749 -1.049 1
1 883 . 1 1 1 A 82 82 ASP CB C 82 37.900 41.036 -3.136 1
1 884 . 1 1 1 A 82 82 ASP N N 82 112.300 117.243 -4.943 1
1 885 . 1 1 1 A 83 83 ASN H H 83 7.790 7.973 -0.183 1
1 886 . 1 1 1 A 83 83 ASN HA H 83 4.270 4.378 -0.108 1
1 891 . 1 1 1 A 83 83 ASN C C 83 176.100 174.932 1.168 1
1 892 . 1 1 1 A 83 83 ASN CA C 83 55.300 54.470 0.830 1
1 893 . 1 1 1 A 83 83 ASN CB C 83 36.900 37.365 -0.465 1
1 894 . 1 1 1 A 83 83 ASN N N 83 113.000 114.724 -1.724 1
1 896 . 1 1 1 A 84 84 VAL H H 84 7.660 7.553 0.107 1
1 897 . 1 1 1 A 84 84 VAL HA H 84 4.270 4.012 0.258 1
1 905 . 1 1 1 A 84 84 VAL C C 84 175.800 175.113 0.687 1
1 906 . 1 1 1 A 84 84 VAL CA C 84 61.500 62.597 -1.097 1
1 907 . 1 1 1 A 84 84 VAL CB C 84 33.500 32.034 1.466 1
1 910 . 1 1 1 A 84 84 VAL N N 84 119.700 119.553 0.147 1
1 911 . 1 1 1 A 85 85 ARG H H 85 8.180 9.161 -0.981 1
1 912 . 1 1 1 A 85 85 ARG HA H 85 4.870 4.744 0.126 1
1 920 . 1 1 1 A 85 85 ARG C C 85 174.000 174.863 -0.863 1
1 921 . 1 1 1 A 85 85 ARG CA C 85 55.700 55.361 0.339 1
1 922 . 1 1 1 A 85 85 ARG CB C 85 32.600 30.610 1.990 1
1 925 . 1 1 1 A 85 85 ARG N N 85 124.800 127.750 -2.950 1
1 927 . 1 1 1 A 86 86 VAL H H 86 8.570 8.339 0.231 1
1 928 . 1 1 1 A 86 86 VAL HA H 86 4.580 4.568 0.012 1
1 936 . 1 1 1 A 86 86 VAL C C 86 175.700 175.483 0.217 1
1 937 . 1 1 1 A 86 86 VAL CA C 86 61.700 62.427 -0.727 1
1 938 . 1 1 1 A 86 86 VAL CB C 86 30.900 30.894 0.006 1
1 941 . 1 1 1 A 86 86 VAL N N 86 127.300 125.182 2.118 1
1 942 . 1 1 1 A 87 87 VAL H H 87 8.790 8.537 0.253 1
1 943 . 1 1 1 A 87 87 VAL HA H 87 5.010 4.800 0.210 1
1 951 . 1 1 1 A 87 87 VAL C C 87 175.500 174.878 0.622 1
1 952 . 1 1 1 A 87 87 VAL CA C 87 61.900 61.114 0.786 1
1 953 . 1 1 1 A 87 87 VAL CB C 87 36.300 32.834 3.466 1
1 956 . 1 1 1 A 87 87 VAL N N 87 125.700 128.533 -2.833 1
1 957 . 1 1 1 A 88 88 THR H H 88 8.350 8.736 -0.386 1
1 958 . 1 1 1 A 88 88 THR HA H 88 4.620 4.568 0.052 1
1 964 . 1 1 1 A 88 88 THR C C 88 173.300 173.227 0.073 1
1 965 . 1 1 1 A 88 88 THR CA C 88 61.700 60.641 1.059 1
1 966 . 1 1 1 A 88 88 THR CB C 88 70.400 71.942 -1.542 1
1 968 . 1 1 1 A 88 88 THR N N 88 117.500 121.230 -3.730 1
1 969 . 1 1 1 A 89 89 ASP H H 89 7.700 8.483 -0.783 1
1 970 . 1 1 1 A 89 89 ASP HA H 89 4.480 4.646 -0.166 1
1 973 . 1 1 1 A 89 89 ASP C C 89 175.900 176.315 -0.415 1
1 974 . 1 1 1 A 89 89 ASP CA C 89 55.900 55.172 0.728 1
1 975 . 1 1 1 A 89 89 ASP CB C 89 43.900 40.816 3.084 1
1 976 . 1 1 1 A 89 89 ASP N N 89 120.800 124.359 -3.559 1
1 977 . 1 1 1 A 90 90 TYR H H 90 8.240 8.988 -0.748 1
1 978 . 1 1 1 A 90 90 TYR HA H 90 3.920 4.103 -0.183 1
1 983 . 1 1 1 A 90 90 TYR C C 90 176.400 177.518 -1.118 1
1 984 . 1 1 1 A 90 90 TYR CA C 90 62.300 61.694 0.606 1
1 985 . 1 1 1 A 90 90 TYR CB C 90 39.500 38.669 0.831 1
1 988 . 1 1 1 A 90 90 TYR N N 90 126.100 126.472 -0.372 1
1 989 . 1 1 1 A 91 91 SER H H 91 9.160 8.547 0.613 1
1 990 . 1 1 1 A 91 91 SER HA H 91 4.000 4.170 -0.170 1
1 993 . 1 1 1 A 91 91 SER C C 91 178.000 176.544 1.456 1
1 994 . 1 1 1 A 91 91 SER CA C 91 62.600 61.561 1.039 1
1 995 . 1 1 1 A 91 91 SER CB C 91 62.200 62.509 -0.309 1
1 996 . 1 1 1 A 91 91 SER N N 91 116.600 114.590 2.010 1
1 997 . 1 1 1 A 92 92 GLU H H 92 8.590 8.113 0.477 1
1 998 . 1 1 1 A 92 92 GLU HA H 92 4.050 4.091 -0.041 1
1 1003 . 1 1 1 A 92 92 GLU C C 92 179.400 178.764 0.636 1
1 1004 . 1 1 1 A 92 92 GLU CA C 92 58.900 59.088 -0.188 1
1 1005 . 1 1 1 A 92 92 GLU CB C 92 30.600 29.084 1.516 1
1 1007 . 1 1 1 A 92 92 GLU N N 92 120.200 122.779 -2.579 1
1 1008 . 1 1 1 A 93 93 PHE H H 93 7.870 8.330 -0.460 1
1 1009 . 1 1 1 A 93 93 PHE HA H 93 4.050 4.178 -0.128 1
1 1015 . 1 1 1 A 93 93 PHE C C 93 176.500 177.533 -1.033 1
1 1016 . 1 1 1 A 93 93 PHE CA C 93 62.200 61.367 0.833 1
1 1017 . 1 1 1 A 93 93 PHE CB C 93 39.700 39.189 0.511 1
1 1021 . 1 1 1 A 93 93 PHE N N 93 120.200 120.612 -0.412 1
1 1022 . 1 1 1 A 94 94 GLN H H 94 8.190 8.058 0.132 1
1 1023 . 1 1 1 A 94 94 GLN HA H 94 3.390 3.598 -0.208 1
1 1030 . 1 1 1 A 94 94 GLN C C 94 178.600 178.209 0.391 1
1 1031 . 1 1 1 A 94 94 GLN CA C 94 58.800 59.117 -0.317 1
1 1032 . 1 1 1 A 94 94 GLN CB C 94 28.400 28.087 0.313 1
1 1034 . 1 1 1 A 94 94 GLN N N 94 116.800 118.077 -1.277 1
1 1036 . 1 1 1 A 95 95 LYS H H 95 7.060 7.585 -0.525 1
1 1037 . 1 1 1 A 95 95 LYS HA H 95 3.780 4.051 -0.271 1
1 1046 . 1 1 1 A 95 95 LYS C C 95 179.300 178.975 0.325 1
1 1047 . 1 1 1 A 95 95 LYS CA C 95 59.900 58.970 0.930 1
1 1048 . 1 1 1 A 95 95 LYS CB C 95 32.700 32.240 0.460 1
1 1052 . 1 1 1 A 95 95 LYS N N 95 117.500 120.985 -3.485 1
1 1053 . 1 1 1 A 96 96 ILE H H 96 7.240 7.810 -0.570 1
1 1054 . 1 1 1 A 96 96 ILE HA H 96 3.420 3.563 -0.143 1
1 1064 . 1 1 1 A 96 96 ILE C C 96 177.800 178.551 -0.751 1
1 1065 . 1 1 1 A 96 96 ILE CA C 96 64.300 64.970 -0.670 1
1 1066 . 1 1 1 A 96 96 ILE CB C 96 37.400 37.270 0.130 1
1 1070 . 1 1 1 A 96 96 ILE N N 96 120.700 120.063 0.637 1
1 1071 . 1 1 1 A 97 97 LEU H H 97 7.690 8.045 -0.355 1
1 1072 . 1 1 1 A 97 97 LEU HA H 97 3.580 3.584 -0.004 1
1 1082 . 1 1 1 A 97 97 LEU C C 97 179.900 179.058 0.842 1
1 1083 . 1 1 1 A 97 97 LEU CA C 97 58.100 58.283 -0.183 1
1 1084 . 1 1 1 A 97 97 LEU CB C 97 41.500 41.738 -0.238 1
1 1088 . 1 1 1 A 97 97 LEU N N 97 120.000 121.485 -1.485 1
1 1089 . 1 1 1 A 98 98 LYS H H 98 7.510 8.212 -0.702 1
1 1090 . 1 1 1 A 98 98 LYS HA H 98 3.950 3.990 -0.040 1
1 1099 . 1 1 1 A 98 98 LYS C C 98 178.700 179.110 -0.410 1
1 1100 . 1 1 1 A 98 98 LYS CA C 98 58.700 59.511 -0.811 1
1 1101 . 1 1 1 A 98 98 LYS CB C 98 32.500 31.807 0.693 1
1 1105 . 1 1 1 A 98 98 LYS N N 98 117.300 117.221 0.079 1
1 1106 . 1 1 1 A 99 99 LYS H H 99 7.470 7.638 -0.168 1
1 1107 . 1 1 1 A 99 99 LYS HA H 99 4.080 3.938 0.142 1
1 1116 . 1 1 1 A 99 99 LYS C C 99 178.100 179.157 -1.057 1
1 1117 . 1 1 1 A 99 99 LYS CA C 99 58.400 59.645 -1.245 1
1 1118 . 1 1 1 A 99 99 LYS CB C 99 33.000 32.016 0.984 1
1 1122 . 1 1 1 A 99 99 LYS N N 99 119.000 119.853 -0.853 1
1 1123 . 1 1 1 A 100 100 ARG H H 100 8.020 7.703 0.317 1
1 1124 . 1 1 1 A 100 100 ARG HA H 100 4.210 4.313 -0.103 1
1 1131 . 1 1 1 A 100 100 ARG C C 100 177.500 176.469 1.031 1
1 1132 . 1 1 1 A 100 100 ARG CA C 100 56.700 55.762 0.938 1
1 1133 . 1 1 1 A 100 100 ARG CB C 100 30.500 30.683 -0.183 1
1 1136 . 1 1 1 A 100 100 ARG N N 100 117.300 115.963 1.337 1
1 1137 . 1 1 1 A 101 101 GLY H H 101 7.910 7.786 0.124 1
1 1138 . 1 1 1 A 101 101 GLY HA2 H 101 3.980 3.962 0.018 1
1 1139 . 1 1 1 A 101 101 GLY HA3 H 101 4.020 3.972 0.048 1
1 1140 . 1 1 1 A 101 101 GLY C C 101 174.400 174.526 -0.126 1
1 1141 . 1 1 1 A 101 101 GLY CA C 101 46.000 46.351 -0.351 1
1 1142 . 1 1 1 A 101 101 GLY N N 101 108.000 108.481 -0.481 1
1 1143 . 1 1 1 A 102 102 THR H H 102 7.880 8.316 -0.436 1
1 1144 . 1 1 1 A 102 102 THR HA H 102 4.360 4.181 0.179 1
1 1149 . 1 1 1 A 102 102 THR C C 102 174.400 173.821 0.579 1
1 1150 . 1 1 1 A 102 102 THR CA C 102 62.100 63.292 -1.192 1
1 1151 . 1 1 1 A 102 102 THR CB C 102 70.500 68.157 2.343 1
1 1153 . 1 1 1 A 102 102 THR N N 102 113.900 116.809 -2.909 1
1 1154 . 1 1 1 A 103 103 LYS H H 103 8.440 8.826 -0.386 1
1 1155 . 1 1 1 A 103 103 LYS C C 103 176.400 175.523 0.877 1
1 1156 . 1 1 1 A 103 103 LYS CA C 103 56.600 56.304 0.296 1
1 1157 . 1 1 1 A 103 103 LYS CB C 103 33.300 33.287 0.013 1
1 1158 . 1 1 1 A 103 103 LYS N N 103 124.000 127.945 -3.945 1
1 1159 . 1 1 1 A 104 104 LEU H H 104 8.180 9.008 -0.828 1
1 1160 . 1 1 1 A 104 104 LEU HA H 104 4.270 4.852 -0.582 1
1 1170 . 1 1 1 A 104 104 LEU C C 104 177.100 176.761 0.339 1
1 1171 . 1 1 1 A 104 104 LEU CA C 104 55.500 54.321 1.179 1
1 1172 . 1 1 1 A 104 104 LEU CB C 104 42.500 42.003 0.497 1
1 1176 . 1 1 1 A 104 104 LEU N N 104 123.500 128.754 -5.254 1
1 1177 . 1 1 1 A 105 105 GLU H H 105 8.270 9.038 -0.768 1
1 1178 . 1 1 1 A 105 105 GLU CA C 105 56.700 56.971 -0.271 1
1 1179 . 1 1 1 A 105 105 GLU CB C 105 30.800 30.318 0.482 1
1 13 . 2 1 1 A 2 2 ASN HA H 2 4.980 5.119 -0.139 1
1 18 . 2 1 1 A 2 2 ASN C C 2 176.300 175.476 0.824 1
1 19 . 2 1 1 A 2 2 ASN CA C 2 52.500 51.336 1.164 1
1 20 . 2 1 1 A 2 2 ASN CB C 2 40.900 41.432 -0.532 1
1 22 . 2 1 1 A 3 3 SER H H 3 9.940 9.188 0.752 1
1 23 . 2 1 1 A 3 3 SER HA H 3 3.720 4.057 -0.337 1
1 26 . 2 1 1 A 3 3 SER C C 3 175.900 176.394 -0.494 1
1 27 . 2 1 1 A 3 3 SER CA C 3 63.300 61.725 1.575 1
1 28 . 2 1 1 A 3 3 SER CB C 3 61.700 63.095 -1.395 1
1 29 . 2 1 1 A 3 3 SER N N 3 118.200 115.637 2.563 1
1 30 . 2 1 1 A 4 4 GLU H H 4 8.450 8.270 0.180 1
1 31 . 2 1 1 A 4 4 GLU HA H 4 4.010 4.054 -0.044 1
1 36 . 2 1 1 A 4 4 GLU C C 4 178.800 179.143 -0.343 1
1 37 . 2 1 1 A 4 4 GLU CA C 4 60.300 58.954 1.346 1
1 38 . 2 1 1 A 4 4 GLU CB C 4 29.100 29.419 -0.319 1
1 40 . 2 1 1 A 4 4 GLU N N 4 123.600 122.269 1.331 1
1 41 . 2 1 1 A 5 5 VAL H H 5 7.590 7.899 -0.309 1
1 42 . 2 1 1 A 5 5 VAL HA H 5 3.850 3.609 0.241 1
1 50 . 2 1 1 A 5 5 VAL C C 5 179.100 178.494 0.606 1
1 51 . 2 1 1 A 5 5 VAL CA C 5 65.800 66.546 -0.746 1
1 52 . 2 1 1 A 5 5 VAL CB C 5 32.300 31.490 0.810 1
1 55 . 2 1 1 A 5 5 VAL N N 5 119.300 120.035 -0.735 1
1 56 . 2 1 1 A 6 6 ILE H H 6 7.240 8.124 -0.884 1
1 57 . 2 1 1 A 6 6 ILE HA H 6 3.580 3.491 0.089 1
1 67 . 2 1 1 A 6 6 ILE C C 6 177.000 177.956 -0.956 1
1 68 . 2 1 1 A 6 6 ILE CA C 6 65.300 65.717 -0.417 1
1 69 . 2 1 1 A 6 6 ILE CB C 6 37.900 37.662 0.238 1
1 73 . 2 1 1 A 6 6 ILE N N 6 120.300 120.845 -0.545 1
1 74 . 2 1 1 A 7 7 LYS H H 7 8.050 7.951 0.099 1
1 75 . 2 1 1 A 7 7 LYS HA H 7 3.570 3.232 0.338 1
1 84 . 2 1 1 A 7 7 LYS C C 7 178.700 178.882 -0.182 1
1 85 . 2 1 1 A 7 7 LYS CA C 7 61.300 60.204 1.096 1
1 86 . 2 1 1 A 7 7 LYS CB C 7 32.200 31.967 0.233 1
1 90 . 2 1 1 A 7 7 LYS N N 7 119.200 118.557 0.643 1
1 91 . 2 1 1 A 8 8 GLU H H 8 8.100 8.189 -0.089 1
1 92 . 2 1 1 A 8 8 GLU HA H 8 4.000 4.038 -0.038 1
1 97 . 2 1 1 A 8 8 GLU C C 8 178.500 178.915 -0.415 1
1 98 . 2 1 1 A 8 8 GLU CA C 8 59.700 59.576 0.124 1
1 99 . 2 1 1 A 8 8 GLU CB C 8 29.600 29.428 0.172 1
1 101 . 2 1 1 A 8 8 GLU N N 8 119.400 120.053 -0.653 1
1 102 . 2 1 1 A 9 9 PHE H H 9 7.720 8.228 -0.508 1
1 103 . 2 1 1 A 9 9 PHE HA H 9 4.160 4.060 0.100 1
1 109 . 2 1 1 A 9 9 PHE C C 9 176.900 177.092 -0.192 1
1 110 . 2 1 1 A 9 9 PHE CA C 9 61.300 61.451 -0.151 1
1 111 . 2 1 1 A 9 9 PHE CB C 9 39.400 39.052 0.348 1
1 115 . 2 1 1 A 9 9 PHE N N 9 121.300 120.170 1.130 1
1 116 . 2 1 1 A 10 10 LEU H H 10 8.060 8.462 -0.402 1
1 117 . 2 1 1 A 10 10 LEU HA H 10 3.660 3.794 -0.134 1
1 127 . 2 1 1 A 10 10 LEU C C 10 179.000 179.270 -0.270 1
1 128 . 2 1 1 A 10 10 LEU CA C 10 58.000 57.900 0.100 1
1 129 . 2 1 1 A 10 10 LEU CB C 10 41.400 41.513 -0.113 1
1 133 . 2 1 1 A 10 10 LEU N N 10 118.000 119.326 -1.326 1
1 134 . 2 1 1 A 11 11 GLU H H 11 7.990 8.468 -0.478 1
1 135 . 2 1 1 A 11 11 GLU HA H 11 4.110 4.028 0.082 1
1 140 . 2 1 1 A 11 11 GLU C C 11 174.200 179.015 -4.815 1
1 141 . 2 1 1 A 11 11 GLU CA C 11 59.200 59.949 -0.749 1
1 142 . 2 1 1 A 11 11 GLU CB C 11 29.300 29.319 -0.019 1
1 144 . 2 1 1 A 11 11 GLU N N 11 118.300 118.151 0.149 1
1 145 . 2 1 1 A 12 12 ASP H H 12 8.080 8.107 -0.027 1
1 146 . 2 1 1 A 12 12 ASP HA H 12 4.340 4.332 0.008 1
1 149 . 2 1 1 A 12 12 ASP C C 12 178.900 178.407 0.493 1
1 150 . 2 1 1 A 12 12 ASP CA C 12 57.600 57.777 -0.177 1
1 151 . 2 1 1 A 12 12 ASP CB C 12 41.000 41.371 -0.371 1
1 152 . 2 1 1 A 12 12 ASP N N 12 121.800 119.654 2.146 1
1 153 . 2 1 1 A 13 13 ILE H H 13 7.610 7.408 0.202 1
1 154 . 2 1 1 A 13 13 ILE HA H 13 4.240 3.971 0.269 1
1 164 . 2 1 1 A 13 13 ILE C C 13 176.800 176.444 0.356 1
1 165 . 2 1 1 A 13 13 ILE CA C 13 62.100 60.948 1.152 1
1 166 . 2 1 1 A 13 13 ILE CB C 13 38.300 37.076 1.224 1
1 170 . 2 1 1 A 13 13 ILE N N 13 110.800 112.324 -1.524 1
1 171 . 2 1 1 A 14 14 GLY H H 14 7.640 7.621 0.019 1
1 172 . 2 1 1 A 14 14 GLY HA2 H 14 3.810 3.893 -0.083 1
1 173 . 2 1 1 A 14 14 GLY HA3 H 14 3.880 3.901 -0.021 1
1 174 . 2 1 1 A 14 14 GLY C C 14 175.200 174.477 0.723 1
1 175 . 2 1 1 A 14 14 GLY CA C 14 46.900 45.754 1.146 1
1 176 . 2 1 1 A 14 14 GLY N N 14 111.800 111.927 -0.127 1
1 177 . 2 1 1 A 15 15 GLU H H 15 7.870 8.383 -0.513 1
1 178 . 2 1 1 A 15 15 GLU HA H 15 4.680 4.613 0.067 1
1 183 . 2 1 1 A 15 15 GLU C C 15 175.100 175.605 -0.505 1
1 184 . 2 1 1 A 15 15 GLU CA C 15 54.800 55.502 -0.702 1
1 185 . 2 1 1 A 15 15 GLU CB C 15 32.200 31.306 0.894 1
1 187 . 2 1 1 A 15 15 GLU N N 15 119.200 121.431 -2.231 1
1 188 . 2 1 1 A 16 16 ASP H H 16 8.220 8.823 -0.603 1
1 189 . 2 1 1 A 16 16 ASP HA H 16 4.680 5.184 -0.504 1
1 192 . 2 1 1 A 16 16 ASP C C 16 174.600 175.002 -0.402 1
1 193 . 2 1 1 A 16 16 ASP CA C 16 53.600 53.176 0.424 1
1 194 . 2 1 1 A 16 16 ASP CB C 16 42.900 42.605 0.295 1
1 195 . 2 1 1 A 16 16 ASP N N 16 120.600 124.356 -3.756 1
1 196 . 2 1 1 A 17 17 TYR H H 17 7.540 8.625 -1.085 1
1 197 . 2 1 1 A 17 17 TYR HA H 17 4.910 5.815 -0.905 1
1 202 . 2 1 1 A 17 17 TYR C C 17 173.600 174.421 -0.821 1
1 203 . 2 1 1 A 17 17 TYR CA C 17 56.200 55.402 0.798 1
1 204 . 2 1 1 A 17 17 TYR CB C 17 41.100 41.333 -0.233 1
1 207 . 2 1 1 A 17 17 TYR N N 17 112.700 120.180 -7.480 1
1 208 . 2 1 1 A 18 18 ILE H H 18 7.950 9.253 -1.303 1
1 209 . 2 1 1 A 18 18 ILE HA H 18 4.330 4.594 -0.264 1
1 219 . 2 1 1 A 18 18 ILE C C 18 174.700 174.307 0.393 1
1 220 . 2 1 1 A 18 18 ILE CA C 18 60.300 60.352 -0.052 1
1 221 . 2 1 1 A 18 18 ILE CB C 18 41.000 37.436 3.564 1
1 225 . 2 1 1 A 18 18 ILE N N 18 120.400 124.362 -3.962 1
1 226 . 2 1 1 A 19 19 GLU H H 19 8.760 9.129 -0.369 1
1 227 . 2 1 1 A 19 19 GLU HA H 19 5.200 5.732 -0.532 1
1 232 . 2 1 1 A 19 19 GLU C C 19 175.200 175.372 -0.172 1
1 233 . 2 1 1 A 19 19 GLU CA C 19 55.500 55.426 0.074 1
1 234 . 2 1 1 A 19 19 GLU CB C 19 32.400 31.185 1.215 1
1 236 . 2 1 1 A 19 19 GLU N N 19 129.000 128.984 0.016 1
1 237 . 2 1 1 A 20 20 LEU H H 20 8.730 8.853 -0.123 1
1 238 . 2 1 1 A 20 20 LEU HA H 20 4.620 4.717 -0.097 1
1 248 . 2 1 1 A 20 20 LEU C C 20 176.200 176.637 -0.437 1
1 249 . 2 1 1 A 20 20 LEU CA C 20 54.100 53.260 0.840 1
1 250 . 2 1 1 A 20 20 LEU CB C 20 44.400 44.169 0.231 1
1 254 . 2 1 1 A 20 20 LEU N N 20 128.400 128.507 -0.107 1
1 255 . 2 1 1 A 21 21 GLU H H 21 8.700 9.533 -0.833 1
1 256 . 2 1 1 A 21 21 GLU HA H 21 3.870 4.031 -0.161 1
1 261 . 2 1 1 A 21 21 GLU C C 21 176.100 175.784 0.316 1
1 262 . 2 1 1 A 21 21 GLU CA C 21 58.800 57.979 0.821 1
1 263 . 2 1 1 A 21 21 GLU CB C 21 28.200 28.037 0.163 1
1 265 . 2 1 1 A 21 21 GLU N N 21 122.600 125.765 -3.165 1
1 266 . 2 1 1 A 22 22 ASN H H 22 8.640 8.628 0.012 1
1 267 . 2 1 1 A 22 22 ASN HA H 22 4.540 4.347 0.193 1
1 272 . 2 1 1 A 22 22 ASN C C 22 173.800 173.839 -0.039 1
1 273 . 2 1 1 A 22 22 ASN CA C 22 54.600 54.649 -0.049 1
1 274 . 2 1 1 A 22 22 ASN CB C 22 38.400 36.834 1.566 1
1 275 . 2 1 1 A 22 22 ASN N N 22 118.000 108.816 9.184 1
1 277 . 2 1 1 A 23 23 GLU H H 23 7.740 7.746 -0.006 1
1 278 . 2 1 1 A 23 23 GLU HA H 23 5.430 5.122 0.308 1
1 283 . 2 1 1 A 23 23 GLU C C 23 175.400 175.434 -0.034 1
1 284 . 2 1 1 A 23 23 GLU CA C 23 54.900 55.348 -0.448 1
1 285 . 2 1 1 A 23 23 GLU CB C 23 34.500 31.735 2.765 1
1 287 . 2 1 1 A 23 23 GLU N N 23 116.400 117.455 -1.055 1
1 288 . 2 1 1 A 24 24 ILE H H 24 9.050 9.178 -0.128 1
1 289 . 2 1 1 A 24 24 ILE HA H 24 4.810 4.636 0.174 1
1 299 . 2 1 1 A 24 24 ILE C C 24 174.600 175.395 -0.795 1
1 300 . 2 1 1 A 24 24 ILE CA C 24 60.700 60.542 0.158 1
1 301 . 2 1 1 A 24 24 ILE CB C 24 41.300 37.960 3.340 1
1 305 . 2 1 1 A 24 24 ILE N N 24 122.800 126.469 -3.669 1
1 306 . 2 1 1 A 25 25 HIS H H 25 9.490 9.712 -0.222 1
1 307 . 2 1 1 A 25 25 HIS HA H 25 5.090 5.520 -0.430 1
1 312 . 2 1 1 A 25 25 HIS C C 25 176.100 175.395 0.705 1
1 313 . 2 1 1 A 25 25 HIS CA C 25 56.100 55.527 0.573 1
1 314 . 2 1 1 A 25 25 HIS CB C 25 33.100 31.077 2.023 1
1 317 . 2 1 1 A 25 25 HIS N N 25 127.300 126.772 0.528 1
1 318 . 2 1 1 A 26 26 LEU H H 26 8.820 8.651 0.169 1
1 319 . 2 1 1 A 26 26 LEU HA H 26 5.160 5.089 0.071 1
1 329 . 2 1 1 A 26 26 LEU C C 26 178.000 175.662 2.338 1
1 330 . 2 1 1 A 26 26 LEU CA C 26 52.900 53.480 -0.580 1
1 331 . 2 1 1 A 26 26 LEU CB C 26 48.100 45.252 2.848 1
1 335 . 2 1 1 A 26 26 LEU N N 26 121.600 125.272 -3.672 1
1 336 . 2 1 1 A 27 27 LYS H H 27 8.990 8.733 0.257 1
1 337 . 2 1 1 A 27 27 LYS HA H 27 4.630 4.769 -0.139 1
1 345 . 2 1 1 A 27 27 LYS CA C 27 55.700 53.742 1.958 1
1 346 . 2 1 1 A 27 27 LYS CB C 27 31.900 32.422 -0.522 1
1 350 . 2 1 1 A 27 27 LYS N N 27 125.900 120.062 5.838 1
1 351 . 2 1 1 A 28 28 PRO HA H 28 4.500 4.452 0.048 1
1 358 . 2 1 1 A 28 28 PRO C C 28 177.900 178.234 -0.334 1
1 359 . 2 1 1 A 28 28 PRO CA C 28 67.400 65.951 1.449 1
1 360 . 2 1 1 A 28 28 PRO CB C 28 32.100 31.863 0.237 1
1 363 . 2 1 1 A 29 29 GLU H H 29 9.880 8.298 1.582 1
1 364 . 2 1 1 A 29 29 GLU HA H 29 4.140 4.321 -0.181 1
1 369 . 2 1 1 A 29 29 GLU C C 29 178.800 179.419 -0.619 1
1 370 . 2 1 1 A 29 29 GLU CA C 29 60.600 59.837 0.763 1
1 371 . 2 1 1 A 29 29 GLU CB C 29 29.200 29.451 -0.251 1
1 373 . 2 1 1 A 29 29 GLU N N 29 117.100 118.382 -1.282 1
1 374 . 2 1 1 A 30 30 VAL H H 30 7.050 7.739 -0.689 1
1 375 . 2 1 1 A 30 30 VAL HA H 30 3.850 3.805 0.045 1
1 383 . 2 1 1 A 30 30 VAL C C 30 177.700 178.453 -0.753 1
1 384 . 2 1 1 A 30 30 VAL CA C 30 65.600 65.969 -0.369 1
1 385 . 2 1 1 A 30 30 VAL CB C 30 32.100 32.095 0.005 1
1 388 . 2 1 1 A 30 30 VAL N N 30 120.900 120.087 0.813 1
1 389 . 2 1 1 A 31 31 PHE H H 31 8.980 8.716 0.264 1
1 390 . 2 1 1 A 31 31 PHE HA H 31 3.870 4.294 -0.424 1
1 394 . 2 1 1 A 31 31 PHE C C 31 176.700 177.182 -0.482 1
1 395 . 2 1 1 A 31 31 PHE CA C 31 62.200 62.065 0.135 1
1 396 . 2 1 1 A 31 31 PHE CB C 31 39.300 39.067 0.233 1
1 398 . 2 1 1 A 31 31 PHE N N 31 121.100 120.616 0.484 1
1 399 . 2 1 1 A 32 32 TYR H H 32 8.640 8.491 0.149 1
1 400 . 2 1 1 A 32 32 TYR HA H 32 3.880 4.575 -0.695 1
1 405 . 2 1 1 A 32 32 TYR C C 32 176.000 178.512 -2.512 1
1 406 . 2 1 1 A 32 32 TYR CA C 32 63.300 61.833 1.467 1
1 407 . 2 1 1 A 32 32 TYR CB C 32 39.100 39.096 0.004 1
1 410 . 2 1 1 A 32 32 TYR N N 32 117.400 120.896 -3.496 1
1 411 . 2 1 1 A 33 33 GLU H H 33 7.400 8.276 -0.876 1
1 412 . 2 1 1 A 33 33 GLU HA H 33 4.050 4.100 -0.050 1
1 417 . 2 1 1 A 33 33 GLU C C 33 180.200 179.446 0.754 1
1 418 . 2 1 1 A 33 33 GLU CA C 33 59.500 59.115 0.385 1
1 419 . 2 1 1 A 33 33 GLU CB C 33 29.300 29.659 -0.359 1
1 421 . 2 1 1 A 33 33 GLU N N 33 116.100 118.622 -2.522 1
1 422 . 2 1 1 A 34 34 VAL H H 34 8.530 8.209 0.321 1
1 423 . 2 1 1 A 34 34 VAL HA H 34 3.350 3.573 -0.223 1
1 431 . 2 1 1 A 34 34 VAL C C 34 175.800 178.357 -2.557 1
1 432 . 2 1 1 A 34 34 VAL CA C 34 66.400 66.152 0.248 1
1 433 . 2 1 1 A 34 34 VAL CB C 34 32.200 31.604 0.596 1
1 436 . 2 1 1 A 34 34 VAL N N 34 120.600 120.456 0.144 1
1 437 . 2 1 1 A 35 35 TRP H H 35 9.100 8.313 0.787 1
1 438 . 2 1 1 A 35 35 TRP HA H 35 3.340 3.563 -0.223 1
1 447 . 2 1 1 A 35 35 TRP C C 35 178.000 178.430 -0.430 1
1 448 . 2 1 1 A 35 35 TRP CA C 35 61.800 60.822 0.978 1
1 449 . 2 1 1 A 35 35 TRP CB C 35 27.900 29.449 -1.549 1
1 455 . 2 1 1 A 35 35 TRP N N 35 121.700 121.726 -0.026 1
1 457 . 2 1 1 A 36 36 LYS H H 36 7.970 7.736 0.234 1
1 458 . 2 1 1 A 36 36 LYS HA H 36 3.330 3.598 -0.268 1
1 467 . 2 1 1 A 36 36 LYS C C 36 180.000 178.139 1.861 1
1 468 . 2 1 1 A 36 36 LYS CA C 36 59.000 58.838 0.162 1
1 469 . 2 1 1 A 36 36 LYS CB C 36 31.800 32.230 -0.430 1
1 473 . 2 1 1 A 36 36 LYS N N 36 116.300 117.918 -1.618 1
1 474 . 2 1 1 A 37 37 TYR H H 37 7.750 8.132 -0.382 1
1 475 . 2 1 1 A 37 37 TYR HA H 37 3.940 3.980 -0.040 1
1 480 . 2 1 1 A 37 37 TYR C C 37 177.600 177.667 -0.067 1
1 481 . 2 1 1 A 37 37 TYR CA C 37 61.200 61.214 -0.014 1
1 482 . 2 1 1 A 37 37 TYR CB C 37 38.800 38.624 0.176 1
1 485 . 2 1 1 A 37 37 TYR N N 37 122.700 121.620 1.080 1
1 486 . 2 1 1 A 38 38 VAL H H 38 7.660 7.487 0.173 1
1 487 . 2 1 1 A 38 38 VAL HA H 38 3.870 3.844 0.026 1
1 495 . 2 1 1 A 38 38 VAL C C 38 175.600 176.129 -0.529 1
1 496 . 2 1 1 A 38 38 VAL CA C 38 61.100 61.346 -0.246 1
1 497 . 2 1 1 A 38 38 VAL CB C 38 30.700 31.135 -0.435 1
1 500 . 2 1 1 A 38 38 VAL N N 38 108.200 113.045 -4.845 1
1 501 . 2 1 1 A 39 39 GLY H H 39 7.090 7.552 -0.462 1
1 502 . 2 1 1 A 39 39 GLY HA2 H 39 3.320 3.732 -0.412 1
1 503 . 2 1 1 A 39 39 GLY HA3 H 39 3.730 3.749 -0.019 1
1 504 . 2 1 1 A 39 39 GLY C C 39 173.600 174.502 -0.902 1
1 505 . 2 1 1 A 39 39 GLY CA C 39 46.100 45.003 1.097 1
1 506 . 2 1 1 A 39 39 GLY N N 39 107.600 110.085 -2.485 1
1 507 . 2 1 1 A 40 40 GLU H H 40 7.730 8.012 -0.282 1
1 508 . 2 1 1 A 40 40 GLU HA H 40 1.090 3.353 -2.263 1
1 513 . 2 1 1 A 40 40 GLU CA C 40 55.700 56.765 -1.065 1
1 514 . 2 1 1 A 40 40 GLU CB C 40 27.200 27.625 -0.425 1
1 516 . 2 1 1 A 40 40 GLU N N 40 114.400 119.278 -4.878 1
1 517 . 2 1 1 A 41 41 PRO HA H 41 4.310 4.572 -0.262 1
1 524 . 2 1 1 A 41 41 PRO CA C 41 62.300 62.281 0.019 1
1 525 . 2 1 1 A 41 41 PRO CB C 41 32.700 32.836 -0.136 1
1 528 . 2 1 1 A 42 42 GLU H H 42 8.110 8.531 -0.421 1
1 529 . 2 1 1 A 42 42 GLU C C 42 175.800 176.529 -0.729 1
1 530 . 2 1 1 A 42 42 GLU CA C 42 57.800 56.184 1.616 1
1 531 . 2 1 1 A 42 42 GLU CB C 42 30.600 31.001 -0.401 1
1 533 . 2 1 1 A 42 42 GLU N N 42 119.100 121.285 -2.185 1
1 534 . 2 1 1 A 43 43 LEU H H 43 8.140 8.460 -0.320 1
1 535 . 2 1 1 A 43 43 LEU HA H 43 4.840 4.884 -0.044 1
1 545 . 2 1 1 A 43 43 LEU C C 43 177.300 176.197 1.103 1
1 546 . 2 1 1 A 43 43 LEU CA C 43 53.700 53.713 -0.013 1
1 547 . 2 1 1 A 43 43 LEU CB C 43 43.900 43.681 0.219 1
1 551 . 2 1 1 A 43 43 LEU N N 43 124.700 125.123 -0.423 1
1 552 . 2 1 1 A 44 44 LYS H H 44 8.640 8.064 0.576 1
1 553 . 2 1 1 A 44 44 LYS HA H 44 4.500 5.019 -0.519 1
1 562 . 2 1 1 A 44 44 LYS C C 44 174.500 175.412 -0.912 1
1 563 . 2 1 1 A 44 44 LYS CA C 44 54.700 54.043 0.657 1
1 564 . 2 1 1 A 44 44 LYS CB C 44 36.200 35.411 0.789 1
1 568 . 2 1 1 A 44 44 LYS N N 44 123.300 119.666 3.634 1
1 569 . 2 1 1 A 45 45 THR H H 45 7.990 8.581 -0.591 1
1 570 . 2 1 1 A 45 45 THR HA H 45 5.700 5.353 0.347 1
1 575 . 2 1 1 A 45 45 THR C C 45 175.100 172.885 2.215 1
1 576 . 2 1 1 A 45 45 THR CA C 45 59.600 59.823 -0.223 1
1 577 . 2 1 1 A 45 45 THR CB C 45 73.400 71.939 1.461 1
1 579 . 2 1 1 A 45 45 THR N N 45 106.900 113.229 -6.329 1
1 580 . 2 1 1 A 46 46 TYR H H 46 8.470 8.994 -0.524 1
1 581 . 2 1 1 A 46 46 TYR HA H 46 4.930 5.418 -0.488 1
1 586 . 2 1 1 A 46 46 TYR C C 46 172.400 172.539 -0.139 1
1 587 . 2 1 1 A 46 46 TYR CA C 46 57.100 55.720 1.380 1
1 588 . 2 1 1 A 46 46 TYR CB C 46 40.200 41.982 -1.782 1
1 591 . 2 1 1 A 46 46 TYR N N 46 117.100 118.303 -1.203 1
1 592 . 2 1 1 A 47 47 VAL H H 47 8.430 9.009 -0.579 1
1 593 . 2 1 1 A 47 47 VAL HA H 47 4.890 4.428 0.462 1
1 601 . 2 1 1 A 47 47 VAL C C 47 175.800 174.751 1.049 1
1 602 . 2 1 1 A 47 47 VAL CA C 47 60.800 61.793 -0.993 1
1 603 . 2 1 1 A 47 47 VAL CB C 47 34.800 32.903 1.897 1
1 606 . 2 1 1 A 47 47 VAL N N 47 119.200 120.994 -1.794 1
1 607 . 2 1 1 A 48 48 ILE H H 48 8.680 9.198 -0.518 1
1 608 . 2 1 1 A 48 48 ILE HA H 48 4.560 5.067 -0.507 1
1 618 . 2 1 1 A 48 48 ILE C C 48 174.500 174.629 -0.129 1
1 619 . 2 1 1 A 48 48 ILE CA C 48 59.700 59.024 0.676 1
1 620 . 2 1 1 A 48 48 ILE CB C 48 41.500 41.267 0.233 1
1 624 . 2 1 1 A 48 48 ILE N N 48 124.400 129.233 -4.833 1
1 625 . 2 1 1 A 49 49 GLU H H 49 8.320 8.622 -0.302 1
1 626 . 2 1 1 A 49 49 GLU C C 49 175.500 174.864 0.636 1
1 627 . 2 1 1 A 49 49 GLU CA C 49 55.500 55.408 0.092 1
1 628 . 2 1 1 A 49 49 GLU CB C 49 31.800 29.685 2.115 1
1 630 . 2 1 1 A 49 49 GLU N N 49 123.400 128.992 -5.592 1
1 631 . 2 1 1 A 50 50 ASP H H 50 8.610 8.542 0.068 1
1 632 . 2 1 1 A 50 50 ASP C C 50 175.100 174.981 0.119 1
1 633 . 2 1 1 A 50 50 ASP CA C 50 53.100 53.719 -0.619 1
1 634 . 2 1 1 A 50 50 ASP CB C 50 44.000 41.196 2.804 1
1 635 . 2 1 1 A 50 50 ASP N N 50 124.300 127.263 -2.963 1
1 636 . 2 1 1 A 51 51 GLU H H 51 8.450 9.076 -0.626 1
1 637 . 2 1 1 A 51 51 GLU C C 51 175.900 175.360 0.540 1
1 638 . 2 1 1 A 51 51 GLU CA C 51 56.000 55.948 0.052 1
1 639 . 2 1 1 A 51 51 GLU CB C 51 31.700 30.339 1.361 1
1 640 . 2 1 1 A 51 51 GLU N N 51 121.300 123.678 -2.378 1
1 641 . 2 1 1 A 52 52 ILE H H 52 8.480 8.603 -0.123 1
1 642 . 2 1 1 A 52 52 ILE C C 52 175.400 175.647 -0.247 1
1 643 . 2 1 1 A 52 52 ILE CA C 52 60.400 61.152 -0.752 1
1 644 . 2 1 1 A 52 52 ILE CB C 52 40.000 36.586 3.414 1
1 645 . 2 1 1 A 52 52 ILE N N 52 122.700 126.716 -4.016 1
1 646 . 2 1 1 A 53 53 VAL H H 53 8.140 8.037 0.103 1
1 647 . 2 1 1 A 53 53 VAL C C 53 175.600 174.832 0.768 1
1 648 . 2 1 1 A 53 53 VAL CA C 53 61.900 60.115 1.785 1
1 649 . 2 1 1 A 53 53 VAL CB C 53 33.200 33.777 -0.577 1
1 650 . 2 1 1 A 53 53 VAL N N 53 124.400 124.316 0.084 1
1 651 . 2 1 1 A 54 54 GLU H H 54 8.540 8.524 0.016 1
1 652 . 2 1 1 A 54 54 GLU CA C 54 55.600 53.444 2.156 1
1 653 . 2 1 1 A 54 54 GLU CB C 54 34.300 30.530 3.770 1
1 654 . 2 1 1 A 54 54 GLU N N 54 125.900 123.146 2.754 1
1 655 . 2 1 1 A 55 55 PRO C C 55 177.500 177.088 0.412 1
1 656 . 2 1 1 A 55 55 PRO CA C 55 63.400 62.483 0.917 1
1 657 . 2 1 1 A 55 55 PRO CB C 55 32.300 29.646 2.654 1
1 658 . 2 1 1 A 56 56 GLY H H 56 8.420 7.727 0.693 1
1 659 . 2 1 1 A 56 56 GLY HA2 H 56 3.830 4.076 -0.246 1
1 660 . 2 1 1 A 56 56 GLY HA3 H 56 4.000 4.081 -0.081 1
1 661 . 2 1 1 A 56 56 GLY C C 56 174.500 173.795 0.705 1
1 662 . 2 1 1 A 56 56 GLY CA C 56 45.400 45.225 0.175 1
1 663 . 2 1 1 A 56 56 GLY N N 56 109.700 111.668 -1.968 1
1 664 . 2 1 1 A 57 57 GLU H H 57 8.180 8.004 0.176 1
1 665 . 2 1 1 A 57 57 GLU C C 57 176.300 175.959 0.341 1
1 666 . 2 1 1 A 57 57 GLU CA C 57 57.500 54.626 2.874 1
1 667 . 2 1 1 A 57 57 GLU CB C 57 30.400 32.427 -2.027 1
1 668 . 2 1 1 A 57 57 GLU N N 57 120.900 119.969 0.931 1
1 669 . 2 1 1 A 58 58 TYR H H 58 8.020 8.730 -0.710 1
1 670 . 2 1 1 A 58 58 TYR C C 58 175.100 175.247 -0.147 1
1 671 . 2 1 1 A 58 58 TYR CA C 58 57.400 60.084 -2.684 1
1 672 . 2 1 1 A 58 58 TYR CB C 58 38.900 39.672 -0.772 1
1 673 . 2 1 1 A 58 58 TYR N N 58 118.800 124.735 -5.935 1
1 674 . 2 1 1 A 59 59 ASP H H 59 7.950 7.850 0.100 1
1 675 . 2 1 1 A 59 59 ASP CA C 59 52.700 51.694 1.006 1
1 676 . 2 1 1 A 59 59 ASP CB C 59 41.000 41.014 -0.014 1
1 677 . 2 1 1 A 59 59 ASP N N 59 123.500 119.472 4.028 1
1 678 . 2 1 1 A 61 61 PRO HA H 61 4.510 4.200 0.310 1
1 685 . 2 1 1 A 61 61 PRO C C 61 176.500 177.450 -0.950 1
1 686 . 2 1 1 A 61 61 PRO CA C 61 63.700 65.144 -1.444 1
1 687 . 2 1 1 A 61 61 PRO CB C 61 34.200 31.987 2.213 1
1 690 . 2 1 1 A 62 62 GLU H H 62 8.490 8.349 0.141 1
1 691 . 2 1 1 A 62 62 GLU N N 62 124.600 118.176 6.424 1
1 692 . 2 1 1 A 64 64 LYS C C 64 176.300 176.435 -0.135 1
1 693 . 2 1 1 A 64 64 LYS CA C 64 57.000 57.815 -0.815 1
1 694 . 2 1 1 A 64 64 LYS CB C 64 33.100 33.300 -0.200 1
1 695 . 2 1 1 A 65 65 TYR H H 65 7.960 8.773 -0.813 1
1 696 . 2 1 1 A 65 65 TYR C C 65 176.000 176.670 -0.670 1
1 697 . 2 1 1 A 65 65 TYR CA C 65 57.800 58.826 -1.026 1
1 698 . 2 1 1 A 65 65 TYR CB C 65 38.800 36.746 2.054 1
1 699 . 2 1 1 A 65 65 TYR N N 65 119.300 118.584 0.716 1
1 700 . 2 1 1 A 66 66 THR H H 66 7.820 8.111 -0.291 1
1 701 . 2 1 1 A 66 66 THR HA H 66 4.280 4.422 -0.142 1
1 706 . 2 1 1 A 66 66 THR C C 66 174.100 175.349 -1.249 1
1 707 . 2 1 1 A 66 66 THR CA C 66 62.100 62.297 -0.197 1
1 708 . 2 1 1 A 66 66 THR CB C 66 70.000 69.823 0.177 1
1 710 . 2 1 1 A 66 66 THR N N 66 113.900 112.639 1.261 1
1 711 . 2 1 1 A 67 67 ASN H H 67 8.270 8.099 0.171 1
1 712 . 2 1 1 A 67 67 ASN C C 67 174.100 174.908 -0.808 1
1 713 . 2 1 1 A 67 67 ASN CA C 67 53.400 52.911 0.489 1
1 714 . 2 1 1 A 67 67 ASN CB C 67 39.300 39.342 -0.042 1
1 715 . 2 1 1 A 67 67 ASN N N 67 121.400 117.915 3.485 1
1 716 . 2 1 1 A 68 68 VAL H H 68 7.660 7.296 0.364 1
1 717 . 2 1 1 A 68 68 VAL C C 68 175.500 174.507 0.993 1
1 718 . 2 1 1 A 68 68 VAL CA C 68 61.800 62.669 -0.869 1
1 719 . 2 1 1 A 68 68 VAL CB C 68 33.700 30.815 2.885 1
1 720 . 2 1 1 A 68 68 VAL N N 68 119.400 121.181 -1.781 1
1 721 . 2 1 1 A 69 69 LYS H H 69 8.690 8.721 -0.031 1
1 722 . 2 1 1 A 69 69 LYS C C 69 175.200 174.874 0.326 1
1 723 . 2 1 1 A 69 69 LYS CA C 69 55.200 54.604 0.596 1
1 724 . 2 1 1 A 69 69 LYS CB C 69 35.200 34.215 0.985 1
1 725 . 2 1 1 A 69 69 LYS N N 69 126.500 129.736 -3.236 1
1 726 . 2 1 1 A 70 70 LYS H H 70 8.230 9.087 -0.857 1
1 727 . 2 1 1 A 70 70 LYS C C 70 176.400 175.813 0.587 1
1 728 . 2 1 1 A 70 70 LYS CA C 70 55.600 55.474 0.126 1
1 729 . 2 1 1 A 70 70 LYS CB C 70 33.800 33.692 0.108 1
1 730 . 2 1 1 A 70 70 LYS N N 70 122.700 127.481 -4.781 1
1 731 . 2 1 1 A 71 71 VAL H H 71 8.530 9.394 -0.864 1
1 732 . 2 1 1 A 71 71 VAL HA H 71 4.510 4.571 -0.061 1
1 733 . 2 1 1 A 71 71 VAL C C 71 174.700 175.070 -0.370 1
1 734 . 2 1 1 A 71 71 VAL CA C 71 60.900 61.305 -0.405 1
1 735 . 2 1 1 A 71 71 VAL CB C 71 34.800 32.646 2.154 1
1 738 . 2 1 1 A 71 71 VAL N N 71 121.200 124.868 -3.668 1
1 739 . 2 1 1 A 72 72 LYS H H 72 8.210 8.843 -0.633 1
1 740 . 2 1 1 A 72 72 LYS HA H 72 4.800 4.850 -0.050 1
1 747 . 2 1 1 A 72 72 LYS C C 72 176.200 175.555 0.645 1
1 748 . 2 1 1 A 72 72 LYS CA C 72 55.700 56.304 -0.604 1
1 749 . 2 1 1 A 72 72 LYS CB C 72 33.700 33.098 0.602 1
1 752 . 2 1 1 A 72 72 LYS N N 72 123.600 127.527 -3.927 1
1 753 . 2 1 1 A 73 73 ILE H H 73 8.890 8.868 0.022 1
1 754 . 2 1 1 A 73 73 ILE C C 73 174.400 174.618 -0.218 1
1 755 . 2 1 1 A 73 73 ILE CA C 73 60.400 59.775 0.625 1
1 756 . 2 1 1 A 73 73 ILE CB C 73 40.800 38.396 2.404 1
1 760 . 2 1 1 A 73 73 ILE N N 73 125.100 126.461 -1.361 1
1 761 . 2 1 1 A 74 74 LYS H H 74 8.420 8.779 -0.359 1
1 762 . 2 1 1 A 74 74 LYS HA H 74 4.800 4.720 0.080 1
1 771 . 2 1 1 A 74 74 LYS C C 74 175.600 175.375 0.225 1
1 772 . 2 1 1 A 74 74 LYS CA C 74 56.200 55.635 0.565 1
1 773 . 2 1 1 A 74 74 LYS CB C 74 34.300 33.361 0.939 1
1 777 . 2 1 1 A 74 74 LYS N N 74 126.400 128.062 -1.662 1
1 778 . 2 1 1 A 75 75 LYS H H 75 9.090 8.770 0.320 1
1 779 . 2 1 1 A 75 75 LYS HA H 75 4.800 4.831 -0.031 1
1 788 . 2 1 1 A 75 75 LYS C C 75 174.900 174.880 0.020 1
1 789 . 2 1 1 A 75 75 LYS CA C 75 53.200 54.118 -0.918 1
1 790 . 2 1 1 A 75 75 LYS CB C 75 34.200 35.307 -1.107 1
1 794 . 2 1 1 A 75 75 LYS N N 75 127.500 126.511 0.989 1
1 795 . 2 1 1 A 76 76 VAL H H 76 8.610 8.662 -0.052 1
1 796 . 2 1 1 A 76 76 VAL HA H 76 5.340 5.079 0.261 1
1 804 . 2 1 1 A 76 76 VAL C C 76 171.400 173.875 -2.475 1
1 805 . 2 1 1 A 76 76 VAL CA C 76 58.000 59.451 -1.451 1
1 806 . 2 1 1 A 76 76 VAL CB C 76 36.400 35.097 1.303 1
1 809 . 2 1 1 A 76 76 VAL N N 76 120.100 120.804 -0.704 1
1 810 . 2 1 1 A 77 77 TYR H H 77 9.110 9.306 -0.196 1
1 811 . 2 1 1 A 77 77 TYR HA H 77 6.150 5.873 0.277 1
1 816 . 2 1 1 A 77 77 TYR C C 77 173.600 173.170 0.430 1
1 817 . 2 1 1 A 77 77 TYR CA C 77 56.200 55.954 0.246 1
1 818 . 2 1 1 A 77 77 TYR CB C 77 44.000 41.304 2.696 1
1 821 . 2 1 1 A 77 77 TYR N N 77 121.300 121.978 -0.678 1
1 822 . 2 1 1 A 78 78 PHE H H 78 8.190 8.810 -0.620 1
1 823 . 2 1 1 A 78 78 PHE HA H 78 5.130 5.677 -0.547 1
1 829 . 2 1 1 A 78 78 PHE C C 78 173.600 172.773 0.827 1
1 830 . 2 1 1 A 78 78 PHE CA C 78 55.900 55.115 0.785 1
1 831 . 2 1 1 A 78 78 PHE CB C 78 42.500 42.835 -0.335 1
1 835 . 2 1 1 A 78 78 PHE N N 78 112.700 117.022 -4.322 1
1 836 . 2 1 1 A 79 79 GLU H H 79 8.920 9.028 -0.108 1
1 837 . 2 1 1 A 79 79 GLU HA H 79 5.390 5.353 0.037 1
1 842 . 2 1 1 A 79 79 GLU C C 79 177.000 176.680 0.320 1
1 843 . 2 1 1 A 79 79 GLU CA C 79 54.900 55.038 -0.138 1
1 844 . 2 1 1 A 79 79 GLU CB C 79 33.600 32.237 1.363 1
1 846 . 2 1 1 A 79 79 GLU N N 79 120.500 119.881 0.619 1
1 847 . 2 1 1 A 80 80 THR H H 80 8.970 9.265 -0.295 1
1 848 . 2 1 1 A 80 80 THR HA H 80 4.700 4.955 -0.255 1
1 854 . 2 1 1 A 80 80 THR C C 80 177.000 175.723 1.277 1
1 855 . 2 1 1 A 80 80 THR CA C 80 61.300 60.279 1.021 1
1 856 . 2 1 1 A 80 80 THR CB C 80 70.500 70.317 0.183 1
1 858 . 2 1 1 A 80 80 THR N N 80 113.200 114.475 -1.275 1
1 859 . 2 1 1 A 81 81 LEU H H 81 8.610 8.865 -0.255 1
1 860 . 2 1 1 A 81 81 LEU HA H 81 4.230 4.070 0.160 1
1 870 . 2 1 1 A 81 81 LEU C C 81 177.400 177.714 -0.314 1
1 871 . 2 1 1 A 81 81 LEU CA C 81 57.700 57.744 -0.044 1
1 872 . 2 1 1 A 81 81 LEU CB C 81 42.400 41.504 0.896 1
1 876 . 2 1 1 A 81 81 LEU N N 81 120.900 121.995 -1.095 1
1 877 . 2 1 1 A 82 82 ASP H H 82 8.850 7.920 0.930 1
1 878 . 2 1 1 A 82 82 ASP HA H 82 4.670 4.757 -0.087 1
1 881 . 2 1 1 A 82 82 ASP C C 82 174.100 174.914 -0.814 1
1 882 . 2 1 1 A 82 82 ASP CA C 82 52.700 53.895 -1.195 1
1 883 . 2 1 1 A 82 82 ASP CB C 82 37.900 40.901 -3.001 1
1 884 . 2 1 1 A 82 82 ASP N N 82 112.300 116.808 -4.508 1
1 885 . 2 1 1 A 83 83 ASN H H 83 7.790 8.113 -0.323 1
1 886 . 2 1 1 A 83 83 ASN HA H 83 4.270 4.413 -0.143 1
1 891 . 2 1 1 A 83 83 ASN C C 83 176.100 174.860 1.240 1
1 892 . 2 1 1 A 83 83 ASN CA C 83 55.300 54.479 0.821 1
1 893 . 2 1 1 A 83 83 ASN CB C 83 36.900 37.393 -0.493 1
1 894 . 2 1 1 A 83 83 ASN N N 83 113.000 114.195 -1.195 1
1 896 . 2 1 1 A 84 84 VAL H H 84 7.660 7.424 0.236 1
1 897 . 2 1 1 A 84 84 VAL HA H 84 4.270 4.178 0.092 1
1 905 . 2 1 1 A 84 84 VAL C C 84 175.800 175.516 0.284 1
1 906 . 2 1 1 A 84 84 VAL CA C 84 61.500 62.806 -1.306 1
1 907 . 2 1 1 A 84 84 VAL CB C 84 33.500 32.268 1.232 1
1 910 . 2 1 1 A 84 84 VAL N N 84 119.700 119.648 0.052 1
1 911 . 2 1 1 A 85 85 ARG H H 85 8.180 9.166 -0.986 1
1 912 . 2 1 1 A 85 85 ARG HA H 85 4.870 4.815 0.055 1
1 920 . 2 1 1 A 85 85 ARG C C 85 174.000 175.122 -1.122 1
1 921 . 2 1 1 A 85 85 ARG CA C 85 55.700 54.789 0.911 1
1 922 . 2 1 1 A 85 85 ARG CB C 85 32.600 31.598 1.002 1
1 925 . 2 1 1 A 85 85 ARG N N 85 124.800 127.509 -2.709 1
1 927 . 2 1 1 A 86 86 VAL H H 86 8.570 8.533 0.037 1
1 928 . 2 1 1 A 86 86 VAL HA H 86 4.580 4.526 0.054 1
1 936 . 2 1 1 A 86 86 VAL C C 86 175.700 175.427 0.273 1
1 937 . 2 1 1 A 86 86 VAL CA C 86 61.700 62.537 -0.837 1
1 938 . 2 1 1 A 86 86 VAL CB C 86 30.900 30.965 -0.065 1
1 941 . 2 1 1 A 86 86 VAL N N 86 127.300 125.165 2.135 1
1 942 . 2 1 1 A 87 87 VAL H H 87 8.790 8.749 0.041 1
1 943 . 2 1 1 A 87 87 VAL HA H 87 5.010 4.892 0.118 1
1 951 . 2 1 1 A 87 87 VAL C C 87 175.500 174.874 0.626 1
1 952 . 2 1 1 A 87 87 VAL CA C 87 61.900 61.206 0.694 1
1 953 . 2 1 1 A 87 87 VAL CB C 87 36.300 32.850 3.450 1
1 956 . 2 1 1 A 87 87 VAL N N 87 125.700 128.640 -2.940 1
1 957 . 2 1 1 A 88 88 THR H H 88 8.350 8.882 -0.532 1
1 958 . 2 1 1 A 88 88 THR HA H 88 4.620 4.711 -0.091 1
1 964 . 2 1 1 A 88 88 THR C C 88 173.300 172.362 0.938 1
1 965 . 2 1 1 A 88 88 THR CA C 88 61.700 60.750 0.950 1
1 966 . 2 1 1 A 88 88 THR CB C 88 70.400 72.441 -2.041 1
1 968 . 2 1 1 A 88 88 THR N N 88 117.500 121.635 -4.135 1
1 969 . 2 1 1 A 89 89 ASP H H 89 7.700 8.597 -0.897 1
1 970 . 2 1 1 A 89 89 ASP HA H 89 4.480 4.552 -0.072 1
1 973 . 2 1 1 A 89 89 ASP C C 89 175.900 177.665 -1.765 1
1 974 . 2 1 1 A 89 89 ASP CA C 89 55.900 54.336 1.564 1
1 975 . 2 1 1 A 89 89 ASP CB C 89 43.900 41.663 2.237 1
1 976 . 2 1 1 A 89 89 ASP N N 89 120.800 125.314 -4.514 1
1 977 . 2 1 1 A 90 90 TYR H H 90 8.240 8.967 -0.727 1
1 978 . 2 1 1 A 90 90 TYR HA H 90 3.920 4.166 -0.246 1
1 983 . 2 1 1 A 90 90 TYR C C 90 176.400 177.757 -1.357 1
1 984 . 2 1 1 A 90 90 TYR CA C 90 62.300 60.300 2.000 1
1 985 . 2 1 1 A 90 90 TYR CB C 90 39.500 39.428 0.072 1
1 988 . 2 1 1 A 90 90 TYR N N 90 126.100 128.122 -2.022 1
1 989 . 2 1 1 A 91 91 SER H H 91 9.160 8.075 1.085 1
1 990 . 2 1 1 A 91 91 SER HA H 91 4.000 4.029 -0.029 1
1 993 . 2 1 1 A 91 91 SER C C 91 178.000 176.972 1.028 1
1 994 . 2 1 1 A 91 91 SER CA C 91 62.600 61.837 0.763 1
1 995 . 2 1 1 A 91 91 SER CB C 91 62.200 62.771 -0.571 1
1 996 . 2 1 1 A 91 91 SER N N 91 116.600 116.212 0.388 1
1 997 . 2 1 1 A 92 92 GLU H H 92 8.590 8.575 0.015 1
1 998 . 2 1 1 A 92 92 GLU HA H 92 4.050 4.135 -0.085 1
1 1003 . 2 1 1 A 92 92 GLU C C 92 179.400 178.572 0.828 1
1 1004 . 2 1 1 A 92 92 GLU CA C 92 58.900 58.660 0.240 1
1 1005 . 2 1 1 A 92 92 GLU CB C 92 30.600 29.474 1.126 1
1 1007 . 2 1 1 A 92 92 GLU N N 92 120.200 121.221 -1.021 1
1 1008 . 2 1 1 A 93 93 PHE H H 93 7.870 7.950 -0.080 1
1 1009 . 2 1 1 A 93 93 PHE HA H 93 4.050 4.156 -0.106 1
1 1015 . 2 1 1 A 93 93 PHE C C 93 176.500 177.782 -1.282 1
1 1016 . 2 1 1 A 93 93 PHE CA C 93 62.200 61.441 0.759 1
1 1017 . 2 1 1 A 93 93 PHE CB C 93 39.700 39.149 0.551 1
1 1021 . 2 1 1 A 93 93 PHE N N 93 120.200 122.164 -1.964 1
1 1022 . 2 1 1 A 94 94 GLN H H 94 8.190 8.057 0.133 1
1 1023 . 2 1 1 A 94 94 GLN HA H 94 3.390 3.409 -0.019 1
1 1030 . 2 1 1 A 94 94 GLN C C 94 178.600 178.816 -0.216 1
1 1031 . 2 1 1 A 94 94 GLN CA C 94 58.800 59.167 -0.367 1
1 1032 . 2 1 1 A 94 94 GLN CB C 94 28.400 28.523 -0.123 1
1 1034 . 2 1 1 A 94 94 GLN N N 94 116.800 118.334 -1.534 1
1 1036 . 2 1 1 A 95 95 LYS H H 95 7.060 7.377 -0.317 1
1 1037 . 2 1 1 A 95 95 LYS HA H 95 3.780 3.960 -0.180 1
1 1046 . 2 1 1 A 95 95 LYS C C 95 179.300 179.356 -0.056 1
1 1047 . 2 1 1 A 95 95 LYS CA C 95 59.900 59.502 0.398 1
1 1048 . 2 1 1 A 95 95 LYS CB C 95 32.700 32.357 0.343 1
1 1052 . 2 1 1 A 95 95 LYS N N 95 117.500 119.207 -1.707 1
1 1053 . 2 1 1 A 96 96 ILE H H 96 7.240 8.129 -0.889 1
1 1054 . 2 1 1 A 96 96 ILE HA H 96 3.420 3.606 -0.186 1
1 1064 . 2 1 1 A 96 96 ILE C C 96 177.800 178.243 -0.443 1
1 1065 . 2 1 1 A 96 96 ILE CA C 96 64.300 64.643 -0.343 1
1 1066 . 2 1 1 A 96 96 ILE CB C 96 37.400 36.730 0.670 1
1 1070 . 2 1 1 A 96 96 ILE N N 96 120.700 120.320 0.380 1
1 1071 . 2 1 1 A 97 97 LEU H H 97 7.690 7.879 -0.189 1
1 1072 . 2 1 1 A 97 97 LEU HA H 97 3.580 3.550 0.030 1
1 1082 . 2 1 1 A 97 97 LEU C C 97 179.900 179.051 0.849 1
1 1083 . 2 1 1 A 97 97 LEU CA C 97 58.100 57.673 0.427 1
1 1084 . 2 1 1 A 97 97 LEU CB C 97 41.500 40.909 0.591 1
1 1088 . 2 1 1 A 97 97 LEU N N 97 120.000 120.867 -0.867 1
1 1089 . 2 1 1 A 98 98 LYS H H 98 7.510 7.591 -0.081 1
1 1090 . 2 1 1 A 98 98 LYS HA H 98 3.950 4.102 -0.152 1
1 1099 . 2 1 1 A 98 98 LYS C C 98 178.700 179.067 -0.367 1
1 1100 . 2 1 1 A 98 98 LYS CA C 98 58.700 59.027 -0.327 1
1 1101 . 2 1 1 A 98 98 LYS CB C 98 32.500 32.161 0.339 1
1 1105 . 2 1 1 A 98 98 LYS N N 98 117.300 118.246 -0.946 1
1 1106 . 2 1 1 A 99 99 LYS H H 99 7.470 7.424 0.046 1
1 1107 . 2 1 1 A 99 99 LYS HA H 99 4.080 3.905 0.175 1
1 1116 . 2 1 1 A 99 99 LYS C C 99 178.100 178.106 -0.006 1
1 1117 . 2 1 1 A 99 99 LYS CA C 99 58.400 59.260 -0.860 1
1 1118 . 2 1 1 A 99 99 LYS CB C 99 33.000 32.542 0.458 1
1 1122 . 2 1 1 A 99 99 LYS N N 99 119.000 119.706 -0.706 1
1 1123 . 2 1 1 A 100 100 ARG H H 100 8.020 7.655 0.365 1
1 1124 . 2 1 1 A 100 100 ARG HA H 100 4.210 4.342 -0.132 1
1 1131 . 2 1 1 A 100 100 ARG C C 100 177.500 176.565 0.935 1
1 1132 . 2 1 1 A 100 100 ARG CA C 100 56.700 55.548 1.152 1
1 1133 . 2 1 1 A 100 100 ARG CB C 100 30.500 30.784 -0.284 1
1 1136 . 2 1 1 A 100 100 ARG N N 100 117.300 115.847 1.453 1
1 1137 . 2 1 1 A 101 101 GLY H H 101 7.910 7.691 0.219 1
1 1138 . 2 1 1 A 101 101 GLY HA2 H 101 3.980 3.922 0.058 1
1 1139 . 2 1 1 A 101 101 GLY HA3 H 101 4.020 3.945 0.075 1
1 1140 . 2 1 1 A 101 101 GLY C C 101 174.400 174.516 -0.116 1
1 1141 . 2 1 1 A 101 101 GLY CA C 101 46.000 46.626 -0.626 1
1 1142 . 2 1 1 A 101 101 GLY N N 101 108.000 108.203 -0.203 1
1 1143 . 2 1 1 A 102 102 THR H H 102 7.880 8.277 -0.397 1
1 1144 . 2 1 1 A 102 102 THR HA H 102 4.360 4.589 -0.229 1
1 1149 . 2 1 1 A 102 102 THR C C 102 174.400 173.949 0.451 1
1 1150 . 2 1 1 A 102 102 THR CA C 102 62.100 61.213 0.887 1
1 1151 . 2 1 1 A 102 102 THR CB C 102 70.500 70.591 -0.091 1
1 1153 . 2 1 1 A 102 102 THR N N 102 113.900 114.514 -0.614 1
1 1154 . 2 1 1 A 103 103 LYS H H 103 8.440 8.829 -0.389 1
1 1155 . 2 1 1 A 103 103 LYS C C 103 176.400 177.951 -1.551 1
1 1156 . 2 1 1 A 103 103 LYS CA C 103 56.600 55.387 1.213 1
1 1157 . 2 1 1 A 103 103 LYS CB C 103 33.300 33.316 -0.016 1
1 1158 . 2 1 1 A 103 103 LYS N N 103 124.000 125.866 -1.866 1
1 1159 . 2 1 1 A 104 104 LEU H H 104 8.180 8.482 -0.302 1
1 1160 . 2 1 1 A 104 104 LEU HA H 104 4.270 4.267 0.003 1
1 1170 . 2 1 1 A 104 104 LEU C C 104 177.100 177.115 -0.015 1
1 1171 . 2 1 1 A 104 104 LEU CA C 104 55.500 55.864 -0.364 1
1 1172 . 2 1 1 A 104 104 LEU CB C 104 42.500 42.608 -0.108 1
1 1176 . 2 1 1 A 104 104 LEU N N 104 123.500 121.054 2.446 1
1 1177 . 2 1 1 A 105 105 GLU H H 105 8.270 7.672 0.598 1
1 1178 . 2 1 1 A 105 105 GLU CA C 105 56.700 55.836 0.864 1
1 1179 . 2 1 1 A 105 105 GLU CB C 105 30.800 30.784 0.016 1
1 13 . 3 1 1 A 2 2 ASN HA H 2 4.980 5.122 -0.142 1
1 18 . 3 1 1 A 2 2 ASN C C 2 176.300 176.417 -0.117 1
1 19 . 3 1 1 A 2 2 ASN CA C 2 52.500 51.735 0.765 1
1 20 . 3 1 1 A 2 2 ASN CB C 2 40.900 41.290 -0.390 1
1 22 . 3 1 1 A 3 3 SER H H 3 9.940 8.958 0.982 1
1 23 . 3 1 1 A 3 3 SER HA H 3 3.720 4.160 -0.440 1
1 26 . 3 1 1 A 3 3 SER C C 3 175.900 176.866 -0.966 1
1 27 . 3 1 1 A 3 3 SER CA C 3 63.300 61.714 1.586 1
1 28 . 3 1 1 A 3 3 SER CB C 3 61.700 62.419 -0.719 1
1 29 . 3 1 1 A 3 3 SER N N 3 118.200 116.358 1.842 1
1 30 . 3 1 1 A 4 4 GLU H H 4 8.450 8.217 0.233 1
1 31 . 3 1 1 A 4 4 GLU HA H 4 4.010 4.027 -0.017 1
1 36 . 3 1 1 A 4 4 GLU C C 4 178.800 179.212 -0.412 1
1 37 . 3 1 1 A 4 4 GLU CA C 4 60.300 59.184 1.116 1
1 38 . 3 1 1 A 4 4 GLU CB C 4 29.100 29.465 -0.365 1
1 40 . 3 1 1 A 4 4 GLU N N 4 123.600 122.749 0.851 1
1 41 . 3 1 1 A 5 5 VAL H H 5 7.590 7.559 0.031 1
1 42 . 3 1 1 A 5 5 VAL HA H 5 3.850 3.643 0.207 1
1 50 . 3 1 1 A 5 5 VAL C C 5 179.100 178.340 0.760 1
1 51 . 3 1 1 A 5 5 VAL CA C 5 65.800 66.482 -0.682 1
1 52 . 3 1 1 A 5 5 VAL CB C 5 32.300 31.610 0.690 1
1 55 . 3 1 1 A 5 5 VAL N N 5 119.300 119.627 -0.327 1
1 56 . 3 1 1 A 6 6 ILE H H 6 7.240 8.198 -0.958 1
1 57 . 3 1 1 A 6 6 ILE HA H 6 3.580 3.627 -0.047 1
1 67 . 3 1 1 A 6 6 ILE C C 6 177.000 178.096 -1.096 1
1 68 . 3 1 1 A 6 6 ILE CA C 6 65.300 65.844 -0.544 1
1 69 . 3 1 1 A 6 6 ILE CB C 6 37.900 37.960 -0.060 1
1 73 . 3 1 1 A 6 6 ILE N N 6 120.300 120.516 -0.216 1
1 74 . 3 1 1 A 7 7 LYS H H 7 8.050 8.483 -0.433 1
1 75 . 3 1 1 A 7 7 LYS HA H 7 3.570 3.687 -0.117 1
1 84 . 3 1 1 A 7 7 LYS C C 7 178.700 179.762 -1.062 1
1 85 . 3 1 1 A 7 7 LYS CA C 7 61.300 60.455 0.845 1
1 86 . 3 1 1 A 7 7 LYS CB C 7 32.200 32.220 -0.020 1
1 90 . 3 1 1 A 7 7 LYS N N 7 119.200 119.236 -0.036 1
1 91 . 3 1 1 A 8 8 GLU H H 8 8.100 8.315 -0.215 1
1 92 . 3 1 1 A 8 8 GLU HA H 8 4.000 4.062 -0.062 1
1 97 . 3 1 1 A 8 8 GLU C C 8 178.500 179.151 -0.651 1
1 98 . 3 1 1 A 8 8 GLU CA C 8 59.700 59.458 0.242 1
1 99 . 3 1 1 A 8 8 GLU CB C 8 29.600 29.655 -0.055 1
1 101 . 3 1 1 A 8 8 GLU N N 8 119.400 119.844 -0.444 1
1 102 . 3 1 1 A 9 9 PHE H H 9 7.720 8.079 -0.359 1
1 103 . 3 1 1 A 9 9 PHE HA H 9 4.160 4.086 0.074 1
1 109 . 3 1 1 A 9 9 PHE C C 9 176.900 177.282 -0.382 1
1 110 . 3 1 1 A 9 9 PHE CA C 9 61.300 61.386 -0.086 1
1 111 . 3 1 1 A 9 9 PHE CB C 9 39.400 38.941 0.459 1
1 115 . 3 1 1 A 9 9 PHE N N 9 121.300 121.971 -0.671 1
1 116 . 3 1 1 A 10 10 LEU H H 10 8.060 8.832 -0.772 1
1 117 . 3 1 1 A 10 10 LEU HA H 10 3.660 3.730 -0.070 1
1 127 . 3 1 1 A 10 10 LEU C C 10 179.000 179.075 -0.075 1
1 128 . 3 1 1 A 10 10 LEU CA C 10 58.000 57.994 0.006 1
1 129 . 3 1 1 A 10 10 LEU CB C 10 41.400 41.340 0.060 1
1 133 . 3 1 1 A 10 10 LEU N N 10 118.000 119.813 -1.813 1
1 134 . 3 1 1 A 11 11 GLU H H 11 7.990 8.417 -0.427 1
1 135 . 3 1 1 A 11 11 GLU HA H 11 4.110 4.278 -0.168 1
1 140 . 3 1 1 A 11 11 GLU C C 11 174.200 178.949 -4.749 1
1 141 . 3 1 1 A 11 11 GLU CA C 11 59.200 59.310 -0.110 1
1 142 . 3 1 1 A 11 11 GLU CB C 11 29.300 28.870 0.430 1
1 144 . 3 1 1 A 11 11 GLU N N 11 118.300 117.550 0.750 1
1 145 . 3 1 1 A 12 12 ASP H H 12 8.080 8.045 0.035 1
1 146 . 3 1 1 A 12 12 ASP HA H 12 4.340 4.358 -0.018 1
1 149 . 3 1 1 A 12 12 ASP C C 12 178.900 178.014 0.886 1
1 150 . 3 1 1 A 12 12 ASP CA C 12 57.600 56.670 0.930 1
1 151 . 3 1 1 A 12 12 ASP CB C 12 41.000 40.971 0.029 1
1 152 . 3 1 1 A 12 12 ASP N N 12 121.800 119.984 1.816 1
1 153 . 3 1 1 A 13 13 ILE H H 13 7.610 7.426 0.184 1
1 154 . 3 1 1 A 13 13 ILE HA H 13 4.240 4.028 0.212 1
1 164 . 3 1 1 A 13 13 ILE C C 13 176.800 176.546 0.254 1
1 165 . 3 1 1 A 13 13 ILE CA C 13 62.100 60.677 1.423 1
1 166 . 3 1 1 A 13 13 ILE CB C 13 38.300 37.321 0.979 1
1 170 . 3 1 1 A 13 13 ILE N N 13 110.800 111.274 -0.474 1
1 171 . 3 1 1 A 14 14 GLY H H 14 7.640 7.638 0.002 1
1 172 . 3 1 1 A 14 14 GLY HA2 H 14 3.810 3.949 -0.139 1
1 173 . 3 1 1 A 14 14 GLY HA3 H 14 3.880 3.959 -0.079 1
1 174 . 3 1 1 A 14 14 GLY C C 14 175.200 174.384 0.816 1
1 175 . 3 1 1 A 14 14 GLY CA C 14 46.900 46.385 0.515 1
1 176 . 3 1 1 A 14 14 GLY N N 14 111.800 111.977 -0.177 1
1 177 . 3 1 1 A 15 15 GLU H H 15 7.870 8.245 -0.375 1
1 178 . 3 1 1 A 15 15 GLU HA H 15 4.680 4.715 -0.035 1
1 183 . 3 1 1 A 15 15 GLU C C 15 175.100 175.829 -0.729 1
1 184 . 3 1 1 A 15 15 GLU CA C 15 54.800 54.690 0.110 1
1 185 . 3 1 1 A 15 15 GLU CB C 15 32.200 31.668 0.532 1
1 187 . 3 1 1 A 15 15 GLU N N 15 119.200 118.930 0.270 1
1 188 . 3 1 1 A 16 16 ASP H H 16 8.220 8.685 -0.465 1
1 189 . 3 1 1 A 16 16 ASP HA H 16 4.680 5.057 -0.377 1
1 192 . 3 1 1 A 16 16 ASP C C 16 174.600 175.559 -0.959 1
1 193 . 3 1 1 A 16 16 ASP CA C 16 53.600 53.302 0.298 1
1 194 . 3 1 1 A 16 16 ASP CB C 16 42.900 42.744 0.156 1
1 195 . 3 1 1 A 16 16 ASP N N 16 120.600 120.977 -0.377 1
1 196 . 3 1 1 A 17 17 TYR H H 17 7.540 8.479 -0.939 1
1 197 . 3 1 1 A 17 17 TYR HA H 17 4.910 5.444 -0.534 1
1 202 . 3 1 1 A 17 17 TYR C C 17 173.600 172.778 0.822 1
1 203 . 3 1 1 A 17 17 TYR CA C 17 56.200 56.067 0.133 1
1 204 . 3 1 1 A 17 17 TYR CB C 17 41.100 41.738 -0.638 1
1 207 . 3 1 1 A 17 17 TYR N N 17 112.700 117.807 -5.107 1
1 208 . 3 1 1 A 18 18 ILE H H 18 7.950 9.439 -1.489 1
1 209 . 3 1 1 A 18 18 ILE HA H 18 4.330 4.616 -0.286 1
1 219 . 3 1 1 A 18 18 ILE C C 18 174.700 174.582 0.118 1
1 220 . 3 1 1 A 18 18 ILE CA C 18 60.300 60.860 -0.560 1
1 221 . 3 1 1 A 18 18 ILE CB C 18 41.000 37.434 3.566 1
1 225 . 3 1 1 A 18 18 ILE N N 18 120.400 122.323 -1.923 1
1 226 . 3 1 1 A 19 19 GLU H H 19 8.760 9.127 -0.367 1
1 227 . 3 1 1 A 19 19 GLU HA H 19 5.200 4.940 0.260 1
1 232 . 3 1 1 A 19 19 GLU C C 19 175.200 175.751 -0.551 1
1 233 . 3 1 1 A 19 19 GLU CA C 19 55.500 55.756 -0.256 1
1 234 . 3 1 1 A 19 19 GLU CB C 19 32.400 31.024 1.376 1
1 236 . 3 1 1 A 19 19 GLU N N 19 129.000 128.889 0.111 1
1 237 . 3 1 1 A 20 20 LEU H H 20 8.730 9.520 -0.790 1
1 238 . 3 1 1 A 20 20 LEU HA H 20 4.620 4.896 -0.276 1
1 248 . 3 1 1 A 20 20 LEU C C 20 176.200 176.222 -0.022 1
1 249 . 3 1 1 A 20 20 LEU CA C 20 54.100 53.518 0.582 1
1 250 . 3 1 1 A 20 20 LEU CB C 20 44.400 43.269 1.131 1
1 254 . 3 1 1 A 20 20 LEU N N 20 128.400 128.511 -0.111 1
1 255 . 3 1 1 A 21 21 GLU H H 21 8.700 8.678 0.022 1
1 256 . 3 1 1 A 21 21 GLU HA H 21 3.870 4.259 -0.389 1
1 261 . 3 1 1 A 21 21 GLU C C 21 176.100 176.805 -0.705 1
1 262 . 3 1 1 A 21 21 GLU CA C 21 58.800 56.685 2.115 1
1 263 . 3 1 1 A 21 21 GLU CB C 21 28.200 29.278 -1.078 1
1 265 . 3 1 1 A 21 21 GLU N N 21 122.600 119.838 2.762 1
1 266 . 3 1 1 A 22 22 ASN H H 22 8.640 8.948 -0.308 1
1 267 . 3 1 1 A 22 22 ASN HA H 22 4.540 4.361 0.179 1
1 272 . 3 1 1 A 22 22 ASN C C 22 173.800 173.861 -0.061 1
1 273 . 3 1 1 A 22 22 ASN CA C 22 54.600 54.723 -0.123 1
1 274 . 3 1 1 A 22 22 ASN CB C 22 38.400 36.781 1.619 1
1 275 . 3 1 1 A 22 22 ASN N N 22 118.000 120.620 -2.620 1
1 277 . 3 1 1 A 23 23 GLU H H 23 7.740 7.693 0.047 1
1 278 . 3 1 1 A 23 23 GLU HA H 23 5.430 5.054 0.376 1
1 283 . 3 1 1 A 23 23 GLU C C 23 175.400 174.936 0.464 1
1 284 . 3 1 1 A 23 23 GLU CA C 23 54.900 55.038 -0.138 1
1 285 . 3 1 1 A 23 23 GLU CB C 23 34.500 33.057 1.443 1
1 287 . 3 1 1 A 23 23 GLU N N 23 116.400 117.100 -0.700 1
1 288 . 3 1 1 A 24 24 ILE H H 24 9.050 9.590 -0.540 1
1 289 . 3 1 1 A 24 24 ILE HA H 24 4.810 4.950 -0.140 1
1 299 . 3 1 1 A 24 24 ILE C C 24 174.600 175.152 -0.552 1
1 300 . 3 1 1 A 24 24 ILE CA C 24 60.700 60.548 0.152 1
1 301 . 3 1 1 A 24 24 ILE CB C 24 41.300 39.951 1.349 1
1 305 . 3 1 1 A 24 24 ILE N N 24 122.800 123.825 -1.025 1
1 306 . 3 1 1 A 25 25 HIS H H 25 9.490 9.426 0.064 1
1 307 . 3 1 1 A 25 25 HIS HA H 25 5.090 5.523 -0.433 1
1 312 . 3 1 1 A 25 25 HIS C C 25 176.100 175.130 0.970 1
1 313 . 3 1 1 A 25 25 HIS CA C 25 56.100 55.044 1.056 1
1 314 . 3 1 1 A 25 25 HIS CB C 25 33.100 31.268 1.832 1
1 317 . 3 1 1 A 25 25 HIS N N 25 127.300 126.072 1.228 1
1 318 . 3 1 1 A 26 26 LEU H H 26 8.820 9.078 -0.258 1
1 319 . 3 1 1 A 26 26 LEU HA H 26 5.160 5.015 0.145 1
1 329 . 3 1 1 A 26 26 LEU C C 26 178.000 176.172 1.828 1
1 330 . 3 1 1 A 26 26 LEU CA C 26 52.900 53.507 -0.607 1
1 331 . 3 1 1 A 26 26 LEU CB C 26 48.100 44.286 3.814 1
1 335 . 3 1 1 A 26 26 LEU N N 26 121.600 124.671 -3.071 1
1 336 . 3 1 1 A 27 27 LYS H H 27 8.990 8.793 0.197 1
1 337 . 3 1 1 A 27 27 LYS HA H 27 4.630 4.522 0.108 1
1 345 . 3 1 1 A 27 27 LYS CA C 27 55.700 54.786 0.914 1
1 346 . 3 1 1 A 27 27 LYS CB C 27 31.900 32.079 -0.179 1
1 350 . 3 1 1 A 27 27 LYS N N 27 125.900 120.785 5.115 1
1 351 . 3 1 1 A 28 28 PRO HA H 28 4.500 4.390 0.110 1
1 358 . 3 1 1 A 28 28 PRO C C 28 177.900 178.296 -0.396 1
1 359 . 3 1 1 A 28 28 PRO CA C 28 67.400 65.947 1.453 1
1 360 . 3 1 1 A 28 28 PRO CB C 28 32.100 31.817 0.283 1
1 363 . 3 1 1 A 29 29 GLU H H 29 9.880 8.281 1.599 1
1 364 . 3 1 1 A 29 29 GLU HA H 29 4.140 4.346 -0.206 1
1 369 . 3 1 1 A 29 29 GLU C C 29 178.800 179.451 -0.651 1
1 370 . 3 1 1 A 29 29 GLU CA C 29 60.600 59.674 0.926 1
1 371 . 3 1 1 A 29 29 GLU CB C 29 29.200 29.258 -0.058 1
1 373 . 3 1 1 A 29 29 GLU N N 29 117.100 118.283 -1.183 1
1 374 . 3 1 1 A 30 30 VAL H H 30 7.050 7.786 -0.736 1
1 375 . 3 1 1 A 30 30 VAL HA H 30 3.850 3.872 -0.022 1
1 383 . 3 1 1 A 30 30 VAL C C 30 177.700 178.337 -0.637 1
1 384 . 3 1 1 A 30 30 VAL CA C 30 65.600 66.166 -0.566 1
1 385 . 3 1 1 A 30 30 VAL CB C 30 32.100 32.038 0.062 1
1 388 . 3 1 1 A 30 30 VAL N N 30 120.900 120.659 0.241 1
1 389 . 3 1 1 A 31 31 PHE H H 31 8.980 8.962 0.018 1
1 390 . 3 1 1 A 31 31 PHE HA H 31 3.870 4.287 -0.417 1
1 394 . 3 1 1 A 31 31 PHE C C 31 176.700 177.162 -0.462 1
1 395 . 3 1 1 A 31 31 PHE CA C 31 62.200 61.901 0.299 1
1 396 . 3 1 1 A 31 31 PHE CB C 31 39.300 39.084 0.216 1
1 398 . 3 1 1 A 31 31 PHE N N 31 121.100 120.661 0.439 1
1 399 . 3 1 1 A 32 32 TYR H H 32 8.640 8.434 0.206 1
1 400 . 3 1 1 A 32 32 TYR HA H 32 3.880 4.890 -1.010 1
1 405 . 3 1 1 A 32 32 TYR C C 32 176.000 178.249 -2.249 1
1 406 . 3 1 1 A 32 32 TYR CA C 32 63.300 62.261 1.039 1
1 407 . 3 1 1 A 32 32 TYR CB C 32 39.100 39.084 0.016 1
1 410 . 3 1 1 A 32 32 TYR N N 32 117.400 121.015 -3.615 1
1 411 . 3 1 1 A 33 33 GLU H H 33 7.400 7.927 -0.527 1
1 412 . 3 1 1 A 33 33 GLU HA H 33 4.050 4.123 -0.073 1
1 417 . 3 1 1 A 33 33 GLU C C 33 180.200 179.266 0.934 1
1 418 . 3 1 1 A 33 33 GLU CA C 33 59.500 58.971 0.529 1
1 419 . 3 1 1 A 33 33 GLU CB C 33 29.300 29.589 -0.289 1
1 421 . 3 1 1 A 33 33 GLU N N 33 116.100 118.820 -2.720 1
1 422 . 3 1 1 A 34 34 VAL H H 34 8.530 7.807 0.723 1
1 423 . 3 1 1 A 34 34 VAL HA H 34 3.350 3.632 -0.282 1
1 431 . 3 1 1 A 34 34 VAL C C 34 175.800 178.282 -2.482 1
1 432 . 3 1 1 A 34 34 VAL CA C 34 66.400 66.237 0.163 1
1 433 . 3 1 1 A 34 34 VAL CB C 34 32.200 31.861 0.339 1
1 436 . 3 1 1 A 34 34 VAL N N 34 120.600 120.220 0.380 1
1 437 . 3 1 1 A 35 35 TRP H H 35 9.100 8.606 0.494 1
1 438 . 3 1 1 A 35 35 TRP HA H 35 3.340 3.607 -0.267 1
1 447 . 3 1 1 A 35 35 TRP C C 35 178.000 178.407 -0.407 1
1 448 . 3 1 1 A 35 35 TRP CA C 35 61.800 60.362 1.438 1
1 449 . 3 1 1 A 35 35 TRP CB C 35 27.900 29.440 -1.540 1
1 455 . 3 1 1 A 35 35 TRP N N 35 121.700 121.528 0.172 1
1 457 . 3 1 1 A 36 36 LYS H H 36 7.970 7.694 0.276 1
1 458 . 3 1 1 A 36 36 LYS HA H 36 3.330 3.550 -0.220 1
1 467 . 3 1 1 A 36 36 LYS C C 36 180.000 178.012 1.988 1
1 468 . 3 1 1 A 36 36 LYS CA C 36 59.000 58.744 0.256 1
1 469 . 3 1 1 A 36 36 LYS CB C 36 31.800 32.306 -0.506 1
1 473 . 3 1 1 A 36 36 LYS N N 36 116.300 118.162 -1.862 1
1 474 . 3 1 1 A 37 37 TYR H H 37 7.750 8.172 -0.422 1
1 475 . 3 1 1 A 37 37 TYR HA H 37 3.940 3.897 0.043 1
1 480 . 3 1 1 A 37 37 TYR C C 37 177.600 177.582 0.018 1
1 481 . 3 1 1 A 37 37 TYR CA C 37 61.200 61.106 0.094 1
1 482 . 3 1 1 A 37 37 TYR CB C 37 38.800 38.378 0.422 1
1 485 . 3 1 1 A 37 37 TYR N N 37 122.700 121.556 1.144 1
1 486 . 3 1 1 A 38 38 VAL H H 38 7.660 7.287 0.373 1
1 487 . 3 1 1 A 38 38 VAL HA H 38 3.870 3.871 -0.001 1
1 495 . 3 1 1 A 38 38 VAL C C 38 175.600 176.118 -0.518 1
1 496 . 3 1 1 A 38 38 VAL CA C 38 61.100 61.403 -0.303 1
1 497 . 3 1 1 A 38 38 VAL CB C 38 30.700 31.063 -0.363 1
1 500 . 3 1 1 A 38 38 VAL N N 38 108.200 113.019 -4.819 1
1 501 . 3 1 1 A 39 39 GLY H H 39 7.090 7.558 -0.468 1
1 502 . 3 1 1 A 39 39 GLY HA2 H 39 3.320 3.764 -0.444 1
1 503 . 3 1 1 A 39 39 GLY HA3 H 39 3.730 3.785 -0.055 1
1 504 . 3 1 1 A 39 39 GLY C C 39 173.600 174.469 -0.869 1
1 505 . 3 1 1 A 39 39 GLY CA C 39 46.100 44.970 1.130 1
1 506 . 3 1 1 A 39 39 GLY N N 39 107.600 110.071 -2.471 1
1 507 . 3 1 1 A 40 40 GLU H H 40 7.730 7.899 -0.169 1
1 508 . 3 1 1 A 40 40 GLU HA H 40 1.090 3.180 -2.090 1
1 513 . 3 1 1 A 40 40 GLU CA C 40 55.700 56.678 -0.978 1
1 514 . 3 1 1 A 40 40 GLU CB C 40 27.200 27.547 -0.347 1
1 516 . 3 1 1 A 40 40 GLU N N 40 114.400 119.272 -4.872 1
1 517 . 3 1 1 A 41 41 PRO HA H 41 4.310 4.547 -0.237 1
1 524 . 3 1 1 A 41 41 PRO CA C 41 62.300 62.105 0.195 1
1 525 . 3 1 1 A 41 41 PRO CB C 41 32.700 32.954 -0.254 1
1 528 . 3 1 1 A 42 42 GLU H H 42 8.110 8.626 -0.516 1
1 529 . 3 1 1 A 42 42 GLU C C 42 175.800 176.676 -0.876 1
1 530 . 3 1 1 A 42 42 GLU CA C 42 57.800 57.265 0.535 1
1 531 . 3 1 1 A 42 42 GLU CB C 42 30.600 30.407 0.193 1
1 533 . 3 1 1 A 42 42 GLU N N 42 119.100 120.083 -0.983 1
1 534 . 3 1 1 A 43 43 LEU H H 43 8.140 8.677 -0.537 1
1 535 . 3 1 1 A 43 43 LEU HA H 43 4.840 4.912 -0.072 1
1 545 . 3 1 1 A 43 43 LEU C C 43 177.300 175.583 1.717 1
1 546 . 3 1 1 A 43 43 LEU CA C 43 53.700 53.785 -0.085 1
1 547 . 3 1 1 A 43 43 LEU CB C 43 43.900 42.708 1.192 1
1 551 . 3 1 1 A 43 43 LEU N N 43 124.700 124.624 0.076 1
1 552 . 3 1 1 A 44 44 LYS H H 44 8.640 8.495 0.145 1
1 553 . 3 1 1 A 44 44 LYS HA H 44 4.500 4.798 -0.298 1
1 562 . 3 1 1 A 44 44 LYS C C 44 174.500 175.628 -1.128 1
1 563 . 3 1 1 A 44 44 LYS CA C 44 54.700 54.690 0.010 1
1 564 . 3 1 1 A 44 44 LYS CB C 44 36.200 34.810 1.390 1
1 568 . 3 1 1 A 44 44 LYS N N 44 123.300 124.498 -1.198 1
1 569 . 3 1 1 A 45 45 THR H H 45 7.990 8.657 -0.667 1
1 570 . 3 1 1 A 45 45 THR HA H 45 5.700 5.523 0.177 1
1 575 . 3 1 1 A 45 45 THR C C 45 175.100 173.644 1.456 1
1 576 . 3 1 1 A 45 45 THR CA C 45 59.600 59.072 0.528 1
1 577 . 3 1 1 A 45 45 THR CB C 45 73.400 72.219 1.181 1
1 579 . 3 1 1 A 45 45 THR N N 45 106.900 113.302 -6.402 1
1 580 . 3 1 1 A 46 46 TYR H H 46 8.470 9.134 -0.664 1
1 581 . 3 1 1 A 46 46 TYR HA H 46 4.930 5.594 -0.664 1
1 586 . 3 1 1 A 46 46 TYR C C 46 172.400 173.150 -0.750 1
1 587 . 3 1 1 A 46 46 TYR CA C 46 57.100 55.682 1.418 1
1 588 . 3 1 1 A 46 46 TYR CB C 46 40.200 42.099 -1.899 1
1 591 . 3 1 1 A 46 46 TYR N N 46 117.100 118.844 -1.744 1
1 592 . 3 1 1 A 47 47 VAL H H 47 8.430 8.977 -0.547 1
1 593 . 3 1 1 A 47 47 VAL HA H 47 4.890 4.687 0.203 1
1 601 . 3 1 1 A 47 47 VAL C C 47 175.800 174.375 1.425 1
1 602 . 3 1 1 A 47 47 VAL CA C 47 60.800 62.089 -1.289 1
1 603 . 3 1 1 A 47 47 VAL CB C 47 34.800 32.887 1.913 1
1 606 . 3 1 1 A 47 47 VAL N N 47 119.200 122.762 -3.562 1
1 607 . 3 1 1 A 48 48 ILE H H 48 8.680 9.510 -0.830 1
1 608 . 3 1 1 A 48 48 ILE HA H 48 4.560 4.966 -0.406 1
1 618 . 3 1 1 A 48 48 ILE C C 48 174.500 174.901 -0.401 1
1 619 . 3 1 1 A 48 48 ILE CA C 48 59.700 59.401 0.299 1
1 620 . 3 1 1 A 48 48 ILE CB C 48 41.500 40.383 1.117 1
1 624 . 3 1 1 A 48 48 ILE N N 48 124.400 129.575 -5.175 1
1 625 . 3 1 1 A 49 49 GLU H H 49 8.320 8.926 -0.606 1
1 626 . 3 1 1 A 49 49 GLU C C 49 175.500 174.819 0.681 1
1 627 . 3 1 1 A 49 49 GLU CA C 49 55.500 56.112 -0.612 1
1 628 . 3 1 1 A 49 49 GLU CB C 49 31.800 30.466 1.334 1
1 630 . 3 1 1 A 49 49 GLU N N 49 123.400 130.328 -6.928 1
1 631 . 3 1 1 A 50 50 ASP H H 50 8.610 9.265 -0.655 1
1 632 . 3 1 1 A 50 50 ASP C C 50 175.100 174.158 0.942 1
1 633 . 3 1 1 A 50 50 ASP CA C 50 53.100 52.661 0.439 1
1 634 . 3 1 1 A 50 50 ASP CB C 50 44.000 43.745 0.255 1
1 635 . 3 1 1 A 50 50 ASP N N 50 124.300 127.509 -3.209 1
1 636 . 3 1 1 A 51 51 GLU H H 51 8.450 8.934 -0.484 1
1 637 . 3 1 1 A 51 51 GLU C C 51 175.900 175.515 0.385 1
1 638 . 3 1 1 A 51 51 GLU CA C 51 56.000 55.619 0.381 1
1 639 . 3 1 1 A 51 51 GLU CB C 51 31.700 31.350 0.350 1
1 640 . 3 1 1 A 51 51 GLU N N 51 121.300 127.410 -6.110 1
1 641 . 3 1 1 A 52 52 ILE H H 52 8.480 8.704 -0.224 1
1 642 . 3 1 1 A 52 52 ILE C C 52 175.400 175.011 0.389 1
1 643 . 3 1 1 A 52 52 ILE CA C 52 60.400 60.644 -0.244 1
1 644 . 3 1 1 A 52 52 ILE CB C 52 40.000 36.968 3.032 1
1 645 . 3 1 1 A 52 52 ILE N N 52 122.700 129.000 -6.300 1
1 646 . 3 1 1 A 53 53 VAL H H 53 8.140 8.896 -0.756 1
1 647 . 3 1 1 A 53 53 VAL C C 53 175.600 174.448 1.152 1
1 648 . 3 1 1 A 53 53 VAL CA C 53 61.900 59.585 2.315 1
1 649 . 3 1 1 A 53 53 VAL CB C 53 33.200 35.011 -1.811 1
1 650 . 3 1 1 A 53 53 VAL N N 53 124.400 127.435 -3.035 1
1 651 . 3 1 1 A 54 54 GLU H H 54 8.540 8.507 0.033 1
1 652 . 3 1 1 A 54 54 GLU CA C 54 55.600 52.896 2.704 1
1 653 . 3 1 1 A 54 54 GLU CB C 54 34.300 30.337 3.963 1
1 654 . 3 1 1 A 54 54 GLU N N 54 125.900 125.462 0.438 1
1 655 . 3 1 1 A 55 55 PRO C C 55 177.500 176.030 1.470 1
1 656 . 3 1 1 A 55 55 PRO CA C 55 63.400 62.442 0.958 1
1 657 . 3 1 1 A 55 55 PRO CB C 55 32.300 29.637 2.663 1
1 658 . 3 1 1 A 56 56 GLY H H 56 8.420 8.234 0.186 1
1 659 . 3 1 1 A 56 56 GLY HA2 H 56 3.830 3.925 -0.095 1
1 660 . 3 1 1 A 56 56 GLY HA3 H 56 4.000 3.960 0.040 1
1 661 . 3 1 1 A 56 56 GLY C C 56 174.500 173.636 0.864 1
1 662 . 3 1 1 A 56 56 GLY CA C 56 45.400 45.496 -0.096 1
1 663 . 3 1 1 A 56 56 GLY N N 56 109.700 108.820 0.880 1
1 664 . 3 1 1 A 57 57 GLU H H 57 8.180 7.577 0.603 1
1 665 . 3 1 1 A 57 57 GLU C C 57 176.300 176.536 -0.236 1
1 666 . 3 1 1 A 57 57 GLU CA C 57 57.500 55.599 1.901 1
1 667 . 3 1 1 A 57 57 GLU CB C 57 30.400 30.563 -0.163 1
1 668 . 3 1 1 A 57 57 GLU N N 57 120.900 119.993 0.907 1
1 669 . 3 1 1 A 58 58 TYR H H 58 8.020 8.564 -0.544 1
1 670 . 3 1 1 A 58 58 TYR C C 58 175.100 176.190 -1.090 1
1 671 . 3 1 1 A 58 58 TYR CA C 58 57.400 59.756 -2.356 1
1 672 . 3 1 1 A 58 58 TYR CB C 58 38.900 38.464 0.436 1
1 673 . 3 1 1 A 58 58 TYR N N 58 118.800 123.009 -4.209 1
1 674 . 3 1 1 A 59 59 ASP H H 59 7.950 7.908 0.042 1
1 675 . 3 1 1 A 59 59 ASP CA C 59 52.700 51.153 1.547 1
1 676 . 3 1 1 A 59 59 ASP CB C 59 41.000 41.136 -0.136 1
1 677 . 3 1 1 A 59 59 ASP N N 59 123.500 119.049 4.451 1
1 678 . 3 1 1 A 61 61 PRO HA H 61 4.510 4.623 -0.113 1
1 685 . 3 1 1 A 61 61 PRO C C 61 176.500 177.825 -1.325 1
1 686 . 3 1 1 A 61 61 PRO CA C 61 63.700 62.603 1.097 1
1 687 . 3 1 1 A 61 61 PRO CB C 61 34.200 31.683 2.517 1
1 690 . 3 1 1 A 62 62 GLU H H 62 8.490 8.955 -0.465 1
1 691 . 3 1 1 A 62 62 GLU N N 62 124.600 123.905 0.695 1
1 692 . 3 1 1 A 64 64 LYS C C 64 176.300 176.434 -0.134 1
1 693 . 3 1 1 A 64 64 LYS CA C 64 57.000 55.205 1.795 1
1 694 . 3 1 1 A 64 64 LYS CB C 64 33.100 31.079 2.021 1
1 695 . 3 1 1 A 65 65 TYR H H 65 7.960 8.752 -0.792 1
1 696 . 3 1 1 A 65 65 TYR C C 65 176.000 175.737 0.263 1
1 697 . 3 1 1 A 65 65 TYR CA C 65 57.800 61.813 -4.013 1
1 698 . 3 1 1 A 65 65 TYR CB C 65 38.800 39.262 -0.462 1
1 699 . 3 1 1 A 65 65 TYR N N 65 119.300 127.289 -7.989 1
1 700 . 3 1 1 A 66 66 THR H H 66 7.820 7.935 -0.115 1
1 701 . 3 1 1 A 66 66 THR HA H 66 4.280 4.478 -0.198 1
1 706 . 3 1 1 A 66 66 THR C C 66 174.100 174.390 -0.290 1
1 707 . 3 1 1 A 66 66 THR CA C 66 62.100 60.975 1.125 1
1 708 . 3 1 1 A 66 66 THR CB C 66 70.000 70.379 -0.379 1
1 710 . 3 1 1 A 66 66 THR N N 66 113.900 113.604 0.296 1
1 711 . 3 1 1 A 67 67 ASN H H 67 8.270 8.674 -0.404 1
1 712 . 3 1 1 A 67 67 ASN C C 67 174.100 175.117 -1.017 1
1 713 . 3 1 1 A 67 67 ASN CA C 67 53.400 53.194 0.206 1
1 714 . 3 1 1 A 67 67 ASN CB C 67 39.300 38.545 0.755 1
1 715 . 3 1 1 A 67 67 ASN N N 67 121.400 123.107 -1.707 1
1 716 . 3 1 1 A 68 68 VAL H H 68 7.660 8.325 -0.665 1
1 717 . 3 1 1 A 68 68 VAL C C 68 175.500 175.220 0.280 1
1 718 . 3 1 1 A 68 68 VAL CA C 68 61.800 62.328 -0.528 1
1 719 . 3 1 1 A 68 68 VAL CB C 68 33.700 32.646 1.054 1
1 720 . 3 1 1 A 68 68 VAL N N 68 119.400 123.636 -4.236 1
1 721 . 3 1 1 A 69 69 LYS H H 69 8.690 8.617 0.073 1
1 722 . 3 1 1 A 69 69 LYS C C 69 175.200 175.082 0.118 1
1 723 . 3 1 1 A 69 69 LYS CA C 69 55.200 55.071 0.129 1
1 724 . 3 1 1 A 69 69 LYS CB C 69 35.200 33.691 1.509 1
1 725 . 3 1 1 A 69 69 LYS N N 69 126.500 125.381 1.119 1
1 726 . 3 1 1 A 70 70 LYS H H 70 8.230 8.860 -0.630 1
1 727 . 3 1 1 A 70 70 LYS C C 70 176.400 176.067 0.333 1
1 728 . 3 1 1 A 70 70 LYS CA C 70 55.600 55.425 0.175 1
1 729 . 3 1 1 A 70 70 LYS CB C 70 33.800 33.799 0.001 1
1 730 . 3 1 1 A 70 70 LYS N N 70 122.700 127.821 -5.121 1
1 731 . 3 1 1 A 71 71 VAL H H 71 8.530 9.277 -0.747 1
1 732 . 3 1 1 A 71 71 VAL HA H 71 4.510 4.884 -0.374 1
1 733 . 3 1 1 A 71 71 VAL C C 71 174.700 174.644 0.056 1
1 734 . 3 1 1 A 71 71 VAL CA C 71 60.900 60.025 0.875 1
1 735 . 3 1 1 A 71 71 VAL CB C 71 34.800 33.575 1.225 1
1 738 . 3 1 1 A 71 71 VAL N N 71 121.200 119.749 1.451 1
1 739 . 3 1 1 A 72 72 LYS H H 72 8.210 8.720 -0.510 1
1 740 . 3 1 1 A 72 72 LYS HA H 72 4.800 4.844 -0.044 1
1 747 . 3 1 1 A 72 72 LYS C C 72 176.200 175.409 0.791 1
1 748 . 3 1 1 A 72 72 LYS CA C 72 55.700 55.131 0.569 1
1 749 . 3 1 1 A 72 72 LYS CB C 72 33.700 33.040 0.660 1
1 752 . 3 1 1 A 72 72 LYS N N 72 123.600 122.106 1.494 1
1 753 . 3 1 1 A 73 73 ILE H H 73 8.890 8.794 0.096 1
1 754 . 3 1 1 A 73 73 ILE C C 73 174.400 174.880 -0.480 1
1 755 . 3 1 1 A 73 73 ILE CA C 73 60.400 59.929 0.471 1
1 756 . 3 1 1 A 73 73 ILE CB C 73 40.800 39.403 1.397 1
1 760 . 3 1 1 A 73 73 ILE N N 73 125.100 126.132 -1.032 1
1 761 . 3 1 1 A 74 74 LYS H H 74 8.420 8.860 -0.440 1
1 762 . 3 1 1 A 74 74 LYS HA H 74 4.800 4.876 -0.076 1
1 771 . 3 1 1 A 74 74 LYS C C 74 175.600 174.895 0.705 1
1 772 . 3 1 1 A 74 74 LYS CA C 74 56.200 54.568 1.632 1
1 773 . 3 1 1 A 74 74 LYS CB C 74 34.300 34.334 -0.034 1
1 777 . 3 1 1 A 74 74 LYS N N 74 126.400 127.811 -1.411 1
1 778 . 3 1 1 A 75 75 LYS H H 75 9.090 8.607 0.483 1
1 779 . 3 1 1 A 75 75 LYS HA H 75 4.800 4.811 -0.011 1
1 788 . 3 1 1 A 75 75 LYS C C 75 174.900 174.854 0.046 1
1 789 . 3 1 1 A 75 75 LYS CA C 75 53.200 54.901 -1.701 1
1 790 . 3 1 1 A 75 75 LYS CB C 75 34.200 33.972 0.228 1
1 794 . 3 1 1 A 75 75 LYS N N 75 127.500 127.102 0.398 1
1 795 . 3 1 1 A 76 76 VAL H H 76 8.610 8.910 -0.300 1
1 796 . 3 1 1 A 76 76 VAL HA H 76 5.340 4.960 0.380 1
1 804 . 3 1 1 A 76 76 VAL C C 76 171.400 173.977 -2.577 1
1 805 . 3 1 1 A 76 76 VAL CA C 76 58.000 59.530 -1.530 1
1 806 . 3 1 1 A 76 76 VAL CB C 76 36.400 34.593 1.807 1
1 809 . 3 1 1 A 76 76 VAL N N 76 120.100 120.823 -0.723 1
1 810 . 3 1 1 A 77 77 TYR H H 77 9.110 9.240 -0.130 1
1 811 . 3 1 1 A 77 77 TYR HA H 77 6.150 6.083 0.067 1
1 816 . 3 1 1 A 77 77 TYR C C 77 173.600 173.080 0.520 1
1 817 . 3 1 1 A 77 77 TYR CA C 77 56.200 55.767 0.433 1
1 818 . 3 1 1 A 77 77 TYR CB C 77 44.000 41.530 2.470 1
1 821 . 3 1 1 A 77 77 TYR N N 77 121.300 122.151 -0.851 1
1 822 . 3 1 1 A 78 78 PHE H H 78 8.190 8.617 -0.427 1
1 823 . 3 1 1 A 78 78 PHE HA H 78 5.130 5.645 -0.515 1
1 829 . 3 1 1 A 78 78 PHE C C 78 173.600 172.898 0.702 1
1 830 . 3 1 1 A 78 78 PHE CA C 78 55.900 55.197 0.703 1
1 831 . 3 1 1 A 78 78 PHE CB C 78 42.500 42.789 -0.289 1
1 835 . 3 1 1 A 78 78 PHE N N 78 112.700 116.965 -4.265 1
1 836 . 3 1 1 A 79 79 GLU H H 79 8.920 9.050 -0.130 1
1 837 . 3 1 1 A 79 79 GLU HA H 79 5.390 5.401 -0.011 1
1 842 . 3 1 1 A 79 79 GLU C C 79 177.000 176.745 0.255 1
1 843 . 3 1 1 A 79 79 GLU CA C 79 54.900 55.289 -0.389 1
1 844 . 3 1 1 A 79 79 GLU CB C 79 33.600 31.915 1.685 1
1 846 . 3 1 1 A 79 79 GLU N N 79 120.500 120.020 0.480 1
1 847 . 3 1 1 A 80 80 THR H H 80 8.970 8.820 0.150 1
1 848 . 3 1 1 A 80 80 THR HA H 80 4.700 4.859 -0.159 1
1 854 . 3 1 1 A 80 80 THR C C 80 177.000 175.559 1.441 1
1 855 . 3 1 1 A 80 80 THR CA C 80 61.300 60.421 0.879 1
1 856 . 3 1 1 A 80 80 THR CB C 80 70.500 71.878 -1.378 1
1 858 . 3 1 1 A 80 80 THR N N 80 113.200 114.861 -1.661 1
1 859 . 3 1 1 A 81 81 LEU H H 81 8.610 8.942 -0.332 1
1 860 . 3 1 1 A 81 81 LEU HA H 81 4.230 4.142 0.088 1
1 870 . 3 1 1 A 81 81 LEU C C 81 177.400 178.780 -1.380 1
1 871 . 3 1 1 A 81 81 LEU CA C 81 57.700 58.407 -0.707 1
1 872 . 3 1 1 A 81 81 LEU CB C 81 42.400 41.448 0.952 1
1 876 . 3 1 1 A 81 81 LEU N N 81 120.900 123.119 -2.219 1
1 877 . 3 1 1 A 82 82 ASP H H 82 8.850 7.871 0.979 1
1 878 . 3 1 1 A 82 82 ASP HA H 82 4.670 4.706 -0.036 1
1 881 . 3 1 1 A 82 82 ASP C C 82 174.100 175.163 -1.063 1
1 882 . 3 1 1 A 82 82 ASP CA C 82 52.700 53.962 -1.262 1
1 883 . 3 1 1 A 82 82 ASP CB C 82 37.900 40.953 -3.053 1
1 884 . 3 1 1 A 82 82 ASP N N 82 112.300 117.159 -4.859 1
1 885 . 3 1 1 A 83 83 ASN H H 83 7.790 8.075 -0.285 1
1 886 . 3 1 1 A 83 83 ASN HA H 83 4.270 4.452 -0.182 1
1 891 . 3 1 1 A 83 83 ASN C C 83 176.100 174.612 1.488 1
1 892 . 3 1 1 A 83 83 ASN CA C 83 55.300 54.516 0.784 1
1 893 . 3 1 1 A 83 83 ASN CB C 83 36.900 36.992 -0.092 1
1 894 . 3 1 1 A 83 83 ASN N N 83 113.000 114.607 -1.607 1
1 896 . 3 1 1 A 84 84 VAL H H 84 7.660 7.526 0.134 1
1 897 . 3 1 1 A 84 84 VAL HA H 84 4.270 4.019 0.251 1
1 905 . 3 1 1 A 84 84 VAL C C 84 175.800 175.114 0.686 1
1 906 . 3 1 1 A 84 84 VAL CA C 84 61.500 62.560 -1.060 1
1 907 . 3 1 1 A 84 84 VAL CB C 84 33.500 31.971 1.529 1
1 910 . 3 1 1 A 84 84 VAL N N 84 119.700 119.585 0.115 1
1 911 . 3 1 1 A 85 85 ARG H H 85 8.180 9.098 -0.918 1
1 912 . 3 1 1 A 85 85 ARG HA H 85 4.870 4.753 0.117 1
1 920 . 3 1 1 A 85 85 ARG C C 85 174.000 175.003 -1.003 1
1 921 . 3 1 1 A 85 85 ARG CA C 85 55.700 55.867 -0.167 1
1 922 . 3 1 1 A 85 85 ARG CB C 85 32.600 30.628 1.972 1
1 925 . 3 1 1 A 85 85 ARG N N 85 124.800 127.819 -3.019 1
1 927 . 3 1 1 A 86 86 VAL H H 86 8.570 8.455 0.115 1
1 928 . 3 1 1 A 86 86 VAL HA H 86 4.580 4.573 0.007 1
1 936 . 3 1 1 A 86 86 VAL C C 86 175.700 175.069 0.631 1
1 937 . 3 1 1 A 86 86 VAL CA C 86 61.700 62.459 -0.759 1
1 938 . 3 1 1 A 86 86 VAL CB C 86 30.900 30.817 0.083 1
1 941 . 3 1 1 A 86 86 VAL N N 86 127.300 125.463 1.837 1
1 942 . 3 1 1 A 87 87 VAL H H 87 8.790 9.155 -0.365 1
1 943 . 3 1 1 A 87 87 VAL HA H 87 5.010 5.322 -0.312 1
1 951 . 3 1 1 A 87 87 VAL C C 87 175.500 174.941 0.559 1
1 952 . 3 1 1 A 87 87 VAL CA C 87 61.900 60.417 1.483 1
1 953 . 3 1 1 A 87 87 VAL CB C 87 36.300 34.425 1.875 1
1 956 . 3 1 1 A 87 87 VAL N N 87 125.700 128.613 -2.913 1
1 957 . 3 1 1 A 88 88 THR H H 88 8.350 8.673 -0.323 1
1 958 . 3 1 1 A 88 88 THR HA H 88 4.620 4.643 -0.023 1
1 964 . 3 1 1 A 88 88 THR C C 88 173.300 171.293 2.007 1
1 965 . 3 1 1 A 88 88 THR CA C 88 61.700 59.817 1.883 1
1 966 . 3 1 1 A 88 88 THR CB C 88 70.400 70.296 0.104 1
1 968 . 3 1 1 A 88 88 THR N N 88 117.500 119.018 -1.518 1
1 969 . 3 1 1 A 89 89 ASP H H 89 7.700 8.604 -0.904 1
1 970 . 3 1 1 A 89 89 ASP HA H 89 4.480 4.844 -0.364 1
1 973 . 3 1 1 A 89 89 ASP C C 89 175.900 177.138 -1.238 1
1 974 . 3 1 1 A 89 89 ASP CA C 89 55.900 53.579 2.321 1
1 975 . 3 1 1 A 89 89 ASP CB C 89 43.900 42.007 1.893 1
1 976 . 3 1 1 A 89 89 ASP N N 89 120.800 123.592 -2.792 1
1 977 . 3 1 1 A 90 90 TYR H H 90 8.240 8.828 -0.588 1
1 978 . 3 1 1 A 90 90 TYR HA H 90 3.920 4.160 -0.240 1
1 983 . 3 1 1 A 90 90 TYR C C 90 176.400 177.712 -1.312 1
1 984 . 3 1 1 A 90 90 TYR CA C 90 62.300 60.374 1.926 1
1 985 . 3 1 1 A 90 90 TYR CB C 90 39.500 39.438 0.062 1
1 988 . 3 1 1 A 90 90 TYR N N 90 126.100 128.149 -2.049 1
1 989 . 3 1 1 A 91 91 SER H H 91 9.160 7.955 1.205 1
1 990 . 3 1 1 A 91 91 SER HA H 91 4.000 4.068 -0.068 1
1 993 . 3 1 1 A 91 91 SER C C 91 178.000 177.176 0.824 1
1 994 . 3 1 1 A 91 91 SER CA C 91 62.600 61.949 0.651 1
1 995 . 3 1 1 A 91 91 SER CB C 91 62.200 63.121 -0.921 1
1 996 . 3 1 1 A 91 91 SER N N 91 116.600 115.663 0.937 1
1 997 . 3 1 1 A 92 92 GLU H H 92 8.590 8.318 0.272 1
1 998 . 3 1 1 A 92 92 GLU HA H 92 4.050 4.147 -0.097 1
1 1003 . 3 1 1 A 92 92 GLU C C 92 179.400 178.649 0.751 1
1 1004 . 3 1 1 A 92 92 GLU CA C 92 58.900 58.666 0.234 1
1 1005 . 3 1 1 A 92 92 GLU CB C 92 30.600 29.431 1.169 1
1 1007 . 3 1 1 A 92 92 GLU N N 92 120.200 121.268 -1.068 1
1 1008 . 3 1 1 A 93 93 PHE H H 93 7.870 8.281 -0.411 1
1 1009 . 3 1 1 A 93 93 PHE HA H 93 4.050 4.116 -0.066 1
1 1015 . 3 1 1 A 93 93 PHE C C 93 176.500 177.869 -1.369 1
1 1016 . 3 1 1 A 93 93 PHE CA C 93 62.200 60.985 1.215 1
1 1017 . 3 1 1 A 93 93 PHE CB C 93 39.700 39.129 0.571 1
1 1021 . 3 1 1 A 93 93 PHE N N 93 120.200 122.356 -2.156 1
1 1022 . 3 1 1 A 94 94 GLN H H 94 8.190 8.198 -0.008 1
1 1023 . 3 1 1 A 94 94 GLN HA H 94 3.390 3.534 -0.144 1
1 1030 . 3 1 1 A 94 94 GLN C C 94 178.600 177.986 0.614 1
1 1031 . 3 1 1 A 94 94 GLN CA C 94 58.800 59.146 -0.346 1
1 1032 . 3 1 1 A 94 94 GLN CB C 94 28.400 28.018 0.382 1
1 1034 . 3 1 1 A 94 94 GLN N N 94 116.800 118.558 -1.758 1
1 1036 . 3 1 1 A 95 95 LYS H H 95 7.060 7.804 -0.744 1
1 1037 . 3 1 1 A 95 95 LYS HA H 95 3.780 3.972 -0.192 1
1 1046 . 3 1 1 A 95 95 LYS C C 95 179.300 179.127 0.173 1
1 1047 . 3 1 1 A 95 95 LYS CA C 95 59.900 59.238 0.662 1
1 1048 . 3 1 1 A 95 95 LYS CB C 95 32.700 31.982 0.718 1
1 1052 . 3 1 1 A 95 95 LYS N N 95 117.500 121.238 -3.738 1
1 1053 . 3 1 1 A 96 96 ILE H H 96 7.240 7.517 -0.277 1
1 1054 . 3 1 1 A 96 96 ILE HA H 96 3.420 3.533 -0.113 1
1 1064 . 3 1 1 A 96 96 ILE C C 96 177.800 178.123 -0.323 1
1 1065 . 3 1 1 A 96 96 ILE CA C 96 64.300 64.957 -0.657 1
1 1066 . 3 1 1 A 96 96 ILE CB C 96 37.400 37.428 -0.028 1
1 1070 . 3 1 1 A 96 96 ILE N N 96 120.700 119.649 1.051 1
1 1071 . 3 1 1 A 97 97 LEU H H 97 7.690 8.198 -0.508 1
1 1072 . 3 1 1 A 97 97 LEU HA H 97 3.580 3.812 -0.232 1
1 1082 . 3 1 1 A 97 97 LEU C C 97 179.900 179.270 0.630 1
1 1083 . 3 1 1 A 97 97 LEU CA C 97 58.100 57.425 0.675 1
1 1084 . 3 1 1 A 97 97 LEU CB C 97 41.500 40.304 1.196 1
1 1088 . 3 1 1 A 97 97 LEU N N 97 120.000 119.679 0.321 1
1 1089 . 3 1 1 A 98 98 LYS H H 98 7.510 8.312 -0.802 1
1 1090 . 3 1 1 A 98 98 LYS HA H 98 3.950 3.908 0.042 1
1 1099 . 3 1 1 A 98 98 LYS C C 98 178.700 179.794 -1.094 1
1 1100 . 3 1 1 A 98 98 LYS CA C 98 58.700 60.050 -1.350 1
1 1101 . 3 1 1 A 98 98 LYS CB C 98 32.500 31.764 0.736 1
1 1105 . 3 1 1 A 98 98 LYS N N 98 117.300 118.902 -1.602 1
1 1106 . 3 1 1 A 99 99 LYS H H 99 7.470 7.378 0.092 1
1 1107 . 3 1 1 A 99 99 LYS HA H 99 4.080 4.123 -0.043 1
1 1116 . 3 1 1 A 99 99 LYS C C 99 178.100 179.265 -1.165 1
1 1117 . 3 1 1 A 99 99 LYS CA C 99 58.400 59.475 -1.075 1
1 1118 . 3 1 1 A 99 99 LYS CB C 99 33.000 32.165 0.835 1
1 1122 . 3 1 1 A 99 99 LYS N N 99 119.000 119.495 -0.495 1
1 1123 . 3 1 1 A 100 100 ARG H H 100 8.020 7.851 0.169 1
1 1124 . 3 1 1 A 100 100 ARG HA H 100 4.210 4.319 -0.109 1
1 1131 . 3 1 1 A 100 100 ARG C C 100 177.500 176.437 1.063 1
1 1132 . 3 1 1 A 100 100 ARG CA C 100 56.700 58.175 -1.475 1
1 1133 . 3 1 1 A 100 100 ARG CB C 100 30.500 31.076 -0.576 1
1 1136 . 3 1 1 A 100 100 ARG N N 100 117.300 118.334 -1.034 1
1 1137 . 3 1 1 A 101 101 GLY H H 101 7.910 7.943 -0.033 1
1 1138 . 3 1 1 A 101 101 GLY HA2 H 101 3.980 4.023 -0.043 1
1 1139 . 3 1 1 A 101 101 GLY HA3 H 101 4.020 4.039 -0.019 1
1 1140 . 3 1 1 A 101 101 GLY C C 101 174.400 175.290 -0.890 1
1 1141 . 3 1 1 A 101 101 GLY CA C 101 46.000 45.735 0.265 1
1 1142 . 3 1 1 A 101 101 GLY N N 101 108.000 107.364 0.636 1
1 1143 . 3 1 1 A 102 102 THR H H 102 7.880 8.212 -0.332 1
1 1144 . 3 1 1 A 102 102 THR HA H 102 4.360 4.131 0.229 1
1 1149 . 3 1 1 A 102 102 THR C C 102 174.400 174.730 -0.330 1
1 1150 . 3 1 1 A 102 102 THR CA C 102 62.100 66.278 -4.178 1
1 1151 . 3 1 1 A 102 102 THR CB C 102 70.500 68.829 1.671 1
1 1153 . 3 1 1 A 102 102 THR N N 102 113.900 112.603 1.297 1
1 1154 . 3 1 1 A 103 103 LYS H H 103 8.440 7.483 0.957 1
1 1155 . 3 1 1 A 103 103 LYS C C 103 176.400 175.352 1.048 1
1 1156 . 3 1 1 A 103 103 LYS CA C 103 56.600 55.174 1.426 1
1 1157 . 3 1 1 A 103 103 LYS CB C 103 33.300 32.448 0.852 1
1 1158 . 3 1 1 A 103 103 LYS N N 103 124.000 116.833 7.167 1
1 1159 . 3 1 1 A 104 104 LEU H H 104 8.180 7.247 0.933 1
1 1160 . 3 1 1 A 104 104 LEU HA H 104 4.270 4.581 -0.311 1
1 1170 . 3 1 1 A 104 104 LEU C C 104 177.100 176.052 1.048 1
1 1171 . 3 1 1 A 104 104 LEU CA C 104 55.500 53.402 2.098 1
1 1172 . 3 1 1 A 104 104 LEU CB C 104 42.500 42.922 -0.422 1
1 1176 . 3 1 1 A 104 104 LEU N N 104 123.500 121.910 1.590 1
1 1177 . 3 1 1 A 105 105 GLU H H 105 8.270 8.661 -0.391 1
1 1178 . 3 1 1 A 105 105 GLU CA C 105 56.700 58.515 -1.815 1
1 1179 . 3 1 1 A 105 105 GLU CB C 105 30.800 28.374 2.426 1
1 13 . 4 1 1 A 2 2 ASN HA H 2 4.980 5.084 -0.104 1
1 18 . 4 1 1 A 2 2 ASN C C 2 176.300 176.554 -0.254 1
1 19 . 4 1 1 A 2 2 ASN CA C 2 52.500 51.697 0.803 1
1 20 . 4 1 1 A 2 2 ASN CB C 2 40.900 40.770 0.130 1
1 22 . 4 1 1 A 3 3 SER H H 3 9.940 8.830 1.110 1
1 23 . 4 1 1 A 3 3 SER HA H 3 3.720 4.094 -0.374 1
1 26 . 4 1 1 A 3 3 SER C C 3 175.900 176.338 -0.438 1
1 27 . 4 1 1 A 3 3 SER CA C 3 63.300 61.733 1.567 1
1 28 . 4 1 1 A 3 3 SER CB C 3 61.700 63.293 -1.593 1
1 29 . 4 1 1 A 3 3 SER N N 3 118.200 116.509 1.691 1
1 30 . 4 1 1 A 4 4 GLU H H 4 8.450 8.130 0.320 1
1 31 . 4 1 1 A 4 4 GLU HA H 4 4.010 4.052 -0.042 1
1 36 . 4 1 1 A 4 4 GLU C C 4 178.800 178.867 -0.067 1
1 37 . 4 1 1 A 4 4 GLU CA C 4 60.300 59.253 1.047 1
1 38 . 4 1 1 A 4 4 GLU CB C 4 29.100 29.564 -0.464 1
1 40 . 4 1 1 A 4 4 GLU N N 4 123.600 122.091 1.509 1
1 41 . 4 1 1 A 5 5 VAL H H 5 7.590 7.879 -0.289 1
1 42 . 4 1 1 A 5 5 VAL HA H 5 3.850 3.704 0.146 1
1 50 . 4 1 1 A 5 5 VAL C C 5 179.100 178.628 0.472 1
1 51 . 4 1 1 A 5 5 VAL CA C 5 65.800 66.631 -0.831 1
1 52 . 4 1 1 A 5 5 VAL CB C 5 32.300 31.592 0.708 1
1 55 . 4 1 1 A 5 5 VAL N N 5 119.300 119.606 -0.306 1
1 56 . 4 1 1 A 6 6 ILE H H 6 7.240 7.933 -0.693 1
1 57 . 4 1 1 A 6 6 ILE HA H 6 3.580 3.685 -0.105 1
1 67 . 4 1 1 A 6 6 ILE C C 6 177.000 178.021 -1.021 1
1 68 . 4 1 1 A 6 6 ILE CA C 6 65.300 65.787 -0.487 1
1 69 . 4 1 1 A 6 6 ILE CB C 6 37.900 37.879 0.021 1
1 73 . 4 1 1 A 6 6 ILE N N 6 120.300 120.623 -0.323 1
1 74 . 4 1 1 A 7 7 LYS H H 7 8.050 7.991 0.059 1
1 75 . 4 1 1 A 7 7 LYS HA H 7 3.570 3.874 -0.304 1
1 84 . 4 1 1 A 7 7 LYS C C 7 178.700 180.268 -1.568 1
1 85 . 4 1 1 A 7 7 LYS CA C 7 61.300 60.561 0.739 1
1 86 . 4 1 1 A 7 7 LYS CB C 7 32.200 32.247 -0.047 1
1 90 . 4 1 1 A 7 7 LYS N N 7 119.200 118.627 0.573 1
1 91 . 4 1 1 A 8 8 GLU H H 8 8.100 8.109 -0.009 1
1 92 . 4 1 1 A 8 8 GLU HA H 8 4.000 4.124 -0.124 1
1 97 . 4 1 1 A 8 8 GLU C C 8 178.500 179.257 -0.757 1
1 98 . 4 1 1 A 8 8 GLU CA C 8 59.700 59.481 0.219 1
1 99 . 4 1 1 A 8 8 GLU CB C 8 29.600 29.677 -0.077 1
1 101 . 4 1 1 A 8 8 GLU N N 8 119.400 120.412 -1.012 1
1 102 . 4 1 1 A 9 9 PHE H H 9 7.720 8.489 -0.769 1
1 103 . 4 1 1 A 9 9 PHE HA H 9 4.160 4.027 0.133 1
1 109 . 4 1 1 A 9 9 PHE C C 9 176.900 176.852 0.048 1
1 110 . 4 1 1 A 9 9 PHE CA C 9 61.300 61.330 -0.030 1
1 111 . 4 1 1 A 9 9 PHE CB C 9 39.400 39.140 0.260 1
1 115 . 4 1 1 A 9 9 PHE N N 9 121.300 121.654 -0.354 1
1 116 . 4 1 1 A 10 10 LEU H H 10 8.060 8.643 -0.583 1
1 117 . 4 1 1 A 10 10 LEU HA H 10 3.660 3.782 -0.122 1
1 127 . 4 1 1 A 10 10 LEU C C 10 179.000 179.194 -0.194 1
1 128 . 4 1 1 A 10 10 LEU CA C 10 58.000 57.880 0.120 1
1 129 . 4 1 1 A 10 10 LEU CB C 10 41.400 41.295 0.105 1
1 133 . 4 1 1 A 10 10 LEU N N 10 118.000 118.844 -0.844 1
1 134 . 4 1 1 A 11 11 GLU H H 11 7.990 8.139 -0.149 1
1 135 . 4 1 1 A 11 11 GLU HA H 11 4.110 3.973 0.137 1
1 140 . 4 1 1 A 11 11 GLU C C 11 174.200 178.704 -4.504 1
1 141 . 4 1 1 A 11 11 GLU CA C 11 59.200 59.223 -0.023 1
1 142 . 4 1 1 A 11 11 GLU CB C 11 29.300 29.174 0.126 1
1 144 . 4 1 1 A 11 11 GLU N N 11 118.300 121.209 -2.909 1
1 145 . 4 1 1 A 12 12 ASP H H 12 8.080 8.263 -0.183 1
1 146 . 4 1 1 A 12 12 ASP HA H 12 4.340 4.359 -0.019 1
1 149 . 4 1 1 A 12 12 ASP C C 12 178.900 178.158 0.742 1
1 150 . 4 1 1 A 12 12 ASP CA C 12 57.600 57.039 0.561 1
1 151 . 4 1 1 A 12 12 ASP CB C 12 41.000 40.843 0.157 1
1 152 . 4 1 1 A 12 12 ASP N N 12 121.800 119.657 2.143 1
1 153 . 4 1 1 A 13 13 ILE H H 13 7.610 7.400 0.210 1
1 154 . 4 1 1 A 13 13 ILE HA H 13 4.240 3.990 0.250 1
1 164 . 4 1 1 A 13 13 ILE C C 13 176.800 176.377 0.423 1
1 165 . 4 1 1 A 13 13 ILE CA C 13 62.100 60.686 1.414 1
1 166 . 4 1 1 A 13 13 ILE CB C 13 38.300 37.524 0.776 1
1 170 . 4 1 1 A 13 13 ILE N N 13 110.800 112.734 -1.934 1
1 171 . 4 1 1 A 14 14 GLY H H 14 7.640 7.763 -0.123 1
1 172 . 4 1 1 A 14 14 GLY HA2 H 14 3.810 3.853 -0.043 1
1 173 . 4 1 1 A 14 14 GLY HA3 H 14 3.880 3.853 0.027 1
1 174 . 4 1 1 A 14 14 GLY C C 14 175.200 174.378 0.822 1
1 175 . 4 1 1 A 14 14 GLY CA C 14 46.900 45.829 1.071 1
1 176 . 4 1 1 A 14 14 GLY N N 14 111.800 112.253 -0.453 1
1 177 . 4 1 1 A 15 15 GLU H H 15 7.870 8.063 -0.193 1
1 178 . 4 1 1 A 15 15 GLU HA H 15 4.680 4.639 0.041 1
1 183 . 4 1 1 A 15 15 GLU C C 15 175.100 174.543 0.557 1
1 184 . 4 1 1 A 15 15 GLU CA C 15 54.800 54.733 0.067 1
1 185 . 4 1 1 A 15 15 GLU CB C 15 32.200 32.174 0.026 1
1 187 . 4 1 1 A 15 15 GLU N N 15 119.200 120.707 -1.507 1
1 188 . 4 1 1 A 16 16 ASP H H 16 8.220 8.705 -0.485 1
1 189 . 4 1 1 A 16 16 ASP HA H 16 4.680 5.271 -0.591 1
1 192 . 4 1 1 A 16 16 ASP C C 16 174.600 174.953 -0.353 1
1 193 . 4 1 1 A 16 16 ASP CA C 16 53.600 52.823 0.777 1
1 194 . 4 1 1 A 16 16 ASP CB C 16 42.900 43.637 -0.737 1
1 195 . 4 1 1 A 16 16 ASP N N 16 120.600 126.951 -6.351 1
1 196 . 4 1 1 A 17 17 TYR H H 17 7.540 8.412 -0.872 1
1 197 . 4 1 1 A 17 17 TYR HA H 17 4.910 5.839 -0.929 1
1 202 . 4 1 1 A 17 17 TYR C C 17 173.600 174.130 -0.530 1
1 203 . 4 1 1 A 17 17 TYR CA C 17 56.200 54.973 1.227 1
1 204 . 4 1 1 A 17 17 TYR CB C 17 41.100 42.025 -0.925 1
1 207 . 4 1 1 A 17 17 TYR N N 17 112.700 120.317 -7.617 1
1 208 . 4 1 1 A 18 18 ILE H H 18 7.950 8.957 -1.007 1
1 209 . 4 1 1 A 18 18 ILE HA H 18 4.330 4.682 -0.352 1
1 219 . 4 1 1 A 18 18 ILE C C 18 174.700 174.560 0.140 1
1 220 . 4 1 1 A 18 18 ILE CA C 18 60.300 60.774 -0.474 1
1 221 . 4 1 1 A 18 18 ILE CB C 18 41.000 37.558 3.442 1
1 225 . 4 1 1 A 18 18 ILE N N 18 120.400 121.313 -0.913 1
1 226 . 4 1 1 A 19 19 GLU H H 19 8.760 9.222 -0.462 1
1 227 . 4 1 1 A 19 19 GLU HA H 19 5.200 5.575 -0.375 1
1 232 . 4 1 1 A 19 19 GLU C C 19 175.200 175.181 0.019 1
1 233 . 4 1 1 A 19 19 GLU CA C 19 55.500 54.895 0.605 1
1 234 . 4 1 1 A 19 19 GLU CB C 19 32.400 33.101 -0.701 1
1 236 . 4 1 1 A 19 19 GLU N N 19 129.000 128.796 0.204 1
1 237 . 4 1 1 A 20 20 LEU H H 20 8.730 9.404 -0.674 1
1 238 . 4 1 1 A 20 20 LEU HA H 20 4.620 4.784 -0.164 1
1 248 . 4 1 1 A 20 20 LEU C C 20 176.200 176.501 -0.301 1
1 249 . 4 1 1 A 20 20 LEU CA C 20 54.100 53.228 0.872 1
1 250 . 4 1 1 A 20 20 LEU CB C 20 44.400 44.046 0.354 1
1 254 . 4 1 1 A 20 20 LEU N N 20 128.400 126.852 1.548 1
1 255 . 4 1 1 A 21 21 GLU H H 21 8.700 8.634 0.066 1
1 256 . 4 1 1 A 21 21 GLU HA H 21 3.870 3.958 -0.088 1
1 261 . 4 1 1 A 21 21 GLU C C 21 176.100 176.953 -0.853 1
1 262 . 4 1 1 A 21 21 GLU CA C 21 58.800 57.333 1.467 1
1 263 . 4 1 1 A 21 21 GLU CB C 21 28.200 29.255 -1.055 1
1 265 . 4 1 1 A 21 21 GLU N N 21 122.600 120.103 2.497 1
1 266 . 4 1 1 A 22 22 ASN H H 22 8.640 8.983 -0.343 1
1 267 . 4 1 1 A 22 22 ASN HA H 22 4.540 4.300 0.240 1
1 272 . 4 1 1 A 22 22 ASN C C 22 173.800 173.912 -0.112 1
1 273 . 4 1 1 A 22 22 ASN CA C 22 54.600 54.480 0.120 1
1 274 . 4 1 1 A 22 22 ASN CB C 22 38.400 36.761 1.639 1
1 275 . 4 1 1 A 22 22 ASN N N 22 118.000 120.369 -2.369 1
1 277 . 4 1 1 A 23 23 GLU H H 23 7.740 7.560 0.180 1
1 278 . 4 1 1 A 23 23 GLU HA H 23 5.430 4.904 0.526 1
1 283 . 4 1 1 A 23 23 GLU C C 23 175.400 175.347 0.053 1
1 284 . 4 1 1 A 23 23 GLU CA C 23 54.900 54.912 -0.012 1
1 285 . 4 1 1 A 23 23 GLU CB C 23 34.500 31.833 2.667 1
1 287 . 4 1 1 A 23 23 GLU N N 23 116.400 117.402 -1.002 1
1 288 . 4 1 1 A 24 24 ILE H H 24 9.050 9.328 -0.278 1
1 289 . 4 1 1 A 24 24 ILE HA H 24 4.810 4.664 0.146 1
1 299 . 4 1 1 A 24 24 ILE C C 24 174.600 174.815 -0.215 1
1 300 . 4 1 1 A 24 24 ILE CA C 24 60.700 60.234 0.466 1
1 301 . 4 1 1 A 24 24 ILE CB C 24 41.300 38.682 2.618 1
1 305 . 4 1 1 A 24 24 ILE N N 24 122.800 125.880 -3.080 1
1 306 . 4 1 1 A 25 25 HIS H H 25 9.490 9.633 -0.143 1
1 307 . 4 1 1 A 25 25 HIS HA H 25 5.090 5.325 -0.235 1
1 312 . 4 1 1 A 25 25 HIS C C 25 176.100 175.321 0.779 1
1 313 . 4 1 1 A 25 25 HIS CA C 25 56.100 55.330 0.770 1
1 314 . 4 1 1 A 25 25 HIS CB C 25 33.100 31.345 1.755 1
1 317 . 4 1 1 A 25 25 HIS N N 25 127.300 126.598 0.702 1
1 318 . 4 1 1 A 26 26 LEU H H 26 8.820 8.825 -0.005 1
1 319 . 4 1 1 A 26 26 LEU HA H 26 5.160 5.135 0.025 1
1 329 . 4 1 1 A 26 26 LEU C C 26 178.000 176.315 1.685 1
1 330 . 4 1 1 A 26 26 LEU CA C 26 52.900 53.617 -0.717 1
1 331 . 4 1 1 A 26 26 LEU CB C 26 48.100 45.398 2.702 1
1 335 . 4 1 1 A 26 26 LEU N N 26 121.600 125.311 -3.711 1
1 336 . 4 1 1 A 27 27 LYS H H 27 8.990 8.806 0.184 1
1 337 . 4 1 1 A 27 27 LYS HA H 27 4.630 4.429 0.201 1
1 345 . 4 1 1 A 27 27 LYS CA C 27 55.700 54.968 0.732 1
1 346 . 4 1 1 A 27 27 LYS CB C 27 31.900 32.138 -0.238 1
1 350 . 4 1 1 A 27 27 LYS N N 27 125.900 121.040 4.860 1
1 351 . 4 1 1 A 28 28 PRO HA H 28 4.500 4.427 0.073 1
1 358 . 4 1 1 A 28 28 PRO C C 28 177.900 178.117 -0.217 1
1 359 . 4 1 1 A 28 28 PRO CA C 28 67.400 65.621 1.779 1
1 360 . 4 1 1 A 28 28 PRO CB C 28 32.100 32.113 -0.013 1
1 363 . 4 1 1 A 29 29 GLU H H 29 9.880 8.349 1.531 1
1 364 . 4 1 1 A 29 29 GLU HA H 29 4.140 4.223 -0.083 1
1 369 . 4 1 1 A 29 29 GLU C C 29 178.800 179.118 -0.318 1
1 370 . 4 1 1 A 29 29 GLU CA C 29 60.600 60.081 0.519 1
1 371 . 4 1 1 A 29 29 GLU CB C 29 29.200 29.501 -0.301 1
1 373 . 4 1 1 A 29 29 GLU N N 29 117.100 118.261 -1.161 1
1 374 . 4 1 1 A 30 30 VAL H H 30 7.050 7.890 -0.840 1
1 375 . 4 1 1 A 30 30 VAL HA H 30 3.850 3.924 -0.074 1
1 383 . 4 1 1 A 30 30 VAL C C 30 177.700 178.225 -0.525 1
1 384 . 4 1 1 A 30 30 VAL CA C 30 65.600 65.578 0.022 1
1 385 . 4 1 1 A 30 30 VAL CB C 30 32.100 31.621 0.479 1
1 388 . 4 1 1 A 30 30 VAL N N 30 120.900 119.871 1.029 1
1 389 . 4 1 1 A 31 31 PHE H H 31 8.980 8.910 0.070 1
1 390 . 4 1 1 A 31 31 PHE HA H 31 3.870 4.324 -0.454 1
1 394 . 4 1 1 A 31 31 PHE C C 31 176.700 177.424 -0.724 1
1 395 . 4 1 1 A 31 31 PHE CA C 31 62.200 61.960 0.240 1
1 396 . 4 1 1 A 31 31 PHE CB C 31 39.300 39.117 0.183 1
1 398 . 4 1 1 A 31 31 PHE N N 31 121.100 121.070 0.030 1
1 399 . 4 1 1 A 32 32 TYR H H 32 8.640 8.396 0.244 1
1 400 . 4 1 1 A 32 32 TYR HA H 32 3.880 4.782 -0.902 1
1 405 . 4 1 1 A 32 32 TYR C C 32 176.000 178.127 -2.127 1
1 406 . 4 1 1 A 32 32 TYR CA C 32 63.300 62.169 1.131 1
1 407 . 4 1 1 A 32 32 TYR CB C 32 39.100 39.110 -0.010 1
1 410 . 4 1 1 A 32 32 TYR N N 32 117.400 120.891 -3.491 1
1 411 . 4 1 1 A 33 33 GLU H H 33 7.400 8.042 -0.642 1
1 412 . 4 1 1 A 33 33 GLU HA H 33 4.050 4.231 -0.181 1
1 417 . 4 1 1 A 33 33 GLU C C 33 180.200 178.969 1.231 1
1 418 . 4 1 1 A 33 33 GLU CA C 33 59.500 59.064 0.436 1
1 419 . 4 1 1 A 33 33 GLU CB C 33 29.300 29.389 -0.089 1
1 421 . 4 1 1 A 33 33 GLU N N 33 116.100 118.908 -2.808 1
1 422 . 4 1 1 A 34 34 VAL H H 34 8.530 7.778 0.752 1
1 423 . 4 1 1 A 34 34 VAL HA H 34 3.350 3.674 -0.324 1
1 431 . 4 1 1 A 34 34 VAL C C 34 175.800 178.162 -2.362 1
1 432 . 4 1 1 A 34 34 VAL CA C 34 66.400 66.435 -0.035 1
1 433 . 4 1 1 A 34 34 VAL CB C 34 32.200 31.700 0.500 1
1 436 . 4 1 1 A 34 34 VAL N N 34 120.600 120.150 0.450 1
1 437 . 4 1 1 A 35 35 TRP H H 35 9.100 8.688 0.412 1
1 438 . 4 1 1 A 35 35 TRP HA H 35 3.340 3.696 -0.356 1
1 447 . 4 1 1 A 35 35 TRP C C 35 178.000 178.524 -0.524 1
1 448 . 4 1 1 A 35 35 TRP CA C 35 61.800 59.863 1.937 1
1 449 . 4 1 1 A 35 35 TRP CB C 35 27.900 29.716 -1.816 1
1 455 . 4 1 1 A 35 35 TRP N N 35 121.700 121.222 0.478 1
1 457 . 4 1 1 A 36 36 LYS H H 36 7.970 7.788 0.182 1
1 458 . 4 1 1 A 36 36 LYS HA H 36 3.330 3.562 -0.232 1
1 467 . 4 1 1 A 36 36 LYS C C 36 180.000 178.409 1.591 1
1 468 . 4 1 1 A 36 36 LYS CA C 36 59.000 59.079 -0.079 1
1 469 . 4 1 1 A 36 36 LYS CB C 36 31.800 32.157 -0.357 1
1 473 . 4 1 1 A 36 36 LYS N N 36 116.300 118.484 -2.184 1
1 474 . 4 1 1 A 37 37 TYR H H 37 7.750 8.361 -0.611 1
1 475 . 4 1 1 A 37 37 TYR HA H 37 3.940 3.905 0.035 1
1 480 . 4 1 1 A 37 37 TYR C C 37 177.600 177.677 -0.077 1
1 481 . 4 1 1 A 37 37 TYR CA C 37 61.200 61.046 0.154 1
1 482 . 4 1 1 A 37 37 TYR CB C 37 38.800 38.492 0.308 1
1 485 . 4 1 1 A 37 37 TYR N N 37 122.700 120.924 1.776 1
1 486 . 4 1 1 A 38 38 VAL H H 38 7.660 7.560 0.100 1
1 487 . 4 1 1 A 38 38 VAL HA H 38 3.870 3.782 0.088 1
1 495 . 4 1 1 A 38 38 VAL C C 38 175.600 176.254 -0.654 1
1 496 . 4 1 1 A 38 38 VAL CA C 38 61.100 61.932 -0.832 1
1 497 . 4 1 1 A 38 38 VAL CB C 38 30.700 31.283 -0.583 1
1 500 . 4 1 1 A 38 38 VAL N N 38 108.200 113.014 -4.814 1
1 501 . 4 1 1 A 39 39 GLY H H 39 7.090 7.492 -0.402 1
1 502 . 4 1 1 A 39 39 GLY HA2 H 39 3.320 3.756 -0.436 1
1 503 . 4 1 1 A 39 39 GLY HA3 H 39 3.730 3.778 -0.048 1
1 504 . 4 1 1 A 39 39 GLY C C 39 173.600 174.429 -0.829 1
1 505 . 4 1 1 A 39 39 GLY CA C 39 46.100 44.898 1.202 1
1 506 . 4 1 1 A 39 39 GLY N N 39 107.600 110.175 -2.575 1
1 507 . 4 1 1 A 40 40 GLU H H 40 7.730 7.923 -0.193 1
1 508 . 4 1 1 A 40 40 GLU HA H 40 1.090 3.227 -2.137 1
1 513 . 4 1 1 A 40 40 GLU CA C 40 55.700 56.778 -1.078 1
1 514 . 4 1 1 A 40 40 GLU CB C 40 27.200 27.613 -0.413 1
1 516 . 4 1 1 A 40 40 GLU N N 40 114.400 119.244 -4.844 1
1 517 . 4 1 1 A 41 41 PRO HA H 41 4.310 4.612 -0.302 1
1 524 . 4 1 1 A 41 41 PRO CA C 41 62.300 62.268 0.032 1
1 525 . 4 1 1 A 41 41 PRO CB C 41 32.700 32.732 -0.032 1
1 528 . 4 1 1 A 42 42 GLU H H 42 8.110 8.652 -0.542 1
1 529 . 4 1 1 A 42 42 GLU C C 42 175.800 176.460 -0.660 1
1 530 . 4 1 1 A 42 42 GLU CA C 42 57.800 56.997 0.803 1
1 531 . 4 1 1 A 42 42 GLU CB C 42 30.600 30.424 0.176 1
1 533 . 4 1 1 A 42 42 GLU N N 42 119.100 120.647 -1.547 1
1 534 . 4 1 1 A 43 43 LEU H H 43 8.140 8.730 -0.590 1
1 535 . 4 1 1 A 43 43 LEU HA H 43 4.840 4.932 -0.092 1
1 545 . 4 1 1 A 43 43 LEU C C 43 177.300 176.160 1.140 1
1 546 . 4 1 1 A 43 43 LEU CA C 43 53.700 53.376 0.324 1
1 547 . 4 1 1 A 43 43 LEU CB C 43 43.900 43.803 0.097 1
1 551 . 4 1 1 A 43 43 LEU N N 43 124.700 125.122 -0.422 1
1 552 . 4 1 1 A 44 44 LYS H H 44 8.640 8.756 -0.116 1
1 553 . 4 1 1 A 44 44 LYS HA H 44 4.500 4.651 -0.151 1
1 562 . 4 1 1 A 44 44 LYS C C 44 174.500 175.214 -0.714 1
1 563 . 4 1 1 A 44 44 LYS CA C 44 54.700 54.444 0.256 1
1 564 . 4 1 1 A 44 44 LYS CB C 44 36.200 35.066 1.134 1
1 568 . 4 1 1 A 44 44 LYS N N 44 123.300 122.758 0.542 1
1 569 . 4 1 1 A 45 45 THR H H 45 7.990 8.668 -0.678 1
1 570 . 4 1 1 A 45 45 THR HA H 45 5.700 5.361 0.339 1
1 575 . 4 1 1 A 45 45 THR C C 45 175.100 173.989 1.111 1
1 576 . 4 1 1 A 45 45 THR CA C 45 59.600 59.610 -0.010 1
1 577 . 4 1 1 A 45 45 THR CB C 45 73.400 70.880 2.520 1
1 579 . 4 1 1 A 45 45 THR N N 45 106.900 113.682 -6.782 1
1 580 . 4 1 1 A 46 46 TYR H H 46 8.470 9.320 -0.850 1
1 581 . 4 1 1 A 46 46 TYR HA H 46 4.930 5.730 -0.800 1
1 586 . 4 1 1 A 46 46 TYR C C 46 172.400 173.389 -0.989 1
1 587 . 4 1 1 A 46 46 TYR CA C 46 57.100 55.429 1.671 1
1 588 . 4 1 1 A 46 46 TYR CB C 46 40.200 41.658 -1.458 1
1 591 . 4 1 1 A 46 46 TYR N N 46 117.100 119.111 -2.011 1
1 592 . 4 1 1 A 47 47 VAL H H 47 8.430 9.042 -0.612 1
1 593 . 4 1 1 A 47 47 VAL HA H 47 4.890 4.448 0.442 1
1 601 . 4 1 1 A 47 47 VAL C C 47 175.800 174.253 1.547 1
1 602 . 4 1 1 A 47 47 VAL CA C 47 60.800 61.713 -0.913 1
1 603 . 4 1 1 A 47 47 VAL CB C 47 34.800 32.331 2.469 1
1 606 . 4 1 1 A 47 47 VAL N N 47 119.200 120.517 -1.317 1
1 607 . 4 1 1 A 48 48 ILE H H 48 8.680 8.859 -0.179 1
1 608 . 4 1 1 A 48 48 ILE HA H 48 4.560 4.708 -0.148 1
1 618 . 4 1 1 A 48 48 ILE C C 48 174.500 174.219 0.281 1
1 619 . 4 1 1 A 48 48 ILE CA C 48 59.700 60.198 -0.498 1
1 620 . 4 1 1 A 48 48 ILE CB C 48 41.500 39.789 1.711 1
1 624 . 4 1 1 A 48 48 ILE N N 48 124.400 128.818 -4.418 1
1 625 . 4 1 1 A 49 49 GLU H H 49 8.320 8.954 -0.634 1
1 626 . 4 1 1 A 49 49 GLU C C 49 175.500 175.021 0.479 1
1 627 . 4 1 1 A 49 49 GLU CA C 49 55.500 55.993 -0.493 1
1 628 . 4 1 1 A 49 49 GLU CB C 49 31.800 29.535 2.265 1
1 630 . 4 1 1 A 49 49 GLU N N 49 123.400 129.304 -5.904 1
1 631 . 4 1 1 A 50 50 ASP H H 50 8.610 8.909 -0.299 1
1 632 . 4 1 1 A 50 50 ASP C C 50 175.100 175.356 -0.256 1
1 633 . 4 1 1 A 50 50 ASP CA C 50 53.100 53.092 0.008 1
1 634 . 4 1 1 A 50 50 ASP CB C 50 44.000 43.412 0.588 1
1 635 . 4 1 1 A 50 50 ASP N N 50 124.300 126.677 -2.377 1
1 636 . 4 1 1 A 51 51 GLU H H 51 8.450 8.973 -0.523 1
1 637 . 4 1 1 A 51 51 GLU C C 51 175.900 176.773 -0.873 1
1 638 . 4 1 1 A 51 51 GLU CA C 51 56.000 56.246 -0.246 1
1 639 . 4 1 1 A 51 51 GLU CB C 51 31.700 29.684 2.016 1
1 640 . 4 1 1 A 51 51 GLU N N 51 121.300 124.311 -3.011 1
1 641 . 4 1 1 A 52 52 ILE H H 52 8.480 8.975 -0.495 1
1 642 . 4 1 1 A 52 52 ILE C C 52 175.400 175.088 0.312 1
1 643 . 4 1 1 A 52 52 ILE CA C 52 60.400 63.487 -3.087 1
1 644 . 4 1 1 A 52 52 ILE CB C 52 40.000 37.484 2.516 1
1 645 . 4 1 1 A 52 52 ILE N N 52 122.700 125.748 -3.048 1
1 646 . 4 1 1 A 53 53 VAL H H 53 8.140 7.931 0.209 1
1 647 . 4 1 1 A 53 53 VAL C C 53 175.600 173.698 1.902 1
1 648 . 4 1 1 A 53 53 VAL CA C 53 61.900 59.888 2.012 1
1 649 . 4 1 1 A 53 53 VAL CB C 53 33.200 34.939 -1.739 1
1 650 . 4 1 1 A 53 53 VAL N N 53 124.400 124.190 0.210 1
1 651 . 4 1 1 A 54 54 GLU H H 54 8.540 8.913 -0.373 1
1 652 . 4 1 1 A 54 54 GLU CA C 54 55.600 52.974 2.626 1
1 653 . 4 1 1 A 54 54 GLU CB C 54 34.300 30.731 3.569 1
1 654 . 4 1 1 A 54 54 GLU N N 54 125.900 127.030 -1.130 1
1 655 . 4 1 1 A 55 55 PRO C C 55 177.500 176.777 0.723 1
1 656 . 4 1 1 A 55 55 PRO CA C 55 63.400 62.084 1.316 1
1 657 . 4 1 1 A 55 55 PRO CB C 55 32.300 33.026 -0.726 1
1 658 . 4 1 1 A 56 56 GLY H H 56 8.420 8.473 -0.053 1
1 659 . 4 1 1 A 56 56 GLY HA2 H 56 3.830 4.149 -0.319 1
1 660 . 4 1 1 A 56 56 GLY HA3 H 56 4.000 4.163 -0.163 1
1 661 . 4 1 1 A 56 56 GLY C C 56 174.500 175.385 -0.885 1
1 662 . 4 1 1 A 56 56 GLY CA C 56 45.400 45.400 0.000 1
1 663 . 4 1 1 A 56 56 GLY N N 56 109.700 107.992 1.708 1
1 664 . 4 1 1 A 57 57 GLU H H 57 8.180 8.082 0.098 1
1 665 . 4 1 1 A 57 57 GLU C C 57 176.300 175.836 0.464 1
1 666 . 4 1 1 A 57 57 GLU CA C 57 57.500 56.996 0.504 1
1 667 . 4 1 1 A 57 57 GLU CB C 57 30.400 30.482 -0.082 1
1 668 . 4 1 1 A 57 57 GLU N N 57 120.900 118.708 2.192 1
1 669 . 4 1 1 A 58 58 TYR H H 58 8.020 7.809 0.211 1
1 670 . 4 1 1 A 58 58 TYR C C 58 175.100 174.990 0.110 1
1 671 . 4 1 1 A 58 58 TYR CA C 58 57.400 56.660 0.740 1
1 672 . 4 1 1 A 58 58 TYR CB C 58 38.900 42.423 -3.523 1
1 673 . 4 1 1 A 58 58 TYR N N 58 118.800 117.583 1.217 1
1 674 . 4 1 1 A 59 59 ASP H H 59 7.950 8.959 -1.009 1
1 675 . 4 1 1 A 59 59 ASP CA C 59 52.700 51.413 1.287 1
1 676 . 4 1 1 A 59 59 ASP CB C 59 41.000 41.019 -0.019 1
1 677 . 4 1 1 A 59 59 ASP N N 59 123.500 123.362 0.138 1
1 678 . 4 1 1 A 61 61 PRO HA H 61 4.510 4.663 -0.153 1
1 685 . 4 1 1 A 61 61 PRO C C 61 176.500 176.980 -0.480 1
1 686 . 4 1 1 A 61 61 PRO CA C 61 63.700 62.528 1.172 1
1 687 . 4 1 1 A 61 61 PRO CB C 61 34.200 31.599 2.601 1
1 690 . 4 1 1 A 62 62 GLU H H 62 8.490 8.261 0.229 1
1 691 . 4 1 1 A 62 62 GLU N N 62 124.600 123.858 0.742 1
1 692 . 4 1 1 A 64 64 LYS C C 64 176.300 175.673 0.627 1
1 693 . 4 1 1 A 64 64 LYS CA C 64 57.000 57.486 -0.486 1
1 694 . 4 1 1 A 64 64 LYS CB C 64 33.100 32.007 1.093 1
1 695 . 4 1 1 A 65 65 TYR H H 65 7.960 7.898 0.062 1
1 696 . 4 1 1 A 65 65 TYR C C 65 176.000 174.720 1.280 1
1 697 . 4 1 1 A 65 65 TYR CA C 65 57.800 56.333 1.467 1
1 698 . 4 1 1 A 65 65 TYR CB C 65 38.800 37.980 0.820 1
1 699 . 4 1 1 A 65 65 TYR N N 65 119.300 117.695 1.605 1
1 700 . 4 1 1 A 66 66 THR H H 66 7.820 8.018 -0.198 1
1 701 . 4 1 1 A 66 66 THR HA H 66 4.280 4.321 -0.041 1
1 706 . 4 1 1 A 66 66 THR C C 66 174.100 174.095 0.005 1
1 707 . 4 1 1 A 66 66 THR CA C 66 62.100 63.807 -1.707 1
1 708 . 4 1 1 A 66 66 THR CB C 66 70.000 68.892 1.108 1
1 710 . 4 1 1 A 66 66 THR N N 66 113.900 117.432 -3.532 1
1 711 . 4 1 1 A 67 67 ASN H H 67 8.270 8.753 -0.483 1
1 712 . 4 1 1 A 67 67 ASN C C 67 174.100 175.052 -0.952 1
1 713 . 4 1 1 A 67 67 ASN CA C 67 53.400 53.467 -0.067 1
1 714 . 4 1 1 A 67 67 ASN CB C 67 39.300 39.184 0.116 1
1 715 . 4 1 1 A 67 67 ASN N N 67 121.400 126.104 -4.704 1
1 716 . 4 1 1 A 68 68 VAL H H 68 7.660 8.434 -0.774 1
1 717 . 4 1 1 A 68 68 VAL C C 68 175.500 174.538 0.962 1
1 718 . 4 1 1 A 68 68 VAL CA C 68 61.800 61.636 0.164 1
1 719 . 4 1 1 A 68 68 VAL CB C 68 33.700 30.879 2.821 1
1 720 . 4 1 1 A 68 68 VAL N N 68 119.400 121.653 -2.253 1
1 721 . 4 1 1 A 69 69 LYS H H 69 8.690 8.526 0.164 1
1 722 . 4 1 1 A 69 69 LYS C C 69 175.200 174.830 0.370 1
1 723 . 4 1 1 A 69 69 LYS CA C 69 55.200 55.345 -0.145 1
1 724 . 4 1 1 A 69 69 LYS CB C 69 35.200 33.807 1.393 1
1 725 . 4 1 1 A 69 69 LYS N N 69 126.500 127.688 -1.188 1
1 726 . 4 1 1 A 70 70 LYS H H 70 8.230 8.779 -0.549 1
1 727 . 4 1 1 A 70 70 LYS C C 70 176.400 175.724 0.676 1
1 728 . 4 1 1 A 70 70 LYS CA C 70 55.600 56.035 -0.435 1
1 729 . 4 1 1 A 70 70 LYS CB C 70 33.800 33.196 0.604 1
1 730 . 4 1 1 A 70 70 LYS N N 70 122.700 127.641 -4.941 1
1 731 . 4 1 1 A 71 71 VAL H H 71 8.530 9.362 -0.832 1
1 732 . 4 1 1 A 71 71 VAL HA H 71 4.510 4.491 0.019 1
1 733 . 4 1 1 A 71 71 VAL C C 71 174.700 175.108 -0.408 1
1 734 . 4 1 1 A 71 71 VAL CA C 71 60.900 61.554 -0.654 1
1 735 . 4 1 1 A 71 71 VAL CB C 71 34.800 32.798 2.002 1
1 738 . 4 1 1 A 71 71 VAL N N 71 121.200 125.240 -4.040 1
1 739 . 4 1 1 A 72 72 LYS H H 72 8.210 8.833 -0.623 1
1 740 . 4 1 1 A 72 72 LYS HA H 72 4.800 4.527 0.273 1
1 747 . 4 1 1 A 72 72 LYS C C 72 176.200 175.392 0.808 1
1 748 . 4 1 1 A 72 72 LYS CA C 72 55.700 56.011 -0.311 1
1 749 . 4 1 1 A 72 72 LYS CB C 72 33.700 32.072 1.628 1
1 752 . 4 1 1 A 72 72 LYS N N 72 123.600 127.508 -3.908 1
1 753 . 4 1 1 A 73 73 ILE H H 73 8.890 8.741 0.149 1
1 754 . 4 1 1 A 73 73 ILE C C 73 174.400 174.768 -0.368 1
1 755 . 4 1 1 A 73 73 ILE CA C 73 60.400 60.316 0.084 1
1 756 . 4 1 1 A 73 73 ILE CB C 73 40.800 38.304 2.496 1
1 760 . 4 1 1 A 73 73 ILE N N 73 125.100 126.128 -1.028 1
1 761 . 4 1 1 A 74 74 LYS H H 74 8.420 8.759 -0.339 1
1 762 . 4 1 1 A 74 74 LYS HA H 74 4.800 4.845 -0.045 1
1 771 . 4 1 1 A 74 74 LYS C C 74 175.600 175.027 0.573 1
1 772 . 4 1 1 A 74 74 LYS CA C 74 56.200 54.833 1.367 1
1 773 . 4 1 1 A 74 74 LYS CB C 74 34.300 33.912 0.388 1
1 777 . 4 1 1 A 74 74 LYS N N 74 126.400 127.985 -1.585 1
1 778 . 4 1 1 A 75 75 LYS H H 75 9.090 8.509 0.581 1
1 779 . 4 1 1 A 75 75 LYS HA H 75 4.800 4.936 -0.136 1
1 788 . 4 1 1 A 75 75 LYS C C 75 174.900 174.853 0.047 1
1 789 . 4 1 1 A 75 75 LYS CA C 75 53.200 54.337 -1.137 1
1 790 . 4 1 1 A 75 75 LYS CB C 75 34.200 35.675 -1.475 1
1 794 . 4 1 1 A 75 75 LYS N N 75 127.500 126.447 1.053 1
1 795 . 4 1 1 A 76 76 VAL H H 76 8.610 8.527 0.083 1
1 796 . 4 1 1 A 76 76 VAL HA H 76 5.340 4.944 0.396 1
1 804 . 4 1 1 A 76 76 VAL C C 76 171.400 173.668 -2.268 1
1 805 . 4 1 1 A 76 76 VAL CA C 76 58.000 59.444 -1.444 1
1 806 . 4 1 1 A 76 76 VAL CB C 76 36.400 35.281 1.119 1
1 809 . 4 1 1 A 76 76 VAL N N 76 120.100 121.219 -1.119 1
1 810 . 4 1 1 A 77 77 TYR H H 77 9.110 9.162 -0.052 1
1 811 . 4 1 1 A 77 77 TYR HA H 77 6.150 5.741 0.409 1
1 816 . 4 1 1 A 77 77 TYR C C 77 173.600 173.007 0.593 1
1 817 . 4 1 1 A 77 77 TYR CA C 77 56.200 55.636 0.564 1
1 818 . 4 1 1 A 77 77 TYR CB C 77 44.000 41.823 2.177 1
1 821 . 4 1 1 A 77 77 TYR N N 77 121.300 121.828 -0.528 1
1 822 . 4 1 1 A 78 78 PHE H H 78 8.190 8.812 -0.622 1
1 823 . 4 1 1 A 78 78 PHE HA H 78 5.130 5.741 -0.611 1
1 829 . 4 1 1 A 78 78 PHE C C 78 173.600 173.314 0.286 1
1 830 . 4 1 1 A 78 78 PHE CA C 78 55.900 55.248 0.652 1
1 831 . 4 1 1 A 78 78 PHE CB C 78 42.500 42.602 -0.102 1
1 835 . 4 1 1 A 78 78 PHE N N 78 112.700 117.045 -4.345 1
1 836 . 4 1 1 A 79 79 GLU H H 79 8.920 9.108 -0.188 1
1 837 . 4 1 1 A 79 79 GLU HA H 79 5.390 5.077 0.313 1
1 842 . 4 1 1 A 79 79 GLU C C 79 177.000 176.892 0.108 1
1 843 . 4 1 1 A 79 79 GLU CA C 79 54.900 55.288 -0.388 1
1 844 . 4 1 1 A 79 79 GLU CB C 79 33.600 31.877 1.723 1
1 846 . 4 1 1 A 79 79 GLU N N 79 120.500 119.894 0.606 1
1 847 . 4 1 1 A 80 80 THR H H 80 8.970 8.902 0.068 1
1 848 . 4 1 1 A 80 80 THR HA H 80 4.700 4.945 -0.245 1
1 854 . 4 1 1 A 80 80 THR C C 80 177.000 175.407 1.593 1
1 855 . 4 1 1 A 80 80 THR CA C 80 61.300 60.366 0.934 1
1 856 . 4 1 1 A 80 80 THR CB C 80 70.500 71.769 -1.269 1
1 858 . 4 1 1 A 80 80 THR N N 80 113.200 115.423 -2.223 1
1 859 . 4 1 1 A 81 81 LEU H H 81 8.610 8.321 0.289 1
1 860 . 4 1 1 A 81 81 LEU HA H 81 4.230 4.389 -0.159 1
1 870 . 4 1 1 A 81 81 LEU C C 81 177.400 176.225 1.175 1
1 871 . 4 1 1 A 81 81 LEU CA C 81 57.700 54.813 2.887 1
1 872 . 4 1 1 A 81 81 LEU CB C 81 42.400 41.451 0.949 1
1 876 . 4 1 1 A 81 81 LEU N N 81 120.900 121.416 -0.516 1
1 877 . 4 1 1 A 82 82 ASP H H 82 8.850 7.561 1.289 1
1 878 . 4 1 1 A 82 82 ASP HA H 82 4.670 4.841 -0.171 1
1 881 . 4 1 1 A 82 82 ASP C C 82 174.100 175.903 -1.803 1
1 882 . 4 1 1 A 82 82 ASP CA C 82 52.700 53.013 -0.313 1
1 883 . 4 1 1 A 82 82 ASP CB C 82 37.900 41.055 -3.155 1
1 884 . 4 1 1 A 82 82 ASP N N 82 112.300 119.764 -7.464 1
1 885 . 4 1 1 A 83 83 ASN H H 83 7.790 7.853 -0.063 1
1 886 . 4 1 1 A 83 83 ASN HA H 83 4.270 4.305 -0.035 1
1 891 . 4 1 1 A 83 83 ASN C C 83 176.100 173.771 2.329 1
1 892 . 4 1 1 A 83 83 ASN CA C 83 55.300 54.565 0.735 1
1 893 . 4 1 1 A 83 83 ASN CB C 83 36.900 37.968 -1.068 1
1 894 . 4 1 1 A 83 83 ASN N N 83 113.000 117.509 -4.509 1
1 896 . 4 1 1 A 84 84 VAL H H 84 7.660 7.617 0.043 1
1 897 . 4 1 1 A 84 84 VAL HA H 84 4.270 4.378 -0.108 1
1 905 . 4 1 1 A 84 84 VAL C C 84 175.800 174.706 1.094 1
1 906 . 4 1 1 A 84 84 VAL CA C 84 61.500 61.183 0.317 1
1 907 . 4 1 1 A 84 84 VAL CB C 84 33.500 33.803 -0.303 1
1 910 . 4 1 1 A 84 84 VAL N N 84 119.700 119.191 0.509 1
1 911 . 4 1 1 A 85 85 ARG H H 85 8.180 9.122 -0.942 1
1 912 . 4 1 1 A 85 85 ARG HA H 85 4.870 4.731 0.139 1
1 920 . 4 1 1 A 85 85 ARG C C 85 174.000 174.976 -0.976 1
1 921 . 4 1 1 A 85 85 ARG CA C 85 55.700 54.841 0.859 1
1 922 . 4 1 1 A 85 85 ARG CB C 85 32.600 31.464 1.136 1
1 925 . 4 1 1 A 85 85 ARG N N 85 124.800 126.912 -2.112 1
1 927 . 4 1 1 A 86 86 VAL H H 86 8.570 8.541 0.029 1
1 928 . 4 1 1 A 86 86 VAL HA H 86 4.580 4.793 -0.213 1
1 936 . 4 1 1 A 86 86 VAL C C 86 175.700 174.858 0.842 1
1 937 . 4 1 1 A 86 86 VAL CA C 86 61.700 61.535 0.165 1
1 938 . 4 1 1 A 86 86 VAL CB C 86 30.900 32.055 -1.155 1
1 941 . 4 1 1 A 86 86 VAL N N 86 127.300 124.422 2.878 1
1 942 . 4 1 1 A 87 87 VAL H H 87 8.790 9.071 -0.281 1
1 943 . 4 1 1 A 87 87 VAL HA H 87 5.010 4.897 0.113 1
1 951 . 4 1 1 A 87 87 VAL C C 87 175.500 174.961 0.539 1
1 952 . 4 1 1 A 87 87 VAL CA C 87 61.900 60.832 1.068 1
1 953 . 4 1 1 A 87 87 VAL CB C 87 36.300 33.910 2.390 1
1 956 . 4 1 1 A 87 87 VAL N N 87 125.700 128.953 -3.253 1
1 957 . 4 1 1 A 88 88 THR H H 88 8.350 8.834 -0.484 1
1 958 . 4 1 1 A 88 88 THR HA H 88 4.620 4.682 -0.062 1
1 964 . 4 1 1 A 88 88 THR C C 88 173.300 171.494 1.806 1
1 965 . 4 1 1 A 88 88 THR CA C 88 61.700 59.830 1.870 1
1 966 . 4 1 1 A 88 88 THR CB C 88 70.400 70.235 0.165 1
1 968 . 4 1 1 A 88 88 THR N N 88 117.500 119.233 -1.733 1
1 969 . 4 1 1 A 89 89 ASP H H 89 7.700 8.591 -0.891 1
1 970 . 4 1 1 A 89 89 ASP HA H 89 4.480 4.852 -0.372 1
1 973 . 4 1 1 A 89 89 ASP C C 89 175.900 176.896 -0.996 1
1 974 . 4 1 1 A 89 89 ASP CA C 89 55.900 53.228 2.672 1
1 975 . 4 1 1 A 89 89 ASP CB C 89 43.900 41.371 2.529 1
1 976 . 4 1 1 A 89 89 ASP N N 89 120.800 123.538 -2.738 1
1 977 . 4 1 1 A 90 90 TYR H H 90 8.240 8.959 -0.719 1
1 978 . 4 1 1 A 90 90 TYR HA H 90 3.920 4.112 -0.192 1
1 983 . 4 1 1 A 90 90 TYR C C 90 176.400 177.673 -1.273 1
1 984 . 4 1 1 A 90 90 TYR CA C 90 62.300 60.811 1.489 1
1 985 . 4 1 1 A 90 90 TYR CB C 90 39.500 39.149 0.351 1
1 988 . 4 1 1 A 90 90 TYR N N 90 126.100 128.044 -1.944 1
1 989 . 4 1 1 A 91 91 SER H H 91 9.160 8.316 0.844 1
1 990 . 4 1 1 A 91 91 SER HA H 91 4.000 4.099 -0.099 1
1 993 . 4 1 1 A 91 91 SER C C 91 178.000 177.005 0.995 1
1 994 . 4 1 1 A 91 91 SER CA C 91 62.600 61.534 1.066 1
1 995 . 4 1 1 A 91 91 SER CB C 91 62.200 63.213 -1.013 1
1 996 . 4 1 1 A 91 91 SER N N 91 116.600 115.845 0.755 1
1 997 . 4 1 1 A 92 92 GLU H H 92 8.590 8.491 0.099 1
1 998 . 4 1 1 A 92 92 GLU HA H 92 4.050 4.158 -0.108 1
1 1003 . 4 1 1 A 92 92 GLU C C 92 179.400 178.766 0.634 1
1 1004 . 4 1 1 A 92 92 GLU CA C 92 58.900 58.622 0.278 1
1 1005 . 4 1 1 A 92 92 GLU CB C 92 30.600 29.371 1.229 1
1 1007 . 4 1 1 A 92 92 GLU N N 92 120.200 121.520 -1.320 1
1 1008 . 4 1 1 A 93 93 PHE H H 93 7.870 8.207 -0.337 1
1 1009 . 4 1 1 A 93 93 PHE HA H 93 4.050 4.058 -0.008 1
1 1015 . 4 1 1 A 93 93 PHE C C 93 176.500 178.018 -1.518 1
1 1016 . 4 1 1 A 93 93 PHE CA C 93 62.200 61.404 0.796 1
1 1017 . 4 1 1 A 93 93 PHE CB C 93 39.700 38.899 0.801 1
1 1021 . 4 1 1 A 93 93 PHE N N 93 120.200 122.605 -2.405 1
1 1022 . 4 1 1 A 94 94 GLN H H 94 8.190 7.958 0.232 1
1 1023 . 4 1 1 A 94 94 GLN HA H 94 3.390 3.616 -0.226 1
1 1030 . 4 1 1 A 94 94 GLN C C 94 178.600 178.096 0.504 1
1 1031 . 4 1 1 A 94 94 GLN CA C 94 58.800 59.229 -0.429 1
1 1032 . 4 1 1 A 94 94 GLN CB C 94 28.400 27.984 0.416 1
1 1034 . 4 1 1 A 94 94 GLN N N 94 116.800 118.298 -1.498 1
1 1036 . 4 1 1 A 95 95 LYS H H 95 7.060 7.729 -0.669 1
1 1037 . 4 1 1 A 95 95 LYS HA H 95 3.780 3.976 -0.196 1
1 1046 . 4 1 1 A 95 95 LYS C C 95 179.300 179.088 0.212 1
1 1047 . 4 1 1 A 95 95 LYS CA C 95 59.900 59.107 0.793 1
1 1048 . 4 1 1 A 95 95 LYS CB C 95 32.700 32.054 0.646 1
1 1052 . 4 1 1 A 95 95 LYS N N 95 117.500 121.559 -4.059 1
1 1053 . 4 1 1 A 96 96 ILE H H 96 7.240 7.481 -0.241 1
1 1054 . 4 1 1 A 96 96 ILE HA H 96 3.420 3.498 -0.078 1
1 1064 . 4 1 1 A 96 96 ILE C C 96 177.800 178.155 -0.355 1
1 1065 . 4 1 1 A 96 96 ILE CA C 96 64.300 64.956 -0.656 1
1 1066 . 4 1 1 A 96 96 ILE CB C 96 37.400 37.580 -0.180 1
1 1070 . 4 1 1 A 96 96 ILE N N 96 120.700 119.757 0.943 1
1 1071 . 4 1 1 A 97 97 LEU H H 97 7.690 7.935 -0.245 1
1 1072 . 4 1 1 A 97 97 LEU HA H 97 3.580 3.582 -0.002 1
1 1082 . 4 1 1 A 97 97 LEU C C 97 179.900 178.821 1.079 1
1 1083 . 4 1 1 A 97 97 LEU CA C 97 58.100 58.133 -0.033 1
1 1084 . 4 1 1 A 97 97 LEU CB C 97 41.500 41.453 0.047 1
1 1088 . 4 1 1 A 97 97 LEU N N 97 120.000 120.649 -0.649 1
1 1089 . 4 1 1 A 98 98 LYS H H 98 7.510 8.203 -0.693 1
1 1090 . 4 1 1 A 98 98 LYS HA H 98 3.950 3.995 -0.045 1
1 1099 . 4 1 1 A 98 98 LYS C C 98 178.700 179.185 -0.485 1
1 1100 . 4 1 1 A 98 98 LYS CA C 98 58.700 59.243 -0.543 1
1 1101 . 4 1 1 A 98 98 LYS CB C 98 32.500 31.898 0.602 1
1 1105 . 4 1 1 A 98 98 LYS N N 98 117.300 117.016 0.284 1
1 1106 . 4 1 1 A 99 99 LYS H H 99 7.470 8.135 -0.665 1
1 1107 . 4 1 1 A 99 99 LYS HA H 99 4.080 3.928 0.152 1
1 1116 . 4 1 1 A 99 99 LYS C C 99 178.100 178.917 -0.817 1
1 1117 . 4 1 1 A 99 99 LYS CA C 99 58.400 59.696 -1.296 1
1 1118 . 4 1 1 A 99 99 LYS CB C 99 33.000 32.360 0.640 1
1 1122 . 4 1 1 A 99 99 LYS N N 99 119.000 120.490 -1.490 1
1 1123 . 4 1 1 A 100 100 ARG H H 100 8.020 7.554 0.466 1
1 1124 . 4 1 1 A 100 100 ARG HA H 100 4.210 4.269 -0.059 1
1 1131 . 4 1 1 A 100 100 ARG C C 100 177.500 176.261 1.239 1
1 1132 . 4 1 1 A 100 100 ARG CA C 100 56.700 57.609 -0.909 1
1 1133 . 4 1 1 A 100 100 ARG CB C 100 30.500 31.208 -0.708 1
1 1136 . 4 1 1 A 100 100 ARG N N 100 117.300 119.008 -1.708 1
1 1137 . 4 1 1 A 101 101 GLY H H 101 7.910 8.242 -0.332 1
1 1138 . 4 1 1 A 101 101 GLY HA2 H 101 3.980 3.992 -0.012 1
1 1139 . 4 1 1 A 101 101 GLY HA3 H 101 4.020 4.004 0.016 1
1 1140 . 4 1 1 A 101 101 GLY C C 101 174.400 174.579 -0.179 1
1 1141 . 4 1 1 A 101 101 GLY CA C 101 46.000 44.874 1.126 1
1 1142 . 4 1 1 A 101 101 GLY N N 101 108.000 107.624 0.376 1
1 1143 . 4 1 1 A 102 102 THR H H 102 7.880 7.774 0.106 1
1 1144 . 4 1 1 A 102 102 THR HA H 102 4.360 4.276 0.084 1
1 1149 . 4 1 1 A 102 102 THR C C 102 174.400 174.117 0.283 1
1 1150 . 4 1 1 A 102 102 THR CA C 102 62.100 63.289 -1.189 1
1 1151 . 4 1 1 A 102 102 THR CB C 102 70.500 69.556 0.944 1
1 1153 . 4 1 1 A 102 102 THR N N 102 113.900 117.505 -3.605 1
1 1154 . 4 1 1 A 103 103 LYS H H 103 8.440 8.690 -0.250 1
1 1155 . 4 1 1 A 103 103 LYS C C 103 176.400 177.021 -0.621 1
1 1156 . 4 1 1 A 103 103 LYS CA C 103 56.600 54.260 2.340 1
1 1157 . 4 1 1 A 103 103 LYS CB C 103 33.300 35.476 -2.176 1
1 1158 . 4 1 1 A 103 103 LYS N N 103 124.000 125.162 -1.162 1
1 1159 . 4 1 1 A 104 104 LEU H H 104 8.180 8.597 -0.417 1
1 1160 . 4 1 1 A 104 104 LEU HA H 104 4.270 4.239 0.031 1
1 1170 . 4 1 1 A 104 104 LEU C C 104 177.100 177.140 -0.040 1
1 1171 . 4 1 1 A 104 104 LEU CA C 104 55.500 56.982 -1.482 1
1 1172 . 4 1 1 A 104 104 LEU CB C 104 42.500 42.275 0.225 1
1 1176 . 4 1 1 A 104 104 LEU N N 104 123.500 124.915 -1.415 1
1 1177 . 4 1 1 A 105 105 GLU H H 105 8.270 7.873 0.397 1
1 1178 . 4 1 1 A 105 105 GLU CA C 105 56.700 56.223 0.477 1
1 1179 . 4 1 1 A 105 105 GLU CB C 105 30.800 30.366 0.434 1
1 13 . 5 1 1 A 2 2 ASN HA H 2 4.980 5.028 -0.048 1
1 18 . 5 1 1 A 2 2 ASN C C 2 176.300 176.775 -0.475 1
1 19 . 5 1 1 A 2 2 ASN CA C 2 52.500 52.203 0.297 1
1 20 . 5 1 1 A 2 2 ASN CB C 2 40.900 39.822 1.078 1
1 22 . 5 1 1 A 3 3 SER H H 3 9.940 8.739 1.201 1
1 23 . 5 1 1 A 3 3 SER HA H 3 3.720 4.187 -0.467 1
1 26 . 5 1 1 A 3 3 SER C C 3 175.900 176.845 -0.945 1
1 27 . 5 1 1 A 3 3 SER CA C 3 63.300 61.646 1.654 1
1 28 . 5 1 1 A 3 3 SER CB C 3 61.700 62.523 -0.823 1
1 29 . 5 1 1 A 3 3 SER N N 3 118.200 116.904 1.296 1
1 30 . 5 1 1 A 4 4 GLU H H 4 8.450 8.189 0.261 1
1 31 . 5 1 1 A 4 4 GLU HA H 4 4.010 4.090 -0.080 1
1 36 . 5 1 1 A 4 4 GLU C C 4 178.800 179.117 -0.317 1
1 37 . 5 1 1 A 4 4 GLU CA C 4 60.300 59.224 1.076 1
1 38 . 5 1 1 A 4 4 GLU CB C 4 29.100 29.300 -0.200 1
1 40 . 5 1 1 A 4 4 GLU N N 4 123.600 122.735 0.865 1
1 41 . 5 1 1 A 5 5 VAL H H 5 7.590 7.560 0.030 1
1 42 . 5 1 1 A 5 5 VAL HA H 5 3.850 3.655 0.195 1
1 50 . 5 1 1 A 5 5 VAL C C 5 179.100 178.501 0.599 1
1 51 . 5 1 1 A 5 5 VAL CA C 5 65.800 66.587 -0.787 1
1 52 . 5 1 1 A 5 5 VAL CB C 5 32.300 31.549 0.751 1
1 55 . 5 1 1 A 5 5 VAL N N 5 119.300 119.910 -0.610 1
1 56 . 5 1 1 A 6 6 ILE H H 6 7.240 8.415 -1.175 1
1 57 . 5 1 1 A 6 6 ILE HA H 6 3.580 3.687 -0.107 1
1 67 . 5 1 1 A 6 6 ILE C C 6 177.000 178.052 -1.052 1
1 68 . 5 1 1 A 6 6 ILE CA C 6 65.300 65.625 -0.325 1
1 69 . 5 1 1 A 6 6 ILE CB C 6 37.900 37.810 0.090 1
1 73 . 5 1 1 A 6 6 ILE N N 6 120.300 120.841 -0.541 1
1 74 . 5 1 1 A 7 7 LYS H H 7 8.050 8.074 -0.024 1
1 75 . 5 1 1 A 7 7 LYS HA H 7 3.570 3.693 -0.123 1
1 84 . 5 1 1 A 7 7 LYS C C 7 178.700 179.517 -0.817 1
1 85 . 5 1 1 A 7 7 LYS CA C 7 61.300 60.734 0.566 1
1 86 . 5 1 1 A 7 7 LYS CB C 7 32.200 32.193 0.007 1
1 90 . 5 1 1 A 7 7 LYS N N 7 119.200 119.273 -0.073 1
1 91 . 5 1 1 A 8 8 GLU H H 8 8.100 8.017 0.083 1
1 92 . 5 1 1 A 8 8 GLU HA H 8 4.000 4.073 -0.073 1
1 97 . 5 1 1 A 8 8 GLU C C 8 178.500 178.865 -0.365 1
1 98 . 5 1 1 A 8 8 GLU CA C 8 59.700 58.854 0.846 1
1 99 . 5 1 1 A 8 8 GLU CB C 8 29.600 29.564 0.036 1
1 101 . 5 1 1 A 8 8 GLU N N 8 119.400 119.482 -0.082 1
1 102 . 5 1 1 A 9 9 PHE H H 9 7.720 8.523 -0.803 1
1 103 . 5 1 1 A 9 9 PHE HA H 9 4.160 4.153 0.007 1
1 109 . 5 1 1 A 9 9 PHE C C 9 176.900 177.243 -0.343 1
1 110 . 5 1 1 A 9 9 PHE CA C 9 61.300 61.181 0.119 1
1 111 . 5 1 1 A 9 9 PHE CB C 9 39.400 39.446 -0.046 1
1 115 . 5 1 1 A 9 9 PHE N N 9 121.300 122.773 -1.473 1
1 116 . 5 1 1 A 10 10 LEU H H 10 8.060 8.670 -0.610 1
1 117 . 5 1 1 A 10 10 LEU HA H 10 3.660 3.839 -0.179 1
1 127 . 5 1 1 A 10 10 LEU C C 10 179.000 179.390 -0.390 1
1 128 . 5 1 1 A 10 10 LEU CA C 10 58.000 57.938 0.062 1
1 129 . 5 1 1 A 10 10 LEU CB C 10 41.400 41.514 -0.114 1
1 133 . 5 1 1 A 10 10 LEU N N 10 118.000 119.340 -1.340 1
1 134 . 5 1 1 A 11 11 GLU H H 11 7.990 8.368 -0.378 1
1 135 . 5 1 1 A 11 11 GLU HA H 11 4.110 3.909 0.201 1
1 140 . 5 1 1 A 11 11 GLU C C 11 174.200 178.173 -3.973 1
1 141 . 5 1 1 A 11 11 GLU CA C 11 59.200 59.459 -0.259 1
1 142 . 5 1 1 A 11 11 GLU CB C 11 29.300 28.860 0.440 1
1 144 . 5 1 1 A 11 11 GLU N N 11 118.300 119.989 -1.689 1
1 145 . 5 1 1 A 12 12 ASP H H 12 8.080 8.342 -0.262 1
1 146 . 5 1 1 A 12 12 ASP HA H 12 4.340 4.310 0.030 1
1 149 . 5 1 1 A 12 12 ASP C C 12 178.900 178.379 0.521 1
1 150 . 5 1 1 A 12 12 ASP CA C 12 57.600 57.856 -0.256 1
1 151 . 5 1 1 A 12 12 ASP CB C 12 41.000 41.238 -0.238 1
1 152 . 5 1 1 A 12 12 ASP N N 12 121.800 120.393 1.407 1
1 153 . 5 1 1 A 13 13 ILE H H 13 7.610 7.482 0.128 1
1 154 . 5 1 1 A 13 13 ILE HA H 13 4.240 3.969 0.271 1
1 164 . 5 1 1 A 13 13 ILE C C 13 176.800 176.642 0.158 1
1 165 . 5 1 1 A 13 13 ILE CA C 13 62.100 60.913 1.187 1
1 166 . 5 1 1 A 13 13 ILE CB C 13 38.300 37.162 1.138 1
1 170 . 5 1 1 A 13 13 ILE N N 13 110.800 112.234 -1.434 1
1 171 . 5 1 1 A 14 14 GLY H H 14 7.640 7.631 0.009 1
1 172 . 5 1 1 A 14 14 GLY HA2 H 14 3.810 3.922 -0.112 1
1 173 . 5 1 1 A 14 14 GLY HA3 H 14 3.880 3.925 -0.045 1
1 174 . 5 1 1 A 14 14 GLY C C 14 175.200 174.479 0.721 1
1 175 . 5 1 1 A 14 14 GLY CA C 14 46.900 46.374 0.526 1
1 176 . 5 1 1 A 14 14 GLY N N 14 111.800 111.497 0.303 1
1 177 . 5 1 1 A 15 15 GLU H H 15 7.870 8.268 -0.398 1
1 178 . 5 1 1 A 15 15 GLU HA H 15 4.680 4.641 0.039 1
1 183 . 5 1 1 A 15 15 GLU C C 15 175.100 175.663 -0.563 1
1 184 . 5 1 1 A 15 15 GLU CA C 15 54.800 55.134 -0.334 1
1 185 . 5 1 1 A 15 15 GLU CB C 15 32.200 31.291 0.909 1
1 187 . 5 1 1 A 15 15 GLU N N 15 119.200 120.926 -1.726 1
1 188 . 5 1 1 A 16 16 ASP H H 16 8.220 8.606 -0.386 1
1 189 . 5 1 1 A 16 16 ASP HA H 16 4.680 4.909 -0.229 1
1 192 . 5 1 1 A 16 16 ASP C C 16 174.600 174.803 -0.203 1
1 193 . 5 1 1 A 16 16 ASP CA C 16 53.600 54.315 -0.715 1
1 194 . 5 1 1 A 16 16 ASP CB C 16 42.900 41.677 1.223 1
1 195 . 5 1 1 A 16 16 ASP N N 16 120.600 124.988 -4.388 1
1 196 . 5 1 1 A 17 17 TYR H H 17 7.540 8.860 -1.320 1
1 197 . 5 1 1 A 17 17 TYR HA H 17 4.910 5.410 -0.500 1
1 202 . 5 1 1 A 17 17 TYR C C 17 173.600 173.974 -0.374 1
1 203 . 5 1 1 A 17 17 TYR CA C 17 56.200 56.361 -0.161 1
1 204 . 5 1 1 A 17 17 TYR CB C 17 41.100 41.205 -0.105 1
1 207 . 5 1 1 A 17 17 TYR N N 17 112.700 128.060 -15.360 1
1 208 . 5 1 1 A 18 18 ILE H H 18 7.950 8.664 -0.714 1
1 209 . 5 1 1 A 18 18 ILE HA H 18 4.330 4.693 -0.363 1
1 219 . 5 1 1 A 18 18 ILE C C 18 174.700 172.981 1.719 1
1 220 . 5 1 1 A 18 18 ILE CA C 18 60.300 59.687 0.613 1
1 221 . 5 1 1 A 18 18 ILE CB C 18 41.000 41.364 -0.364 1
1 225 . 5 1 1 A 18 18 ILE N N 18 120.400 128.155 -7.755 1
1 226 . 5 1 1 A 19 19 GLU H H 19 8.760 8.913 -0.153 1
1 227 . 5 1 1 A 19 19 GLU HA H 19 5.200 5.101 0.099 1
1 232 . 5 1 1 A 19 19 GLU C C 19 175.200 174.980 0.220 1
1 233 . 5 1 1 A 19 19 GLU CA C 19 55.500 54.808 0.692 1
1 234 . 5 1 1 A 19 19 GLU CB C 19 32.400 31.164 1.236 1
1 236 . 5 1 1 A 19 19 GLU N N 19 129.000 130.834 -1.834 1
1 237 . 5 1 1 A 20 20 LEU H H 20 8.730 9.478 -0.748 1
1 238 . 5 1 1 A 20 20 LEU HA H 20 4.620 4.516 0.104 1
1 248 . 5 1 1 A 20 20 LEU C C 20 176.200 175.855 0.345 1
1 249 . 5 1 1 A 20 20 LEU CA C 20 54.100 53.391 0.709 1
1 250 . 5 1 1 A 20 20 LEU CB C 20 44.400 41.574 2.826 1
1 254 . 5 1 1 A 20 20 LEU N N 20 128.400 129.419 -1.019 1
1 255 . 5 1 1 A 21 21 GLU H H 21 8.700 8.924 -0.224 1
1 256 . 5 1 1 A 21 21 GLU HA H 21 3.870 3.969 -0.099 1
1 261 . 5 1 1 A 21 21 GLU C C 21 176.100 175.726 0.374 1
1 262 . 5 1 1 A 21 21 GLU CA C 21 58.800 57.925 0.875 1
1 263 . 5 1 1 A 21 21 GLU CB C 21 28.200 28.103 0.097 1
1 265 . 5 1 1 A 21 21 GLU N N 21 122.600 126.182 -3.582 1
1 266 . 5 1 1 A 22 22 ASN H H 22 8.640 8.344 0.296 1
1 267 . 5 1 1 A 22 22 ASN HA H 22 4.540 4.285 0.255 1
1 272 . 5 1 1 A 22 22 ASN C C 22 173.800 174.167 -0.367 1
1 273 . 5 1 1 A 22 22 ASN CA C 22 54.600 54.918 -0.318 1
1 274 . 5 1 1 A 22 22 ASN CB C 22 38.400 36.852 1.548 1
1 275 . 5 1 1 A 22 22 ASN N N 22 118.000 108.775 9.225 1
1 277 . 5 1 1 A 23 23 GLU H H 23 7.740 7.733 0.007 1
1 278 . 5 1 1 A 23 23 GLU HA H 23 5.430 5.009 0.421 1
1 283 . 5 1 1 A 23 23 GLU C C 23 175.400 175.293 0.107 1
1 284 . 5 1 1 A 23 23 GLU CA C 23 54.900 55.163 -0.263 1
1 285 . 5 1 1 A 23 23 GLU CB C 23 34.500 31.377 3.123 1
1 287 . 5 1 1 A 23 23 GLU N N 23 116.400 117.901 -1.501 1
1 288 . 5 1 1 A 24 24 ILE H H 24 9.050 8.742 0.308 1
1 289 . 5 1 1 A 24 24 ILE HA H 24 4.810 4.752 0.058 1
1 299 . 5 1 1 A 24 24 ILE C C 24 174.600 175.218 -0.618 1
1 300 . 5 1 1 A 24 24 ILE CA C 24 60.700 60.393 0.307 1
1 301 . 5 1 1 A 24 24 ILE CB C 24 41.300 37.816 3.484 1
1 305 . 5 1 1 A 24 24 ILE N N 24 122.800 126.127 -3.327 1
1 306 . 5 1 1 A 25 25 HIS H H 25 9.490 9.112 0.378 1
1 307 . 5 1 1 A 25 25 HIS HA H 25 5.090 5.597 -0.507 1
1 312 . 5 1 1 A 25 25 HIS C C 25 176.100 174.379 1.721 1
1 313 . 5 1 1 A 25 25 HIS CA C 25 56.100 55.003 1.097 1
1 314 . 5 1 1 A 25 25 HIS CB C 25 33.100 30.883 2.217 1
1 317 . 5 1 1 A 25 25 HIS N N 25 127.300 126.737 0.563 1
1 318 . 5 1 1 A 26 26 LEU H H 26 8.820 9.025 -0.205 1
1 319 . 5 1 1 A 26 26 LEU HA H 26 5.160 4.973 0.187 1
1 329 . 5 1 1 A 26 26 LEU C C 26 178.000 175.800 2.200 1
1 330 . 5 1 1 A 26 26 LEU CA C 26 52.900 53.282 -0.382 1
1 331 . 5 1 1 A 26 26 LEU CB C 26 48.100 44.254 3.846 1
1 335 . 5 1 1 A 26 26 LEU N N 26 121.600 126.135 -4.535 1
1 336 . 5 1 1 A 27 27 LYS H H 27 8.990 8.341 0.649 1
1 337 . 5 1 1 A 27 27 LYS HA H 27 4.630 4.453 0.177 1
1 345 . 5 1 1 A 27 27 LYS CA C 27 55.700 54.606 1.094 1
1 346 . 5 1 1 A 27 27 LYS CB C 27 31.900 33.579 -1.679 1
1 350 . 5 1 1 A 27 27 LYS N N 27 125.900 122.783 3.117 1
1 351 . 5 1 1 A 28 28 PRO HA H 28 4.500 4.457 0.043 1
1 358 . 5 1 1 A 28 28 PRO C C 28 177.900 178.150 -0.250 1
1 359 . 5 1 1 A 28 28 PRO CA C 28 67.400 65.859 1.541 1
1 360 . 5 1 1 A 28 28 PRO CB C 28 32.100 31.954 0.146 1
1 363 . 5 1 1 A 29 29 GLU H H 29 9.880 8.439 1.441 1
1 364 . 5 1 1 A 29 29 GLU HA H 29 4.140 4.237 -0.097 1
1 369 . 5 1 1 A 29 29 GLU C C 29 178.800 179.449 -0.649 1
1 370 . 5 1 1 A 29 29 GLU CA C 29 60.600 59.752 0.848 1
1 371 . 5 1 1 A 29 29 GLU CB C 29 29.200 29.485 -0.285 1
1 373 . 5 1 1 A 29 29 GLU N N 29 117.100 118.314 -1.214 1
1 374 . 5 1 1 A 30 30 VAL H H 30 7.050 8.309 -1.259 1
1 375 . 5 1 1 A 30 30 VAL HA H 30 3.850 3.812 0.038 1
1 383 . 5 1 1 A 30 30 VAL C C 30 177.700 178.499 -0.799 1
1 384 . 5 1 1 A 30 30 VAL CA C 30 65.600 66.162 -0.562 1
1 385 . 5 1 1 A 30 30 VAL CB C 30 32.100 32.048 0.052 1
1 388 . 5 1 1 A 30 30 VAL N N 30 120.900 120.203 0.697 1
1 389 . 5 1 1 A 31 31 PHE H H 31 8.980 8.994 -0.014 1
1 390 . 5 1 1 A 31 31 PHE HA H 31 3.870 4.277 -0.407 1
1 394 . 5 1 1 A 31 31 PHE C C 31 176.700 177.292 -0.592 1
1 395 . 5 1 1 A 31 31 PHE CA C 31 62.200 62.056 0.144 1
1 396 . 5 1 1 A 31 31 PHE CB C 31 39.300 39.117 0.183 1
1 398 . 5 1 1 A 31 31 PHE N N 31 121.100 120.662 0.438 1
1 399 . 5 1 1 A 32 32 TYR H H 32 8.640 8.706 -0.066 1
1 400 . 5 1 1 A 32 32 TYR HA H 32 3.880 4.758 -0.878 1
1 405 . 5 1 1 A 32 32 TYR C C 32 176.000 178.281 -2.281 1
1 406 . 5 1 1 A 32 32 TYR CA C 32 63.300 62.174 1.126 1
1 407 . 5 1 1 A 32 32 TYR CB C 32 39.100 39.110 -0.010 1
1 410 . 5 1 1 A 32 32 TYR N N 32 117.400 121.037 -3.637 1
1 411 . 5 1 1 A 33 33 GLU H H 33 7.400 7.927 -0.527 1
1 412 . 5 1 1 A 33 33 GLU HA H 33 4.050 4.191 -0.141 1
1 417 . 5 1 1 A 33 33 GLU C C 33 180.200 179.223 0.977 1
1 418 . 5 1 1 A 33 33 GLU CA C 33 59.500 58.988 0.512 1
1 419 . 5 1 1 A 33 33 GLU CB C 33 29.300 29.604 -0.304 1
1 421 . 5 1 1 A 33 33 GLU N N 33 116.100 118.854 -2.754 1
1 422 . 5 1 1 A 34 34 VAL H H 34 8.530 8.156 0.374 1
1 423 . 5 1 1 A 34 34 VAL HA H 34 3.350 3.582 -0.232 1
1 431 . 5 1 1 A 34 34 VAL C C 34 175.800 178.251 -2.451 1
1 432 . 5 1 1 A 34 34 VAL CA C 34 66.400 66.227 0.173 1
1 433 . 5 1 1 A 34 34 VAL CB C 34 32.200 31.561 0.639 1
1 436 . 5 1 1 A 34 34 VAL N N 34 120.600 120.170 0.430 1
1 437 . 5 1 1 A 35 35 TRP H H 35 9.100 8.430 0.670 1
1 438 . 5 1 1 A 35 35 TRP HA H 35 3.340 3.694 -0.354 1
1 447 . 5 1 1 A 35 35 TRP C C 35 178.000 178.286 -0.286 1
1 448 . 5 1 1 A 35 35 TRP CA C 35 61.800 60.290 1.510 1
1 449 . 5 1 1 A 35 35 TRP CB C 35 27.900 29.481 -1.581 1
1 455 . 5 1 1 A 35 35 TRP N N 35 121.700 121.805 -0.105 1
1 457 . 5 1 1 A 36 36 LYS H H 36 7.970 7.746 0.224 1
1 458 . 5 1 1 A 36 36 LYS HA H 36 3.330 3.605 -0.275 1
1 467 . 5 1 1 A 36 36 LYS C C 36 180.000 178.229 1.771 1
1 468 . 5 1 1 A 36 36 LYS CA C 36 59.000 58.623 0.377 1
1 469 . 5 1 1 A 36 36 LYS CB C 36 31.800 32.146 -0.346 1
1 473 . 5 1 1 A 36 36 LYS N N 36 116.300 118.200 -1.900 1
1 474 . 5 1 1 A 37 37 TYR H H 37 7.750 7.900 -0.150 1
1 475 . 5 1 1 A 37 37 TYR HA H 37 3.940 3.945 -0.005 1
1 480 . 5 1 1 A 37 37 TYR C C 37 177.600 177.830 -0.230 1
1 481 . 5 1 1 A 37 37 TYR CA C 37 61.200 60.977 0.223 1
1 482 . 5 1 1 A 37 37 TYR CB C 37 38.800 38.417 0.383 1
1 485 . 5 1 1 A 37 37 TYR N N 37 122.700 121.753 0.947 1
1 486 . 5 1 1 A 38 38 VAL H H 38 7.660 7.559 0.101 1
1 487 . 5 1 1 A 38 38 VAL HA H 38 3.870 3.835 0.035 1
1 495 . 5 1 1 A 38 38 VAL C C 38 175.600 176.191 -0.591 1
1 496 . 5 1 1 A 38 38 VAL CA C 38 61.100 61.839 -0.739 1
1 497 . 5 1 1 A 38 38 VAL CB C 38 30.700 31.237 -0.537 1
1 500 . 5 1 1 A 38 38 VAL N N 38 108.200 113.078 -4.878 1
1 501 . 5 1 1 A 39 39 GLY H H 39 7.090 7.368 -0.278 1
1 502 . 5 1 1 A 39 39 GLY HA2 H 39 3.320 3.737 -0.417 1
1 503 . 5 1 1 A 39 39 GLY HA3 H 39 3.730 3.760 -0.030 1
1 504 . 5 1 1 A 39 39 GLY C C 39 173.600 174.459 -0.859 1
1 505 . 5 1 1 A 39 39 GLY CA C 39 46.100 44.959 1.141 1
1 506 . 5 1 1 A 39 39 GLY N N 39 107.600 110.432 -2.832 1
1 507 . 5 1 1 A 40 40 GLU H H 40 7.730 7.947 -0.217 1
1 508 . 5 1 1 A 40 40 GLU HA H 40 1.090 2.870 -1.780 1
1 513 . 5 1 1 A 40 40 GLU CA C 40 55.700 56.313 -0.613 1
1 514 . 5 1 1 A 40 40 GLU CB C 40 27.200 27.515 -0.315 1
1 516 . 5 1 1 A 40 40 GLU N N 40 114.400 113.760 0.640 1
1 517 . 5 1 1 A 41 41 PRO HA H 41 4.310 4.550 -0.240 1
1 524 . 5 1 1 A 41 41 PRO CA C 41 62.300 62.355 -0.055 1
1 525 . 5 1 1 A 41 41 PRO CB C 41 32.700 32.689 0.011 1
1 528 . 5 1 1 A 42 42 GLU H H 42 8.110 8.609 -0.499 1
1 529 . 5 1 1 A 42 42 GLU C C 42 175.800 176.719 -0.919 1
1 530 . 5 1 1 A 42 42 GLU CA C 42 57.800 56.535 1.265 1
1 531 . 5 1 1 A 42 42 GLU CB C 42 30.600 30.540 0.060 1
1 533 . 5 1 1 A 42 42 GLU N N 42 119.100 121.095 -1.995 1
1 534 . 5 1 1 A 43 43 LEU H H 43 8.140 8.573 -0.433 1
1 535 . 5 1 1 A 43 43 LEU HA H 43 4.840 4.445 0.395 1
1 545 . 5 1 1 A 43 43 LEU C C 43 177.300 176.349 0.951 1
1 546 . 5 1 1 A 43 43 LEU CA C 43 53.700 54.718 -1.018 1
1 547 . 5 1 1 A 43 43 LEU CB C 43 43.900 41.569 2.331 1
1 551 . 5 1 1 A 43 43 LEU N N 43 124.700 124.333 0.367 1
1 552 . 5 1 1 A 44 44 LYS H H 44 8.640 8.181 0.459 1
1 553 . 5 1 1 A 44 44 LYS HA H 44 4.500 4.616 -0.116 1
1 562 . 5 1 1 A 44 44 LYS C C 44 174.500 175.476 -0.976 1
1 563 . 5 1 1 A 44 44 LYS CA C 44 54.700 55.424 -0.724 1
1 564 . 5 1 1 A 44 44 LYS CB C 44 36.200 33.112 3.088 1
1 568 . 5 1 1 A 44 44 LYS N N 44 123.300 124.972 -1.672 1
1 569 . 5 1 1 A 45 45 THR H H 45 7.990 8.683 -0.693 1
1 570 . 5 1 1 A 45 45 THR HA H 45 5.700 5.432 0.268 1
1 575 . 5 1 1 A 45 45 THR C C 45 175.100 173.910 1.190 1
1 576 . 5 1 1 A 45 45 THR CA C 45 59.600 59.567 0.033 1
1 577 . 5 1 1 A 45 45 THR CB C 45 73.400 70.845 2.555 1
1 579 . 5 1 1 A 45 45 THR N N 45 106.900 115.330 -8.430 1
1 580 . 5 1 1 A 46 46 TYR H H 46 8.470 9.216 -0.746 1
1 581 . 5 1 1 A 46 46 TYR HA H 46 4.930 5.855 -0.925 1
1 586 . 5 1 1 A 46 46 TYR C C 46 172.400 173.796 -1.396 1
1 587 . 5 1 1 A 46 46 TYR CA C 46 57.100 55.307 1.793 1
1 588 . 5 1 1 A 46 46 TYR CB C 46 40.200 42.106 -1.906 1
1 591 . 5 1 1 A 46 46 TYR N N 46 117.100 119.201 -2.101 1
1 592 . 5 1 1 A 47 47 VAL H H 47 8.430 8.875 -0.445 1
1 593 . 5 1 1 A 47 47 VAL HA H 47 4.890 4.415 0.475 1
1 601 . 5 1 1 A 47 47 VAL C C 47 175.800 175.750 0.050 1
1 602 . 5 1 1 A 47 47 VAL CA C 47 60.800 62.237 -1.437 1
1 603 . 5 1 1 A 47 47 VAL CB C 47 34.800 32.007 2.793 1
1 606 . 5 1 1 A 47 47 VAL N N 47 119.200 123.266 -4.066 1
1 607 . 5 1 1 A 48 48 ILE H H 48 8.680 9.256 -0.576 1
1 608 . 5 1 1 A 48 48 ILE HA H 48 4.560 5.002 -0.442 1
1 618 . 5 1 1 A 48 48 ILE C C 48 174.500 174.187 0.313 1
1 619 . 5 1 1 A 48 48 ILE CA C 48 59.700 59.083 0.617 1
1 620 . 5 1 1 A 48 48 ILE CB C 48 41.500 41.091 0.409 1
1 624 . 5 1 1 A 48 48 ILE N N 48 124.400 123.270 1.130 1
1 625 . 5 1 1 A 49 49 GLU H H 49 8.320 8.887 -0.567 1
1 626 . 5 1 1 A 49 49 GLU C C 49 175.500 175.946 -0.446 1
1 627 . 5 1 1 A 49 49 GLU CA C 49 55.500 55.510 -0.010 1
1 628 . 5 1 1 A 49 49 GLU CB C 49 31.800 29.978 1.822 1
1 630 . 5 1 1 A 49 49 GLU N N 49 123.400 124.443 -1.043 1
1 631 . 5 1 1 A 50 50 ASP H H 50 8.610 8.454 0.156 1
1 632 . 5 1 1 A 50 50 ASP C C 50 175.100 175.591 -0.491 1
1 633 . 5 1 1 A 50 50 ASP CA C 50 53.100 53.092 0.008 1
1 634 . 5 1 1 A 50 50 ASP CB C 50 44.000 42.219 1.781 1
1 635 . 5 1 1 A 50 50 ASP N N 50 124.300 124.706 -0.406 1
1 636 . 5 1 1 A 51 51 GLU H H 51 8.450 8.668 -0.218 1
1 637 . 5 1 1 A 51 51 GLU C C 51 175.900 176.251 -0.351 1
1 638 . 5 1 1 A 51 51 GLU CA C 51 56.000 55.487 0.513 1
1 639 . 5 1 1 A 51 51 GLU CB C 51 31.700 30.601 1.099 1
1 640 . 5 1 1 A 51 51 GLU N N 51 121.300 121.687 -0.387 1
1 641 . 5 1 1 A 52 52 ILE H H 52 8.480 9.249 -0.769 1
1 642 . 5 1 1 A 52 52 ILE C C 52 175.400 175.063 0.337 1
1 643 . 5 1 1 A 52 52 ILE CA C 52 60.400 59.355 1.045 1
1 644 . 5 1 1 A 52 52 ILE CB C 52 40.000 40.201 -0.201 1
1 645 . 5 1 1 A 52 52 ILE N N 52 122.700 119.989 2.711 1
1 646 . 5 1 1 A 53 53 VAL H H 53 8.140 9.093 -0.953 1
1 647 . 5 1 1 A 53 53 VAL C C 53 175.600 175.343 0.257 1
1 648 . 5 1 1 A 53 53 VAL CA C 53 61.900 60.836 1.064 1
1 649 . 5 1 1 A 53 53 VAL CB C 53 33.200 32.984 0.216 1
1 650 . 5 1 1 A 53 53 VAL N N 53 124.400 122.067 2.333 1
1 651 . 5 1 1 A 54 54 GLU H H 54 8.540 8.742 -0.202 1
1 652 . 5 1 1 A 54 54 GLU CA C 54 55.600 54.505 1.095 1
1 653 . 5 1 1 A 54 54 GLU CB C 54 34.300 30.448 3.852 1
1 654 . 5 1 1 A 54 54 GLU N N 54 125.900 125.958 -0.058 1
1 655 . 5 1 1 A 55 55 PRO C C 55 177.500 176.409 1.091 1
1 656 . 5 1 1 A 55 55 PRO CA C 55 63.400 62.643 0.757 1
1 657 . 5 1 1 A 55 55 PRO CB C 55 32.300 33.358 -1.058 1
1 658 . 5 1 1 A 56 56 GLY H H 56 8.420 8.382 0.038 1
1 659 . 5 1 1 A 56 56 GLY HA2 H 56 3.830 4.176 -0.346 1
1 660 . 5 1 1 A 56 56 GLY HA3 H 56 4.000 4.214 -0.214 1
1 661 . 5 1 1 A 56 56 GLY C C 56 174.500 175.209 -0.709 1
1 662 . 5 1 1 A 56 56 GLY CA C 56 45.400 45.733 -0.333 1
1 663 . 5 1 1 A 56 56 GLY N N 56 109.700 108.016 1.684 1
1 664 . 5 1 1 A 57 57 GLU H H 57 8.180 7.875 0.305 1
1 665 . 5 1 1 A 57 57 GLU C C 57 176.300 176.126 0.174 1
1 666 . 5 1 1 A 57 57 GLU CA C 57 57.500 58.452 -0.952 1
1 667 . 5 1 1 A 57 57 GLU CB C 57 30.400 29.967 0.433 1
1 668 . 5 1 1 A 57 57 GLU N N 57 120.900 118.659 2.241 1
1 669 . 5 1 1 A 58 58 TYR H H 58 8.020 7.778 0.242 1
1 670 . 5 1 1 A 58 58 TYR C C 58 175.100 175.150 -0.050 1
1 671 . 5 1 1 A 58 58 TYR CA C 58 57.400 56.640 0.760 1
1 672 . 5 1 1 A 58 58 TYR CB C 58 38.900 41.662 -2.762 1
1 673 . 5 1 1 A 58 58 TYR N N 58 118.800 116.346 2.454 1
1 674 . 5 1 1 A 59 59 ASP H H 59 7.950 8.885 -0.935 1
1 675 . 5 1 1 A 59 59 ASP CA C 59 52.700 52.632 0.068 1
1 676 . 5 1 1 A 59 59 ASP CB C 59 41.000 40.767 0.233 1
1 677 . 5 1 1 A 59 59 ASP N N 59 123.500 123.768 -0.268 1
1 678 . 5 1 1 A 61 61 PRO HA H 61 4.510 4.329 0.181 1
1 685 . 5 1 1 A 61 61 PRO C C 61 176.500 176.314 0.186 1
1 686 . 5 1 1 A 61 61 PRO CA C 61 63.700 65.019 -1.319 1
1 687 . 5 1 1 A 61 61 PRO CB C 61 34.200 31.675 2.525 1
1 690 . 5 1 1 A 62 62 GLU H H 62 8.490 7.948 0.542 1
1 691 . 5 1 1 A 62 62 GLU N N 62 124.600 119.302 5.298 1
1 692 . 5 1 1 A 64 64 LYS C C 64 176.300 174.884 1.416 1
1 693 . 5 1 1 A 64 64 LYS CA C 64 57.000 54.757 2.243 1
1 694 . 5 1 1 A 64 64 LYS CB C 64 33.100 30.777 2.323 1
1 695 . 5 1 1 A 65 65 TYR H H 65 7.960 8.280 -0.320 1
1 696 . 5 1 1 A 65 65 TYR C C 65 176.000 175.659 0.341 1
1 697 . 5 1 1 A 65 65 TYR CA C 65 57.800 59.219 -1.419 1
1 698 . 5 1 1 A 65 65 TYR CB C 65 38.800 38.884 -0.084 1
1 699 . 5 1 1 A 65 65 TYR N N 65 119.300 124.628 -5.328 1
1 700 . 5 1 1 A 66 66 THR H H 66 7.820 8.448 -0.628 1
1 701 . 5 1 1 A 66 66 THR HA H 66 4.280 4.996 -0.716 1
1 706 . 5 1 1 A 66 66 THR C C 66 174.100 175.930 -1.830 1
1 707 . 5 1 1 A 66 66 THR CA C 66 62.100 59.651 2.449 1
1 708 . 5 1 1 A 66 66 THR CB C 66 70.000 70.792 -0.792 1
1 710 . 5 1 1 A 66 66 THR N N 66 113.900 114.997 -1.097 1
1 711 . 5 1 1 A 67 67 ASN H H 67 8.270 8.714 -0.444 1
1 712 . 5 1 1 A 67 67 ASN C C 67 174.100 175.857 -1.757 1
1 713 . 5 1 1 A 67 67 ASN CA C 67 53.400 57.134 -3.734 1
1 714 . 5 1 1 A 67 67 ASN CB C 67 39.300 38.821 0.479 1
1 715 . 5 1 1 A 67 67 ASN N N 67 121.400 122.547 -1.147 1
1 716 . 5 1 1 A 68 68 VAL H H 68 7.660 8.148 -0.488 1
1 717 . 5 1 1 A 68 68 VAL C C 68 175.500 174.296 1.204 1
1 718 . 5 1 1 A 68 68 VAL CA C 68 61.800 61.210 0.590 1
1 719 . 5 1 1 A 68 68 VAL CB C 68 33.700 33.885 -0.185 1
1 720 . 5 1 1 A 68 68 VAL N N 68 119.400 118.460 0.940 1
1 721 . 5 1 1 A 69 69 LYS H H 69 8.690 9.086 -0.396 1
1 722 . 5 1 1 A 69 69 LYS C C 69 175.200 175.126 0.074 1
1 723 . 5 1 1 A 69 69 LYS CA C 69 55.200 54.925 0.275 1
1 724 . 5 1 1 A 69 69 LYS CB C 69 35.200 34.021 1.179 1
1 725 . 5 1 1 A 69 69 LYS N N 69 126.500 128.437 -1.937 1
1 726 . 5 1 1 A 70 70 LYS H H 70 8.230 8.894 -0.664 1
1 727 . 5 1 1 A 70 70 LYS C C 70 176.400 175.606 0.794 1
1 728 . 5 1 1 A 70 70 LYS CA C 70 55.600 56.130 -0.530 1
1 729 . 5 1 1 A 70 70 LYS CB C 70 33.800 33.138 0.662 1
1 730 . 5 1 1 A 70 70 LYS N N 70 122.700 128.799 -6.099 1
1 731 . 5 1 1 A 71 71 VAL H H 71 8.530 9.185 -0.655 1
1 732 . 5 1 1 A 71 71 VAL HA H 71 4.510 4.615 -0.105 1
1 733 . 5 1 1 A 71 71 VAL C C 71 174.700 174.957 -0.257 1
1 734 . 5 1 1 A 71 71 VAL CA C 71 60.900 61.297 -0.397 1
1 735 . 5 1 1 A 71 71 VAL CB C 71 34.800 33.605 1.195 1
1 738 . 5 1 1 A 71 71 VAL N N 71 121.200 127.888 -6.688 1
1 739 . 5 1 1 A 72 72 LYS H H 72 8.210 8.698 -0.488 1
1 740 . 5 1 1 A 72 72 LYS HA H 72 4.800 4.564 0.236 1
1 747 . 5 1 1 A 72 72 LYS C C 72 176.200 174.952 1.248 1
1 748 . 5 1 1 A 72 72 LYS CA C 72 55.700 55.864 -0.164 1
1 749 . 5 1 1 A 72 72 LYS CB C 72 33.700 32.339 1.361 1
1 752 . 5 1 1 A 72 72 LYS N N 72 123.600 127.285 -3.685 1
1 753 . 5 1 1 A 73 73 ILE H H 73 8.890 8.778 0.112 1
1 754 . 5 1 1 A 73 73 ILE C C 73 174.400 173.771 0.629 1
1 755 . 5 1 1 A 73 73 ILE CA C 73 60.400 59.834 0.566 1
1 756 . 5 1 1 A 73 73 ILE CB C 73 40.800 40.888 -0.088 1
1 760 . 5 1 1 A 73 73 ILE N N 73 125.100 125.956 -0.856 1
1 761 . 5 1 1 A 74 74 LYS H H 74 8.420 8.902 -0.482 1
1 762 . 5 1 1 A 74 74 LYS HA H 74 4.800 4.899 -0.099 1
1 771 . 5 1 1 A 74 74 LYS C C 74 175.600 175.256 0.344 1
1 772 . 5 1 1 A 74 74 LYS CA C 74 56.200 54.714 1.486 1
1 773 . 5 1 1 A 74 74 LYS CB C 74 34.300 34.336 -0.036 1
1 777 . 5 1 1 A 74 74 LYS N N 74 126.400 131.032 -4.632 1
1 778 . 5 1 1 A 75 75 LYS H H 75 9.090 8.443 0.647 1
1 779 . 5 1 1 A 75 75 LYS HA H 75 4.800 4.979 -0.179 1
1 788 . 5 1 1 A 75 75 LYS C C 75 174.900 175.062 -0.162 1
1 789 . 5 1 1 A 75 75 LYS CA C 75 53.200 54.327 -1.127 1
1 790 . 5 1 1 A 75 75 LYS CB C 75 34.200 34.745 -0.545 1
1 794 . 5 1 1 A 75 75 LYS N N 75 127.500 126.879 0.621 1
1 795 . 5 1 1 A 76 76 VAL H H 76 8.610 8.312 0.298 1
1 796 . 5 1 1 A 76 76 VAL HA H 76 5.340 4.865 0.475 1
1 804 . 5 1 1 A 76 76 VAL C C 76 171.400 173.831 -2.431 1
1 805 . 5 1 1 A 76 76 VAL CA C 76 58.000 59.422 -1.422 1
1 806 . 5 1 1 A 76 76 VAL CB C 76 36.400 35.078 1.322 1
1 809 . 5 1 1 A 76 76 VAL N N 76 120.100 120.916 -0.816 1
1 810 . 5 1 1 A 77 77 TYR H H 77 9.110 9.199 -0.089 1
1 811 . 5 1 1 A 77 77 TYR HA H 77 6.150 5.937 0.213 1
1 816 . 5 1 1 A 77 77 TYR C C 77 173.600 173.114 0.486 1
1 817 . 5 1 1 A 77 77 TYR CA C 77 56.200 55.709 0.491 1
1 818 . 5 1 1 A 77 77 TYR CB C 77 44.000 41.404 2.596 1
1 821 . 5 1 1 A 77 77 TYR N N 77 121.300 121.933 -0.633 1
1 822 . 5 1 1 A 78 78 PHE H H 78 8.190 8.707 -0.517 1
1 823 . 5 1 1 A 78 78 PHE HA H 78 5.130 5.699 -0.569 1
1 829 . 5 1 1 A 78 78 PHE C C 78 173.600 172.689 0.911 1
1 830 . 5 1 1 A 78 78 PHE CA C 78 55.900 55.229 0.671 1
1 831 . 5 1 1 A 78 78 PHE CB C 78 42.500 42.850 -0.350 1
1 835 . 5 1 1 A 78 78 PHE N N 78 112.700 116.911 -4.211 1
1 836 . 5 1 1 A 79 79 GLU H H 79 8.920 8.926 -0.006 1
1 837 . 5 1 1 A 79 79 GLU HA H 79 5.390 5.187 0.203 1
1 842 . 5 1 1 A 79 79 GLU C C 79 177.000 176.837 0.163 1
1 843 . 5 1 1 A 79 79 GLU CA C 79 54.900 55.132 -0.232 1
1 844 . 5 1 1 A 79 79 GLU CB C 79 33.600 31.862 1.738 1
1 846 . 5 1 1 A 79 79 GLU N N 79 120.500 120.003 0.497 1
1 847 . 5 1 1 A 80 80 THR H H 80 8.970 8.752 0.218 1
1 848 . 5 1 1 A 80 80 THR HA H 80 4.700 4.873 -0.173 1
1 854 . 5 1 1 A 80 80 THR C C 80 177.000 176.356 0.644 1
1 855 . 5 1 1 A 80 80 THR CA C 80 61.300 60.764 0.536 1
1 856 . 5 1 1 A 80 80 THR CB C 80 70.500 71.639 -1.139 1
1 858 . 5 1 1 A 80 80 THR N N 80 113.200 114.773 -1.573 1
1 859 . 5 1 1 A 81 81 LEU H H 81 8.610 8.959 -0.349 1
1 860 . 5 1 1 A 81 81 LEU HA H 81 4.230 3.996 0.234 1
1 870 . 5 1 1 A 81 81 LEU C C 81 177.400 177.461 -0.061 1
1 871 . 5 1 1 A 81 81 LEU CA C 81 57.700 57.866 -0.166 1
1 872 . 5 1 1 A 81 81 LEU CB C 81 42.400 41.672 0.728 1
1 876 . 5 1 1 A 81 81 LEU N N 81 120.900 122.518 -1.618 1
1 877 . 5 1 1 A 82 82 ASP H H 82 8.850 8.027 0.823 1
1 878 . 5 1 1 A 82 82 ASP HA H 82 4.670 4.572 0.098 1
1 881 . 5 1 1 A 82 82 ASP C C 82 174.100 175.516 -1.416 1
1 882 . 5 1 1 A 82 82 ASP CA C 82 52.700 52.794 -0.094 1
1 883 . 5 1 1 A 82 82 ASP CB C 82 37.900 39.489 -1.589 1
1 884 . 5 1 1 A 82 82 ASP N N 82 112.300 115.327 -3.027 1
1 885 . 5 1 1 A 83 83 ASN H H 83 7.790 8.189 -0.399 1
1 886 . 5 1 1 A 83 83 ASN HA H 83 4.270 4.277 -0.007 1
1 891 . 5 1 1 A 83 83 ASN C C 83 176.100 174.364 1.736 1
1 892 . 5 1 1 A 83 83 ASN CA C 83 55.300 54.585 0.715 1
1 893 . 5 1 1 A 83 83 ASN CB C 83 36.900 36.851 0.049 1
1 894 . 5 1 1 A 83 83 ASN N N 83 113.000 112.735 0.265 1
1 896 . 5 1 1 A 84 84 VAL H H 84 7.660 7.856 -0.196 1
1 897 . 5 1 1 A 84 84 VAL HA H 84 4.270 4.065 0.205 1
1 905 . 5 1 1 A 84 84 VAL C C 84 175.800 175.058 0.742 1
1 906 . 5 1 1 A 84 84 VAL CA C 84 61.500 62.567 -1.067 1
1 907 . 5 1 1 A 84 84 VAL CB C 84 33.500 32.204 1.296 1
1 910 . 5 1 1 A 84 84 VAL N N 84 119.700 119.651 0.049 1
1 911 . 5 1 1 A 85 85 ARG H H 85 8.180 8.330 -0.150 1
1 912 . 5 1 1 A 85 85 ARG HA H 85 4.870 4.816 0.054 1
1 920 . 5 1 1 A 85 85 ARG C C 85 174.000 174.859 -0.859 1
1 921 . 5 1 1 A 85 85 ARG CA C 85 55.700 55.222 0.478 1
1 922 . 5 1 1 A 85 85 ARG CB C 85 32.600 30.747 1.853 1
1 925 . 5 1 1 A 85 85 ARG N N 85 124.800 127.922 -3.122 1
1 927 . 5 1 1 A 86 86 VAL H H 86 8.570 8.145 0.425 1
1 928 . 5 1 1 A 86 86 VAL HA H 86 4.580 4.631 -0.051 1
1 936 . 5 1 1 A 86 86 VAL C C 86 175.700 175.020 0.680 1
1 937 . 5 1 1 A 86 86 VAL CA C 86 61.700 61.937 -0.237 1
1 938 . 5 1 1 A 86 86 VAL CB C 86 30.900 31.091 -0.191 1
1 941 . 5 1 1 A 86 86 VAL N N 86 127.300 125.458 1.842 1
1 942 . 5 1 1 A 87 87 VAL H H 87 8.790 9.224 -0.434 1
1 943 . 5 1 1 A 87 87 VAL HA H 87 5.010 5.160 -0.150 1
1 951 . 5 1 1 A 87 87 VAL C C 87 175.500 175.067 0.433 1
1 952 . 5 1 1 A 87 87 VAL CA C 87 61.900 60.720 1.180 1
1 953 . 5 1 1 A 87 87 VAL CB C 87 36.300 33.991 2.309 1
1 956 . 5 1 1 A 87 87 VAL N N 87 125.700 128.911 -3.211 1
1 957 . 5 1 1 A 88 88 THR H H 88 8.350 8.591 -0.241 1
1 958 . 5 1 1 A 88 88 THR HA H 88 4.620 4.672 -0.052 1
1 964 . 5 1 1 A 88 88 THR C C 88 173.300 171.508 1.792 1
1 965 . 5 1 1 A 88 88 THR CA C 88 61.700 59.824 1.876 1
1 966 . 5 1 1 A 88 88 THR CB C 88 70.400 70.641 -0.241 1
1 968 . 5 1 1 A 88 88 THR N N 88 117.500 118.837 -1.337 1
1 969 . 5 1 1 A 89 89 ASP H H 89 7.700 8.549 -0.849 1
1 970 . 5 1 1 A 89 89 ASP HA H 89 4.480 4.690 -0.210 1
1 973 . 5 1 1 A 89 89 ASP C C 89 175.900 177.366 -1.466 1
1 974 . 5 1 1 A 89 89 ASP CA C 89 55.900 53.680 2.220 1
1 975 . 5 1 1 A 89 89 ASP CB C 89 43.900 41.255 2.645 1
1 976 . 5 1 1 A 89 89 ASP N N 89 120.800 124.758 -3.958 1
1 977 . 5 1 1 A 90 90 TYR H H 90 8.240 8.902 -0.662 1
1 978 . 5 1 1 A 90 90 TYR HA H 90 3.920 4.089 -0.169 1
1 983 . 5 1 1 A 90 90 TYR C C 90 176.400 177.685 -1.285 1
1 984 . 5 1 1 A 90 90 TYR CA C 90 62.300 60.775 1.525 1
1 985 . 5 1 1 A 90 90 TYR CB C 90 39.500 39.270 0.230 1
1 988 . 5 1 1 A 90 90 TYR N N 90 126.100 128.006 -1.906 1
1 989 . 5 1 1 A 91 91 SER H H 91 9.160 7.943 1.217 1
1 990 . 5 1 1 A 91 91 SER HA H 91 4.000 4.009 -0.009 1
1 993 . 5 1 1 A 91 91 SER C C 91 178.000 175.886 2.114 1
1 994 . 5 1 1 A 91 91 SER CA C 91 62.600 61.817 0.783 1
1 995 . 5 1 1 A 91 91 SER CB C 91 62.200 62.758 -0.558 1
1 996 . 5 1 1 A 91 91 SER N N 91 116.600 116.177 0.423 1
1 997 . 5 1 1 A 92 92 GLU H H 92 8.590 8.231 0.359 1
1 998 . 5 1 1 A 92 92 GLU HA H 92 4.050 4.064 -0.014 1
1 1003 . 5 1 1 A 92 92 GLU C C 92 179.400 178.781 0.619 1
1 1004 . 5 1 1 A 92 92 GLU CA C 92 58.900 59.041 -0.141 1
1 1005 . 5 1 1 A 92 92 GLU CB C 92 30.600 29.203 1.397 1
1 1007 . 5 1 1 A 92 92 GLU N N 92 120.200 121.850 -1.650 1
1 1008 . 5 1 1 A 93 93 PHE H H 93 7.870 8.267 -0.397 1
1 1009 . 5 1 1 A 93 93 PHE HA H 93 4.050 4.139 -0.089 1
1 1015 . 5 1 1 A 93 93 PHE C C 93 176.500 177.651 -1.151 1
1 1016 . 5 1 1 A 93 93 PHE CA C 93 62.200 61.368 0.832 1
1 1017 . 5 1 1 A 93 93 PHE CB C 93 39.700 39.193 0.507 1
1 1021 . 5 1 1 A 93 93 PHE N N 93 120.200 120.536 -0.336 1
1 1022 . 5 1 1 A 94 94 GLN H H 94 8.190 8.318 -0.128 1
1 1023 . 5 1 1 A 94 94 GLN HA H 94 3.390 3.532 -0.142 1
1 1030 . 5 1 1 A 94 94 GLN C C 94 178.600 178.344 0.256 1
1 1031 . 5 1 1 A 94 94 GLN CA C 94 58.800 59.155 -0.355 1
1 1032 . 5 1 1 A 94 94 GLN CB C 94 28.400 28.414 -0.014 1
1 1034 . 5 1 1 A 94 94 GLN N N 94 116.800 118.414 -1.614 1
1 1036 . 5 1 1 A 95 95 LYS H H 95 7.060 7.344 -0.284 1
1 1037 . 5 1 1 A 95 95 LYS HA H 95 3.780 4.099 -0.319 1
1 1046 . 5 1 1 A 95 95 LYS C C 95 179.300 178.652 0.648 1
1 1047 . 5 1 1 A 95 95 LYS CA C 95 59.900 58.935 0.965 1
1 1048 . 5 1 1 A 95 95 LYS CB C 95 32.700 32.827 -0.127 1
1 1052 . 5 1 1 A 95 95 LYS N N 95 117.500 120.880 -3.380 1
1 1053 . 5 1 1 A 96 96 ILE H H 96 7.240 7.798 -0.558 1
1 1054 . 5 1 1 A 96 96 ILE HA H 96 3.420 3.466 -0.046 1
1 1064 . 5 1 1 A 96 96 ILE C C 96 177.800 178.068 -0.268 1
1 1065 . 5 1 1 A 96 96 ILE CA C 96 64.300 65.520 -1.220 1
1 1066 . 5 1 1 A 96 96 ILE CB C 96 37.400 37.154 0.246 1
1 1070 . 5 1 1 A 96 96 ILE N N 96 120.700 120.343 0.357 1
1 1071 . 5 1 1 A 97 97 LEU H H 97 7.690 7.848 -0.158 1
1 1072 . 5 1 1 A 97 97 LEU HA H 97 3.580 3.653 -0.073 1
1 1082 . 5 1 1 A 97 97 LEU C C 97 179.900 179.258 0.642 1
1 1083 . 5 1 1 A 97 97 LEU CA C 97 58.100 57.875 0.225 1
1 1084 . 5 1 1 A 97 97 LEU CB C 97 41.500 41.171 0.329 1
1 1088 . 5 1 1 A 97 97 LEU N N 97 120.000 120.035 -0.035 1
1 1089 . 5 1 1 A 98 98 LYS H H 98 7.510 7.938 -0.428 1
1 1090 . 5 1 1 A 98 98 LYS HA H 98 3.950 3.911 0.039 1
1 1099 . 5 1 1 A 98 98 LYS C C 98 178.700 179.138 -0.438 1
1 1100 . 5 1 1 A 98 98 LYS CA C 98 58.700 59.950 -1.250 1
1 1101 . 5 1 1 A 98 98 LYS CB C 98 32.500 32.088 0.412 1
1 1105 . 5 1 1 A 98 98 LYS N N 98 117.300 118.047 -0.747 1
1 1106 . 5 1 1 A 99 99 LYS H H 99 7.470 8.401 -0.931 1
1 1107 . 5 1 1 A 99 99 LYS HA H 99 4.080 3.917 0.163 1
1 1116 . 5 1 1 A 99 99 LYS C C 99 178.100 178.858 -0.758 1
1 1117 . 5 1 1 A 99 99 LYS CA C 99 58.400 59.684 -1.284 1
1 1118 . 5 1 1 A 99 99 LYS CB C 99 33.000 32.500 0.500 1
1 1122 . 5 1 1 A 99 99 LYS N N 99 119.000 120.885 -1.885 1
1 1123 . 5 1 1 A 100 100 ARG H H 100 8.020 7.849 0.171 1
1 1124 . 5 1 1 A 100 100 ARG HA H 100 4.210 4.318 -0.108 1
1 1131 . 5 1 1 A 100 100 ARG C C 100 177.500 176.471 1.029 1
1 1132 . 5 1 1 A 100 100 ARG CA C 100 56.700 57.801 -1.101 1
1 1133 . 5 1 1 A 100 100 ARG CB C 100 30.500 30.952 -0.452 1
1 1136 . 5 1 1 A 100 100 ARG N N 100 117.300 119.069 -1.769 1
1 1137 . 5 1 1 A 101 101 GLY H H 101 7.910 7.717 0.193 1
1 1138 . 5 1 1 A 101 101 GLY HA2 H 101 3.980 3.966 0.014 1
1 1139 . 5 1 1 A 101 101 GLY HA3 H 101 4.020 3.979 0.041 1
1 1140 . 5 1 1 A 101 101 GLY C C 101 174.400 175.165 -0.765 1
1 1141 . 5 1 1 A 101 101 GLY CA C 101 46.000 46.434 -0.434 1
1 1142 . 5 1 1 A 101 101 GLY N N 101 108.000 107.654 0.346 1
1 1143 . 5 1 1 A 102 102 THR H H 102 7.880 7.880 0.000 1
1 1144 . 5 1 1 A 102 102 THR HA H 102 4.360 4.175 0.185 1
1 1149 . 5 1 1 A 102 102 THR C C 102 174.400 174.765 -0.365 1
1 1150 . 5 1 1 A 102 102 THR CA C 102 62.100 65.926 -3.826 1
1 1151 . 5 1 1 A 102 102 THR CB C 102 70.500 69.338 1.162 1
1 1153 . 5 1 1 A 102 102 THR N N 102 113.900 111.544 2.356 1
1 1154 . 5 1 1 A 103 103 LYS H H 103 8.440 7.656 0.784 1
1 1155 . 5 1 1 A 103 103 LYS C C 103 176.400 176.084 0.316 1
1 1156 . 5 1 1 A 103 103 LYS CA C 103 56.600 54.217 2.383 1
1 1157 . 5 1 1 A 103 103 LYS CB C 103 33.300 34.896 -1.596 1
1 1158 . 5 1 1 A 103 103 LYS N N 103 124.000 117.858 6.142 1
1 1159 . 5 1 1 A 104 104 LEU H H 104 8.180 8.806 -0.626 1
1 1160 . 5 1 1 A 104 104 LEU HA H 104 4.270 4.477 -0.207 1
1 1170 . 5 1 1 A 104 104 LEU C C 104 177.100 178.277 -1.177 1
1 1171 . 5 1 1 A 104 104 LEU CA C 104 55.500 55.157 0.343 1
1 1172 . 5 1 1 A 104 104 LEU CB C 104 42.500 42.051 0.449 1
1 1176 . 5 1 1 A 104 104 LEU N N 104 123.500 124.024 -0.524 1
1 1177 . 5 1 1 A 105 105 GLU H H 105 8.270 8.604 -0.334 1
1 1178 . 5 1 1 A 105 105 GLU CA C 105 56.700 58.829 -2.129 1
1 1179 . 5 1 1 A 105 105 GLU CB C 105 30.800 30.530 0.270 1
1 13 . 6 1 1 A 2 2 ASN HA H 2 4.980 5.171 -0.191 1
1 18 . 6 1 1 A 2 2 ASN C C 2 176.300 176.698 -0.398 1
1 19 . 6 1 1 A 2 2 ASN CA C 2 52.500 51.735 0.765 1
1 20 . 6 1 1 A 2 2 ASN CB C 2 40.900 39.870 1.030 1
1 22 . 6 1 1 A 3 3 SER H H 3 9.940 9.451 0.489 1
1 23 . 6 1 1 A 3 3 SER HA H 3 3.720 4.137 -0.417 1
1 26 . 6 1 1 A 3 3 SER C C 3 175.900 176.763 -0.863 1
1 27 . 6 1 1 A 3 3 SER CA C 3 63.300 61.397 1.903 1
1 28 . 6 1 1 A 3 3 SER CB C 3 61.700 62.634 -0.934 1
1 29 . 6 1 1 A 3 3 SER N N 3 118.200 118.322 -0.122 1
1 30 . 6 1 1 A 4 4 GLU H H 4 8.450 8.141 0.309 1
1 31 . 6 1 1 A 4 4 GLU HA H 4 4.010 4.040 -0.030 1
1 36 . 6 1 1 A 4 4 GLU C C 4 178.800 179.336 -0.536 1
1 37 . 6 1 1 A 4 4 GLU CA C 4 60.300 59.221 1.079 1
1 38 . 6 1 1 A 4 4 GLU CB C 4 29.100 29.630 -0.530 1
1 40 . 6 1 1 A 4 4 GLU N N 4 123.600 122.542 1.058 1
1 41 . 6 1 1 A 5 5 VAL H H 5 7.590 7.666 -0.076 1
1 42 . 6 1 1 A 5 5 VAL HA H 5 3.850 3.682 0.168 1
1 50 . 6 1 1 A 5 5 VAL C C 5 179.100 178.512 0.588 1
1 51 . 6 1 1 A 5 5 VAL CA C 5 65.800 66.446 -0.646 1
1 52 . 6 1 1 A 5 5 VAL CB C 5 32.300 31.557 0.743 1
1 55 . 6 1 1 A 5 5 VAL N N 5 119.300 119.150 0.150 1
1 56 . 6 1 1 A 6 6 ILE H H 6 7.240 8.018 -0.778 1
1 57 . 6 1 1 A 6 6 ILE HA H 6 3.580 3.669 -0.089 1
1 67 . 6 1 1 A 6 6 ILE C C 6 177.000 178.077 -1.077 1
1 68 . 6 1 1 A 6 6 ILE CA C 6 65.300 65.839 -0.539 1
1 69 . 6 1 1 A 6 6 ILE CB C 6 37.900 37.829 0.071 1
1 73 . 6 1 1 A 6 6 ILE N N 6 120.300 120.896 -0.596 1
1 74 . 6 1 1 A 7 7 LYS H H 7 8.050 8.288 -0.238 1
1 75 . 6 1 1 A 7 7 LYS HA H 7 3.570 3.868 -0.298 1
1 84 . 6 1 1 A 7 7 LYS C C 7 178.700 180.145 -1.445 1
1 85 . 6 1 1 A 7 7 LYS CA C 7 61.300 60.592 0.708 1
1 86 . 6 1 1 A 7 7 LYS CB C 7 32.200 32.316 -0.116 1
1 90 . 6 1 1 A 7 7 LYS N N 7 119.200 118.726 0.474 1
1 91 . 6 1 1 A 8 8 GLU H H 8 8.100 8.115 -0.015 1
1 92 . 6 1 1 A 8 8 GLU HA H 8 4.000 4.133 -0.133 1
1 97 . 6 1 1 A 8 8 GLU C C 8 178.500 179.112 -0.612 1
1 98 . 6 1 1 A 8 8 GLU CA C 8 59.700 59.572 0.128 1
1 99 . 6 1 1 A 8 8 GLU CB C 8 29.600 29.751 -0.151 1
1 101 . 6 1 1 A 8 8 GLU N N 8 119.400 120.301 -0.901 1
1 102 . 6 1 1 A 9 9 PHE H H 9 7.720 8.395 -0.675 1
1 103 . 6 1 1 A 9 9 PHE HA H 9 4.160 4.291 -0.131 1
1 109 . 6 1 1 A 9 9 PHE C C 9 176.900 177.406 -0.506 1
1 110 . 6 1 1 A 9 9 PHE CA C 9 61.300 61.399 -0.099 1
1 111 . 6 1 1 A 9 9 PHE CB C 9 39.400 39.191 0.209 1
1 115 . 6 1 1 A 9 9 PHE N N 9 121.300 121.648 -0.348 1
1 116 . 6 1 1 A 10 10 LEU H H 10 8.060 9.037 -0.977 1
1 117 . 6 1 1 A 10 10 LEU HA H 10 3.660 3.920 -0.260 1
1 127 . 6 1 1 A 10 10 LEU C C 10 179.000 178.876 0.124 1
1 128 . 6 1 1 A 10 10 LEU CA C 10 58.000 58.061 -0.061 1
1 129 . 6 1 1 A 10 10 LEU CB C 10 41.400 41.507 -0.107 1
1 133 . 6 1 1 A 10 10 LEU N N 10 118.000 120.075 -2.075 1
1 134 . 6 1 1 A 11 11 GLU H H 11 7.990 8.488 -0.498 1
1 135 . 6 1 1 A 11 11 GLU HA H 11 4.110 4.293 -0.183 1
1 140 . 6 1 1 A 11 11 GLU C C 11 174.200 178.229 -4.029 1
1 141 . 6 1 1 A 11 11 GLU CA C 11 59.200 58.581 0.619 1
1 142 . 6 1 1 A 11 11 GLU CB C 11 29.300 29.177 0.123 1
1 144 . 6 1 1 A 11 11 GLU N N 11 118.300 117.276 1.024 1
1 145 . 6 1 1 A 12 12 ASP H H 12 8.080 7.728 0.352 1
1 146 . 6 1 1 A 12 12 ASP HA H 12 4.340 4.362 -0.022 1
1 149 . 6 1 1 A 12 12 ASP C C 12 178.900 178.377 0.523 1
1 150 . 6 1 1 A 12 12 ASP CA C 12 57.600 56.792 0.808 1
1 151 . 6 1 1 A 12 12 ASP CB C 12 41.000 41.120 -0.120 1
1 152 . 6 1 1 A 12 12 ASP N N 12 121.800 119.945 1.855 1
1 153 . 6 1 1 A 13 13 ILE H H 13 7.610 7.462 0.148 1
1 154 . 6 1 1 A 13 13 ILE HA H 13 4.240 4.008 0.232 1
1 164 . 6 1 1 A 13 13 ILE C C 13 176.800 176.496 0.304 1
1 165 . 6 1 1 A 13 13 ILE CA C 13 62.100 61.215 0.885 1
1 166 . 6 1 1 A 13 13 ILE CB C 13 38.300 37.996 0.304 1
1 170 . 6 1 1 A 13 13 ILE N N 13 110.800 112.043 -1.243 1
1 171 . 6 1 1 A 14 14 GLY H H 14 7.640 7.573 0.067 1
1 172 . 6 1 1 A 14 14 GLY HA2 H 14 3.810 3.904 -0.094 1
1 173 . 6 1 1 A 14 14 GLY HA3 H 14 3.880 3.908 -0.028 1
1 174 . 6 1 1 A 14 14 GLY C C 14 175.200 174.418 0.782 1
1 175 . 6 1 1 A 14 14 GLY CA C 14 46.900 45.691 1.209 1
1 176 . 6 1 1 A 14 14 GLY N N 14 111.800 111.618 0.182 1
1 177 . 6 1 1 A 15 15 GLU H H 15 7.870 8.495 -0.625 1
1 178 . 6 1 1 A 15 15 GLU HA H 15 4.680 4.550 0.130 1
1 183 . 6 1 1 A 15 15 GLU C C 15 175.100 174.723 0.377 1
1 184 . 6 1 1 A 15 15 GLU CA C 15 54.800 55.554 -0.754 1
1 185 . 6 1 1 A 15 15 GLU CB C 15 32.200 31.088 1.112 1
1 187 . 6 1 1 A 15 15 GLU N N 15 119.200 121.466 -2.266 1
1 188 . 6 1 1 A 16 16 ASP H H 16 8.220 8.778 -0.558 1
1 189 . 6 1 1 A 16 16 ASP HA H 16 4.680 4.882 -0.202 1
1 192 . 6 1 1 A 16 16 ASP C C 16 174.600 174.729 -0.129 1
1 193 . 6 1 1 A 16 16 ASP CA C 16 53.600 52.443 1.157 1
1 194 . 6 1 1 A 16 16 ASP CB C 16 42.900 41.570 1.330 1
1 195 . 6 1 1 A 16 16 ASP N N 16 120.600 127.404 -6.804 1
1 196 . 6 1 1 A 17 17 TYR H H 17 7.540 8.467 -0.927 1
1 197 . 6 1 1 A 17 17 TYR HA H 17 4.910 5.671 -0.761 1
1 202 . 6 1 1 A 17 17 TYR C C 17 173.600 174.973 -1.373 1
1 203 . 6 1 1 A 17 17 TYR CA C 17 56.200 55.206 0.994 1
1 204 . 6 1 1 A 17 17 TYR CB C 17 41.100 41.748 -0.648 1
1 207 . 6 1 1 A 17 17 TYR N N 17 112.700 124.597 -11.897 1
1 208 . 6 1 1 A 18 18 ILE H H 18 7.950 9.137 -1.187 1
1 209 . 6 1 1 A 18 18 ILE HA H 18 4.330 4.673 -0.343 1
1 219 . 6 1 1 A 18 18 ILE C C 18 174.700 174.456 0.244 1
1 220 . 6 1 1 A 18 18 ILE CA C 18 60.300 60.676 -0.376 1
1 221 . 6 1 1 A 18 18 ILE CB C 18 41.000 37.780 3.220 1
1 225 . 6 1 1 A 18 18 ILE N N 18 120.400 121.892 -1.492 1
1 226 . 6 1 1 A 19 19 GLU H H 19 8.760 9.217 -0.457 1
1 227 . 6 1 1 A 19 19 GLU HA H 19 5.200 5.572 -0.372 1
1 232 . 6 1 1 A 19 19 GLU C C 19 175.200 175.822 -0.622 1
1 233 . 6 1 1 A 19 19 GLU CA C 19 55.500 55.037 0.463 1
1 234 . 6 1 1 A 19 19 GLU CB C 19 32.400 31.971 0.429 1
1 236 . 6 1 1 A 19 19 GLU N N 19 129.000 128.596 0.404 1
1 237 . 6 1 1 A 20 20 LEU H H 20 8.730 9.376 -0.646 1
1 238 . 6 1 1 A 20 20 LEU HA H 20 4.620 4.779 -0.159 1
1 248 . 6 1 1 A 20 20 LEU C C 20 176.200 175.928 0.272 1
1 249 . 6 1 1 A 20 20 LEU CA C 20 54.100 53.756 0.344 1
1 250 . 6 1 1 A 20 20 LEU CB C 20 44.400 42.612 1.788 1
1 254 . 6 1 1 A 20 20 LEU N N 20 128.400 128.256 0.144 1
1 255 . 6 1 1 A 21 21 GLU H H 21 8.700 8.514 0.186 1
1 256 . 6 1 1 A 21 21 GLU HA H 21 3.870 4.265 -0.395 1
1 261 . 6 1 1 A 21 21 GLU C C 21 176.100 176.765 -0.665 1
1 262 . 6 1 1 A 21 21 GLU CA C 21 58.800 56.730 2.070 1
1 263 . 6 1 1 A 21 21 GLU CB C 21 28.200 29.918 -1.718 1
1 265 . 6 1 1 A 21 21 GLU N N 21 122.600 120.954 1.646 1
1 266 . 6 1 1 A 22 22 ASN H H 22 8.640 8.638 0.002 1
1 267 . 6 1 1 A 22 22 ASN HA H 22 4.540 4.313 0.227 1
1 272 . 6 1 1 A 22 22 ASN C C 22 173.800 173.762 0.038 1
1 273 . 6 1 1 A 22 22 ASN CA C 22 54.600 54.424 0.176 1
1 274 . 6 1 1 A 22 22 ASN CB C 22 38.400 36.978 1.422 1
1 275 . 6 1 1 A 22 22 ASN N N 22 118.000 119.802 -1.802 1
1 277 . 6 1 1 A 23 23 GLU H H 23 7.740 7.388 0.352 1
1 278 . 6 1 1 A 23 23 GLU HA H 23 5.430 4.944 0.486 1
1 283 . 6 1 1 A 23 23 GLU C C 23 175.400 175.237 0.163 1
1 284 . 6 1 1 A 23 23 GLU CA C 23 54.900 55.124 -0.224 1
1 285 . 6 1 1 A 23 23 GLU CB C 23 34.500 31.864 2.636 1
1 287 . 6 1 1 A 23 23 GLU N N 23 116.400 116.866 -0.466 1
1 288 . 6 1 1 A 24 24 ILE H H 24 9.050 8.772 0.278 1
1 289 . 6 1 1 A 24 24 ILE HA H 24 4.810 4.654 0.156 1
1 299 . 6 1 1 A 24 24 ILE C C 24 174.600 174.948 -0.348 1
1 300 . 6 1 1 A 24 24 ILE CA C 24 60.700 60.306 0.394 1
1 301 . 6 1 1 A 24 24 ILE CB C 24 41.300 38.143 3.157 1
1 305 . 6 1 1 A 24 24 ILE N N 24 122.800 125.980 -3.180 1
1 306 . 6 1 1 A 25 25 HIS H H 25 9.490 9.633 -0.143 1
1 307 . 6 1 1 A 25 25 HIS HA H 25 5.090 5.422 -0.332 1
1 312 . 6 1 1 A 25 25 HIS C C 25 176.100 174.645 1.455 1
1 313 . 6 1 1 A 25 25 HIS CA C 25 56.100 55.425 0.675 1
1 314 . 6 1 1 A 25 25 HIS CB C 25 33.100 30.731 2.369 1
1 317 . 6 1 1 A 25 25 HIS N N 25 127.300 126.636 0.664 1
1 318 . 6 1 1 A 26 26 LEU H H 26 8.820 8.825 -0.005 1
1 319 . 6 1 1 A 26 26 LEU HA H 26 5.160 4.966 0.194 1
1 329 . 6 1 1 A 26 26 LEU C C 26 178.000 176.030 1.970 1
1 330 . 6 1 1 A 26 26 LEU CA C 26 52.900 53.553 -0.653 1
1 331 . 6 1 1 A 26 26 LEU CB C 26 48.100 43.048 5.052 1
1 335 . 6 1 1 A 26 26 LEU N N 26 121.600 125.478 -3.878 1
1 336 . 6 1 1 A 27 27 LYS H H 27 8.990 8.819 0.171 1
1 337 . 6 1 1 A 27 27 LYS HA H 27 4.630 4.825 -0.195 1
1 345 . 6 1 1 A 27 27 LYS CA C 27 55.700 53.488 2.212 1
1 346 . 6 1 1 A 27 27 LYS CB C 27 31.900 32.726 -0.826 1
1 350 . 6 1 1 A 27 27 LYS N N 27 125.900 120.102 5.798 1
1 351 . 6 1 1 A 28 28 PRO HA H 28 4.500 4.442 0.058 1
1 358 . 6 1 1 A 28 28 PRO C C 28 177.900 178.165 -0.265 1
1 359 . 6 1 1 A 28 28 PRO CA C 28 67.400 66.043 1.357 1
1 360 . 6 1 1 A 28 28 PRO CB C 28 32.100 31.802 0.298 1
1 363 . 6 1 1 A 29 29 GLU H H 29 9.880 8.316 1.564 1
1 364 . 6 1 1 A 29 29 GLU HA H 29 4.140 4.323 -0.183 1
1 369 . 6 1 1 A 29 29 GLU C C 29 178.800 179.313 -0.513 1
1 370 . 6 1 1 A 29 29 GLU CA C 29 60.600 59.939 0.661 1
1 371 . 6 1 1 A 29 29 GLU CB C 29 29.200 29.443 -0.243 1
1 373 . 6 1 1 A 29 29 GLU N N 29 117.100 118.337 -1.237 1
1 374 . 6 1 1 A 30 30 VAL H H 30 7.050 7.675 -0.625 1
1 375 . 6 1 1 A 30 30 VAL HA H 30 3.850 3.778 0.072 1
1 383 . 6 1 1 A 30 30 VAL C C 30 177.700 178.380 -0.680 1
1 384 . 6 1 1 A 30 30 VAL CA C 30 65.600 65.949 -0.349 1
1 385 . 6 1 1 A 30 30 VAL CB C 30 32.100 32.086 0.014 1
1 388 . 6 1 1 A 30 30 VAL N N 30 120.900 120.034 0.866 1
1 389 . 6 1 1 A 31 31 PHE H H 31 8.980 8.778 0.202 1
1 390 . 6 1 1 A 31 31 PHE HA H 31 3.870 4.317 -0.447 1
1 394 . 6 1 1 A 31 31 PHE C C 31 176.700 177.404 -0.704 1
1 395 . 6 1 1 A 31 31 PHE CA C 31 62.200 62.170 0.030 1
1 396 . 6 1 1 A 31 31 PHE CB C 31 39.300 39.238 0.062 1
1 398 . 6 1 1 A 31 31 PHE N N 31 121.100 120.590 0.510 1
1 399 . 6 1 1 A 32 32 TYR H H 32 8.640 8.349 0.291 1
1 400 . 6 1 1 A 32 32 TYR HA H 32 3.880 4.660 -0.780 1
1 405 . 6 1 1 A 32 32 TYR C C 32 176.000 178.297 -2.297 1
1 406 . 6 1 1 A 32 32 TYR CA C 32 63.300 62.131 1.169 1
1 407 . 6 1 1 A 32 32 TYR CB C 32 39.100 38.827 0.273 1
1 410 . 6 1 1 A 32 32 TYR N N 32 117.400 120.746 -3.346 1
1 411 . 6 1 1 A 33 33 GLU H H 33 7.400 7.701 -0.301 1
1 412 . 6 1 1 A 33 33 GLU HA H 33 4.050 4.149 -0.099 1
1 417 . 6 1 1 A 33 33 GLU C C 33 180.200 179.249 0.951 1
1 418 . 6 1 1 A 33 33 GLU CA C 33 59.500 58.942 0.558 1
1 419 . 6 1 1 A 33 33 GLU CB C 33 29.300 30.000 -0.700 1
1 421 . 6 1 1 A 33 33 GLU N N 33 116.100 119.296 -3.196 1
1 422 . 6 1 1 A 34 34 VAL H H 34 8.530 7.903 0.627 1
1 423 . 6 1 1 A 34 34 VAL HA H 34 3.350 3.611 -0.261 1
1 431 . 6 1 1 A 34 34 VAL C C 34 175.800 178.064 -2.264 1
1 432 . 6 1 1 A 34 34 VAL CA C 34 66.400 66.157 0.243 1
1 433 . 6 1 1 A 34 34 VAL CB C 34 32.200 31.623 0.577 1
1 436 . 6 1 1 A 34 34 VAL N N 34 120.600 120.224 0.376 1
1 437 . 6 1 1 A 35 35 TRP H H 35 9.100 8.256 0.844 1
1 438 . 6 1 1 A 35 35 TRP HA H 35 3.340 3.686 -0.346 1
1 447 . 6 1 1 A 35 35 TRP C C 35 178.000 178.401 -0.401 1
1 448 . 6 1 1 A 35 35 TRP CA C 35 61.800 60.127 1.673 1
1 449 . 6 1 1 A 35 35 TRP CB C 35 27.900 29.846 -1.946 1
1 455 . 6 1 1 A 35 35 TRP N N 35 121.700 121.742 -0.042 1
1 457 . 6 1 1 A 36 36 LYS H H 36 7.970 8.079 -0.109 1
1 458 . 6 1 1 A 36 36 LYS HA H 36 3.330 3.526 -0.196 1
1 467 . 6 1 1 A 36 36 LYS C C 36 180.000 178.504 1.496 1
1 468 . 6 1 1 A 36 36 LYS CA C 36 59.000 58.891 0.109 1
1 469 . 6 1 1 A 36 36 LYS CB C 36 31.800 32.487 -0.687 1
1 473 . 6 1 1 A 36 36 LYS N N 36 116.300 117.958 -1.658 1
1 474 . 6 1 1 A 37 37 TYR H H 37 7.750 7.593 0.157 1
1 475 . 6 1 1 A 37 37 TYR HA H 37 3.940 3.977 -0.037 1
1 480 . 6 1 1 A 37 37 TYR C C 37 177.600 177.852 -0.252 1
1 481 . 6 1 1 A 37 37 TYR CA C 37 61.200 60.424 0.776 1
1 482 . 6 1 1 A 37 37 TYR CB C 37 38.800 38.381 0.419 1
1 485 . 6 1 1 A 37 37 TYR N N 37 122.700 121.481 1.219 1
1 486 . 6 1 1 A 38 38 VAL H H 38 7.660 7.470 0.190 1
1 487 . 6 1 1 A 38 38 VAL HA H 38 3.870 3.692 0.178 1
1 495 . 6 1 1 A 38 38 VAL C C 38 175.600 176.256 -0.656 1
1 496 . 6 1 1 A 38 38 VAL CA C 38 61.100 62.422 -1.322 1
1 497 . 6 1 1 A 38 38 VAL CB C 38 30.700 31.458 -0.758 1
1 500 . 6 1 1 A 38 38 VAL N N 38 108.200 113.138 -4.938 1
1 501 . 6 1 1 A 39 39 GLY H H 39 7.090 7.297 -0.207 1
1 502 . 6 1 1 A 39 39 GLY HA2 H 39 3.320 3.858 -0.538 1
1 503 . 6 1 1 A 39 39 GLY HA3 H 39 3.730 3.867 -0.137 1
1 504 . 6 1 1 A 39 39 GLY C C 39 173.600 174.577 -0.977 1
1 505 . 6 1 1 A 39 39 GLY CA C 39 46.100 44.925 1.175 1
1 506 . 6 1 1 A 39 39 GLY N N 39 107.600 110.533 -2.933 1
1 507 . 6 1 1 A 40 40 GLU H H 40 7.730 7.703 0.027 1
1 508 . 6 1 1 A 40 40 GLU HA H 40 1.090 3.296 -2.206 1
1 513 . 6 1 1 A 40 40 GLU CA C 40 55.700 56.815 -1.115 1
1 514 . 6 1 1 A 40 40 GLU CB C 40 27.200 27.699 -0.499 1
1 516 . 6 1 1 A 40 40 GLU N N 40 114.400 119.009 -4.609 1
1 517 . 6 1 1 A 41 41 PRO HA H 41 4.310 4.692 -0.382 1
1 524 . 6 1 1 A 41 41 PRO CA C 41 62.300 62.179 0.121 1
1 525 . 6 1 1 A 41 41 PRO CB C 41 32.700 32.816 -0.116 1
1 528 . 6 1 1 A 42 42 GLU H H 42 8.110 8.624 -0.514 1
1 529 . 6 1 1 A 42 42 GLU C C 42 175.800 176.314 -0.514 1
1 530 . 6 1 1 A 42 42 GLU CA C 42 57.800 56.639 1.161 1
1 531 . 6 1 1 A 42 42 GLU CB C 42 30.600 30.198 0.402 1
1 533 . 6 1 1 A 42 42 GLU N N 42 119.100 120.343 -1.243 1
1 534 . 6 1 1 A 43 43 LEU H H 43 8.140 8.790 -0.650 1
1 535 . 6 1 1 A 43 43 LEU HA H 43 4.840 4.388 0.452 1
1 545 . 6 1 1 A 43 43 LEU C C 43 177.300 176.438 0.862 1
1 546 . 6 1 1 A 43 43 LEU CA C 43 53.700 55.057 -1.357 1
1 547 . 6 1 1 A 43 43 LEU CB C 43 43.900 42.361 1.539 1
1 551 . 6 1 1 A 43 43 LEU N N 43 124.700 125.466 -0.766 1
1 552 . 6 1 1 A 44 44 LYS H H 44 8.640 8.534 0.106 1
1 553 . 6 1 1 A 44 44 LYS HA H 44 4.500 4.984 -0.484 1
1 562 . 6 1 1 A 44 44 LYS C C 44 174.500 175.408 -0.908 1
1 563 . 6 1 1 A 44 44 LYS CA C 44 54.700 54.179 0.521 1
1 564 . 6 1 1 A 44 44 LYS CB C 44 36.200 35.100 1.100 1
1 568 . 6 1 1 A 44 44 LYS N N 44 123.300 122.181 1.119 1
1 569 . 6 1 1 A 45 45 THR H H 45 7.990 8.697 -0.707 1
1 570 . 6 1 1 A 45 45 THR HA H 45 5.700 5.383 0.317 1
1 575 . 6 1 1 A 45 45 THR C C 45 175.100 173.917 1.183 1
1 576 . 6 1 1 A 45 45 THR CA C 45 59.600 59.501 0.099 1
1 577 . 6 1 1 A 45 45 THR CB C 45 73.400 71.156 2.244 1
1 579 . 6 1 1 A 45 45 THR N N 45 106.900 116.331 -9.431 1
1 580 . 6 1 1 A 46 46 TYR H H 46 8.470 8.932 -0.462 1
1 581 . 6 1 1 A 46 46 TYR HA H 46 4.930 5.567 -0.637 1
1 586 . 6 1 1 A 46 46 TYR C C 46 172.400 173.069 -0.669 1
1 587 . 6 1 1 A 46 46 TYR CA C 46 57.100 55.516 1.584 1
1 588 . 6 1 1 A 46 46 TYR CB C 46 40.200 41.781 -1.581 1
1 591 . 6 1 1 A 46 46 TYR N N 46 117.100 118.729 -1.629 1
1 592 . 6 1 1 A 47 47 VAL H H 47 8.430 8.827 -0.397 1
1 593 . 6 1 1 A 47 47 VAL HA H 47 4.890 4.404 0.486 1
1 601 . 6 1 1 A 47 47 VAL C C 47 175.800 173.810 1.990 1
1 602 . 6 1 1 A 47 47 VAL CA C 47 60.800 61.433 -0.633 1
1 603 . 6 1 1 A 47 47 VAL CB C 47 34.800 33.296 1.504 1
1 606 . 6 1 1 A 47 47 VAL N N 47 119.200 120.638 -1.438 1
1 607 . 6 1 1 A 48 48 ILE H H 48 8.680 9.303 -0.623 1
1 608 . 6 1 1 A 48 48 ILE HA H 48 4.560 4.961 -0.401 1
1 618 . 6 1 1 A 48 48 ILE C C 48 174.500 173.959 0.541 1
1 619 . 6 1 1 A 48 48 ILE CA C 48 59.700 59.583 0.117 1
1 620 . 6 1 1 A 48 48 ILE CB C 48 41.500 40.859 0.641 1
1 624 . 6 1 1 A 48 48 ILE N N 48 124.400 129.494 -5.094 1
1 625 . 6 1 1 A 49 49 GLU H H 49 8.320 9.044 -0.724 1
1 626 . 6 1 1 A 49 49 GLU C C 49 175.500 174.795 0.705 1
1 627 . 6 1 1 A 49 49 GLU CA C 49 55.500 55.483 0.017 1
1 628 . 6 1 1 A 49 49 GLU CB C 49 31.800 31.134 0.666 1
1 630 . 6 1 1 A 49 49 GLU N N 49 123.400 128.707 -5.307 1
1 631 . 6 1 1 A 50 50 ASP H H 50 8.610 8.820 -0.210 1
1 632 . 6 1 1 A 50 50 ASP C C 50 175.100 174.658 0.442 1
1 633 . 6 1 1 A 50 50 ASP CA C 50 53.100 52.694 0.406 1
1 634 . 6 1 1 A 50 50 ASP CB C 50 44.000 44.639 -0.639 1
1 635 . 6 1 1 A 50 50 ASP N N 50 124.300 125.892 -1.592 1
1 636 . 6 1 1 A 51 51 GLU H H 51 8.450 8.849 -0.399 1
1 637 . 6 1 1 A 51 51 GLU C C 51 175.900 175.619 0.281 1
1 638 . 6 1 1 A 51 51 GLU CA C 51 56.000 55.331 0.669 1
1 639 . 6 1 1 A 51 51 GLU CB C 51 31.700 31.149 0.551 1
1 640 . 6 1 1 A 51 51 GLU N N 51 121.300 124.239 -2.939 1
1 641 . 6 1 1 A 52 52 ILE H H 52 8.480 8.448 0.032 1
1 642 . 6 1 1 A 52 52 ILE C C 52 175.400 175.213 0.187 1
1 643 . 6 1 1 A 52 52 ILE CA C 52 60.400 61.993 -1.593 1
1 644 . 6 1 1 A 52 52 ILE CB C 52 40.000 39.070 0.930 1
1 645 . 6 1 1 A 52 52 ILE N N 52 122.700 128.068 -5.368 1
1 646 . 6 1 1 A 53 53 VAL H H 53 8.140 8.591 -0.451 1
1 647 . 6 1 1 A 53 53 VAL C C 53 175.600 175.968 -0.368 1
1 648 . 6 1 1 A 53 53 VAL CA C 53 61.900 61.373 0.527 1
1 649 . 6 1 1 A 53 53 VAL CB C 53 33.200 33.108 0.092 1
1 650 . 6 1 1 A 53 53 VAL N N 53 124.400 123.949 0.451 1
1 651 . 6 1 1 A 54 54 GLU H H 54 8.540 8.626 -0.086 1
1 652 . 6 1 1 A 54 54 GLU CA C 54 55.600 54.685 0.915 1
1 653 . 6 1 1 A 54 54 GLU CB C 54 34.300 28.792 5.508 1
1 654 . 6 1 1 A 54 54 GLU N N 54 125.900 124.690 1.210 1
1 655 . 6 1 1 A 55 55 PRO C C 55 177.500 176.672 0.828 1
1 656 . 6 1 1 A 55 55 PRO CA C 55 63.400 63.578 -0.178 1
1 657 . 6 1 1 A 55 55 PRO CB C 55 32.300 32.060 0.240 1
1 658 . 6 1 1 A 56 56 GLY H H 56 8.420 8.511 -0.091 1
1 659 . 6 1 1 A 56 56 GLY HA2 H 56 3.830 4.113 -0.283 1
1 660 . 6 1 1 A 56 56 GLY HA3 H 56 4.000 4.128 -0.128 1
1 661 . 6 1 1 A 56 56 GLY C C 56 174.500 174.190 0.310 1
1 662 . 6 1 1 A 56 56 GLY CA C 56 45.400 45.707 -0.307 1
1 663 . 6 1 1 A 56 56 GLY N N 56 109.700 106.839 2.861 1
1 664 . 6 1 1 A 57 57 GLU H H 57 8.180 7.607 0.573 1
1 665 . 6 1 1 A 57 57 GLU C C 57 176.300 177.749 -1.449 1
1 666 . 6 1 1 A 57 57 GLU CA C 57 57.500 55.988 1.512 1
1 667 . 6 1 1 A 57 57 GLU CB C 57 30.400 31.015 -0.615 1
1 668 . 6 1 1 A 57 57 GLU N N 57 120.900 119.810 1.090 1
1 669 . 6 1 1 A 58 58 TYR H H 58 8.020 8.884 -0.864 1
1 670 . 6 1 1 A 58 58 TYR C C 58 175.100 174.848 0.252 1
1 671 . 6 1 1 A 58 58 TYR CA C 58 57.400 61.244 -3.844 1
1 672 . 6 1 1 A 58 58 TYR CB C 58 38.900 39.039 -0.139 1
1 673 . 6 1 1 A 58 58 TYR N N 58 118.800 123.298 -4.498 1
1 674 . 6 1 1 A 59 59 ASP H H 59 7.950 7.859 0.091 1
1 675 . 6 1 1 A 59 59 ASP CA C 59 52.700 51.014 1.686 1
1 676 . 6 1 1 A 59 59 ASP CB C 59 41.000 42.760 -1.760 1
1 677 . 6 1 1 A 59 59 ASP N N 59 123.500 118.145 5.355 1
1 678 . 6 1 1 A 61 61 PRO HA H 61 4.510 4.313 0.197 1
1 685 . 6 1 1 A 61 61 PRO C C 61 176.500 176.310 0.190 1
1 686 . 6 1 1 A 61 61 PRO CA C 61 63.700 64.883 -1.183 1
1 687 . 6 1 1 A 61 61 PRO CB C 61 34.200 32.157 2.043 1
1 690 . 6 1 1 A 62 62 GLU H H 62 8.490 7.926 0.564 1
1 691 . 6 1 1 A 62 62 GLU N N 62 124.600 118.834 5.766 1
1 692 . 6 1 1 A 64 64 LYS C C 64 176.300 175.697 0.603 1
1 693 . 6 1 1 A 64 64 LYS CA C 64 57.000 57.644 -0.644 1
1 694 . 6 1 1 A 64 64 LYS CB C 64 33.100 32.531 0.569 1
1 695 . 6 1 1 A 65 65 TYR H H 65 7.960 7.622 0.338 1
1 696 . 6 1 1 A 65 65 TYR C C 65 176.000 174.155 1.845 1
1 697 . 6 1 1 A 65 65 TYR CA C 65 57.800 56.360 1.440 1
1 698 . 6 1 1 A 65 65 TYR CB C 65 38.800 42.916 -4.116 1
1 699 . 6 1 1 A 65 65 TYR N N 65 119.300 118.320 0.980 1
1 700 . 6 1 1 A 66 66 THR H H 66 7.820 8.964 -1.144 1
1 701 . 6 1 1 A 66 66 THR HA H 66 4.280 4.815 -0.535 1
1 706 . 6 1 1 A 66 66 THR C C 66 174.100 172.974 1.126 1
1 707 . 6 1 1 A 66 66 THR CA C 66 62.100 59.662 2.438 1
1 708 . 6 1 1 A 66 66 THR CB C 66 70.000 71.019 -1.019 1
1 710 . 6 1 1 A 66 66 THR N N 66 113.900 116.417 -2.517 1
1 711 . 6 1 1 A 67 67 ASN H H 67 8.270 8.564 -0.294 1
1 712 . 6 1 1 A 67 67 ASN C C 67 174.100 174.498 -0.398 1
1 713 . 6 1 1 A 67 67 ASN CA C 67 53.400 52.758 0.642 1
1 714 . 6 1 1 A 67 67 ASN CB C 67 39.300 38.973 0.327 1
1 715 . 6 1 1 A 67 67 ASN N N 67 121.400 120.839 0.561 1
1 716 . 6 1 1 A 68 68 VAL H H 68 7.660 8.427 -0.767 1
1 717 . 6 1 1 A 68 68 VAL C C 68 175.500 175.431 0.069 1
1 718 . 6 1 1 A 68 68 VAL CA C 68 61.800 63.047 -1.247 1
1 719 . 6 1 1 A 68 68 VAL CB C 68 33.700 32.407 1.293 1
1 720 . 6 1 1 A 68 68 VAL N N 68 119.400 125.240 -5.840 1
1 721 . 6 1 1 A 69 69 LYS H H 69 8.690 8.683 0.007 1
1 722 . 6 1 1 A 69 69 LYS C C 69 175.200 175.322 -0.122 1
1 723 . 6 1 1 A 69 69 LYS CA C 69 55.200 55.052 0.148 1
1 724 . 6 1 1 A 69 69 LYS CB C 69 35.200 34.248 0.952 1
1 725 . 6 1 1 A 69 69 LYS N N 69 126.500 127.724 -1.224 1
1 726 . 6 1 1 A 70 70 LYS H H 70 8.230 8.827 -0.597 1
1 727 . 6 1 1 A 70 70 LYS C C 70 176.400 176.054 0.346 1
1 728 . 6 1 1 A 70 70 LYS CA C 70 55.600 55.985 -0.385 1
1 729 . 6 1 1 A 70 70 LYS CB C 70 33.800 33.179 0.621 1
1 730 . 6 1 1 A 70 70 LYS N N 70 122.700 124.681 -1.981 1
1 731 . 6 1 1 A 71 71 VAL H H 71 8.530 9.216 -0.686 1
1 732 . 6 1 1 A 71 71 VAL HA H 71 4.510 4.797 -0.287 1
1 733 . 6 1 1 A 71 71 VAL C C 71 174.700 174.609 0.091 1
1 734 . 6 1 1 A 71 71 VAL CA C 71 60.900 60.827 0.073 1
1 735 . 6 1 1 A 71 71 VAL CB C 71 34.800 33.331 1.469 1
1 738 . 6 1 1 A 71 71 VAL N N 71 121.200 120.327 0.873 1
1 739 . 6 1 1 A 72 72 LYS H H 72 8.210 8.898 -0.688 1
1 740 . 6 1 1 A 72 72 LYS HA H 72 4.800 4.565 0.235 1
1 747 . 6 1 1 A 72 72 LYS C C 72 176.200 175.325 0.875 1
1 748 . 6 1 1 A 72 72 LYS CA C 72 55.700 55.795 -0.095 1
1 749 . 6 1 1 A 72 72 LYS CB C 72 33.700 32.003 1.697 1
1 752 . 6 1 1 A 72 72 LYS N N 72 123.600 126.794 -3.194 1
1 753 . 6 1 1 A 73 73 ILE H H 73 8.890 8.651 0.239 1
1 754 . 6 1 1 A 73 73 ILE C C 73 174.400 174.411 -0.011 1
1 755 . 6 1 1 A 73 73 ILE CA C 73 60.400 60.232 0.168 1
1 756 . 6 1 1 A 73 73 ILE CB C 73 40.800 37.821 2.979 1
1 760 . 6 1 1 A 73 73 ILE N N 73 125.100 125.704 -0.604 1
1 761 . 6 1 1 A 74 74 LYS H H 74 8.420 8.847 -0.427 1
1 762 . 6 1 1 A 74 74 LYS HA H 74 4.800 5.035 -0.235 1
1 771 . 6 1 1 A 74 74 LYS C C 74 175.600 175.300 0.300 1
1 772 . 6 1 1 A 74 74 LYS CA C 74 56.200 55.181 1.019 1
1 773 . 6 1 1 A 74 74 LYS CB C 74 34.300 33.620 0.680 1
1 777 . 6 1 1 A 74 74 LYS N N 74 126.400 128.391 -1.991 1
1 778 . 6 1 1 A 75 75 LYS H H 75 9.090 8.204 0.886 1
1 779 . 6 1 1 A 75 75 LYS HA H 75 4.800 4.889 -0.089 1
1 788 . 6 1 1 A 75 75 LYS C C 75 174.900 175.003 -0.103 1
1 789 . 6 1 1 A 75 75 LYS CA C 75 53.200 54.374 -1.174 1
1 790 . 6 1 1 A 75 75 LYS CB C 75 34.200 34.580 -0.380 1
1 794 . 6 1 1 A 75 75 LYS N N 75 127.500 126.758 0.742 1
1 795 . 6 1 1 A 76 76 VAL H H 76 8.610 9.004 -0.394 1
1 796 . 6 1 1 A 76 76 VAL HA H 76 5.340 4.958 0.382 1
1 804 . 6 1 1 A 76 76 VAL C C 76 171.400 173.869 -2.469 1
1 805 . 6 1 1 A 76 76 VAL CA C 76 58.000 59.579 -1.579 1
1 806 . 6 1 1 A 76 76 VAL CB C 76 36.400 35.237 1.163 1
1 809 . 6 1 1 A 76 76 VAL N N 76 120.100 120.955 -0.855 1
1 810 . 6 1 1 A 77 77 TYR H H 77 9.110 9.025 0.085 1
1 811 . 6 1 1 A 77 77 TYR HA H 77 6.150 5.827 0.323 1
1 816 . 6 1 1 A 77 77 TYR C C 77 173.600 173.053 0.547 1
1 817 . 6 1 1 A 77 77 TYR CA C 77 56.200 55.745 0.455 1
1 818 . 6 1 1 A 77 77 TYR CB C 77 44.000 41.307 2.693 1
1 821 . 6 1 1 A 77 77 TYR N N 77 121.300 122.028 -0.728 1
1 822 . 6 1 1 A 78 78 PHE H H 78 8.190 8.609 -0.419 1
1 823 . 6 1 1 A 78 78 PHE HA H 78 5.130 5.873 -0.743 1
1 829 . 6 1 1 A 78 78 PHE C C 78 173.600 172.886 0.714 1
1 830 . 6 1 1 A 78 78 PHE CA C 78 55.900 55.416 0.484 1
1 831 . 6 1 1 A 78 78 PHE CB C 78 42.500 42.799 -0.299 1
1 835 . 6 1 1 A 78 78 PHE N N 78 112.700 117.108 -4.408 1
1 836 . 6 1 1 A 79 79 GLU H H 79 8.920 9.255 -0.335 1
1 837 . 6 1 1 A 79 79 GLU HA H 79 5.390 5.268 0.122 1
1 842 . 6 1 1 A 79 79 GLU C C 79 177.000 176.589 0.411 1
1 843 . 6 1 1 A 79 79 GLU CA C 79 54.900 55.243 -0.343 1
1 844 . 6 1 1 A 79 79 GLU CB C 79 33.600 31.317 2.283 1
1 846 . 6 1 1 A 79 79 GLU N N 79 120.500 122.658 -2.158 1
1 847 . 6 1 1 A 80 80 THR H H 80 8.970 8.868 0.102 1
1 848 . 6 1 1 A 80 80 THR HA H 80 4.700 4.802 -0.102 1
1 854 . 6 1 1 A 80 80 THR C C 80 177.000 176.219 0.781 1
1 855 . 6 1 1 A 80 80 THR CA C 80 61.300 60.862 0.438 1
1 856 . 6 1 1 A 80 80 THR CB C 80 70.500 71.406 -0.906 1
1 858 . 6 1 1 A 80 80 THR N N 80 113.200 117.409 -4.209 1
1 859 . 6 1 1 A 81 81 LEU H H 81 8.610 8.909 -0.299 1
1 860 . 6 1 1 A 81 81 LEU HA H 81 4.230 4.073 0.157 1
1 870 . 6 1 1 A 81 81 LEU C C 81 177.400 177.859 -0.459 1
1 871 . 6 1 1 A 81 81 LEU CA C 81 57.700 57.023 0.677 1
1 872 . 6 1 1 A 81 81 LEU CB C 81 42.400 41.559 0.841 1
1 876 . 6 1 1 A 81 81 LEU N N 81 120.900 122.428 -1.528 1
1 877 . 6 1 1 A 82 82 ASP H H 82 8.850 7.874 0.976 1
1 878 . 6 1 1 A 82 82 ASP HA H 82 4.670 4.725 -0.055 1
1 881 . 6 1 1 A 82 82 ASP C C 82 174.100 175.171 -1.071 1
1 882 . 6 1 1 A 82 82 ASP CA C 82 52.700 53.946 -1.246 1
1 883 . 6 1 1 A 82 82 ASP CB C 82 37.900 40.933 -3.033 1
1 884 . 6 1 1 A 82 82 ASP N N 82 112.300 117.307 -5.007 1
1 885 . 6 1 1 A 83 83 ASN H H 83 7.790 7.995 -0.205 1
1 886 . 6 1 1 A 83 83 ASN HA H 83 4.270 4.433 -0.163 1
1 891 . 6 1 1 A 83 83 ASN C C 83 176.100 174.627 1.473 1
1 892 . 6 1 1 A 83 83 ASN CA C 83 55.300 54.548 0.752 1
1 893 . 6 1 1 A 83 83 ASN CB C 83 36.900 37.038 -0.138 1
1 894 . 6 1 1 A 83 83 ASN N N 83 113.000 114.758 -1.758 1
1 896 . 6 1 1 A 84 84 VAL H H 84 7.660 7.843 -0.183 1
1 897 . 6 1 1 A 84 84 VAL HA H 84 4.270 4.374 -0.104 1
1 905 . 6 1 1 A 84 84 VAL C C 84 175.800 175.090 0.710 1
1 906 . 6 1 1 A 84 84 VAL CA C 84 61.500 62.580 -1.080 1
1 907 . 6 1 1 A 84 84 VAL CB C 84 33.500 32.017 1.483 1
1 910 . 6 1 1 A 84 84 VAL N N 84 119.700 119.681 0.019 1
1 911 . 6 1 1 A 85 85 ARG H H 85 8.180 9.090 -0.910 1
1 912 . 6 1 1 A 85 85 ARG HA H 85 4.870 4.675 0.195 1
1 920 . 6 1 1 A 85 85 ARG C C 85 174.000 174.820 -0.820 1
1 921 . 6 1 1 A 85 85 ARG CA C 85 55.700 55.205 0.495 1
1 922 . 6 1 1 A 85 85 ARG CB C 85 32.600 30.242 2.358 1
1 925 . 6 1 1 A 85 85 ARG N N 85 124.800 127.700 -2.900 1
1 927 . 6 1 1 A 86 86 VAL H H 86 8.570 8.140 0.430 1
1 928 . 6 1 1 A 86 86 VAL HA H 86 4.580 4.600 -0.020 1
1 936 . 6 1 1 A 86 86 VAL C C 86 175.700 175.197 0.503 1
1 937 . 6 1 1 A 86 86 VAL CA C 86 61.700 62.335 -0.635 1
1 938 . 6 1 1 A 86 86 VAL CB C 86 30.900 30.765 0.135 1
1 941 . 6 1 1 A 86 86 VAL N N 86 127.300 125.381 1.919 1
1 942 . 6 1 1 A 87 87 VAL H H 87 8.790 8.830 -0.040 1
1 943 . 6 1 1 A 87 87 VAL HA H 87 5.010 4.820 0.190 1
1 951 . 6 1 1 A 87 87 VAL C C 87 175.500 174.740 0.760 1
1 952 . 6 1 1 A 87 87 VAL CA C 87 61.900 60.856 1.044 1
1 953 . 6 1 1 A 87 87 VAL CB C 87 36.300 33.208 3.092 1
1 956 . 6 1 1 A 87 87 VAL N N 87 125.700 128.502 -2.802 1
1 957 . 6 1 1 A 88 88 THR H H 88 8.350 8.732 -0.382 1
1 958 . 6 1 1 A 88 88 THR HA H 88 4.620 4.614 0.006 1
1 964 . 6 1 1 A 88 88 THR C C 88 173.300 173.020 0.280 1
1 965 . 6 1 1 A 88 88 THR CA C 88 61.700 60.590 1.110 1
1 966 . 6 1 1 A 88 88 THR CB C 88 70.400 72.004 -1.604 1
1 968 . 6 1 1 A 88 88 THR N N 88 117.500 120.612 -3.112 1
1 969 . 6 1 1 A 89 89 ASP H H 89 7.700 8.537 -0.837 1
1 970 . 6 1 1 A 89 89 ASP HA H 89 4.480 4.631 -0.151 1
1 973 . 6 1 1 A 89 89 ASP C C 89 175.900 176.647 -0.747 1
1 974 . 6 1 1 A 89 89 ASP CA C 89 55.900 54.959 0.941 1
1 975 . 6 1 1 A 89 89 ASP CB C 89 43.900 40.844 3.056 1
1 976 . 6 1 1 A 89 89 ASP N N 89 120.800 123.811 -3.011 1
1 977 . 6 1 1 A 90 90 TYR H H 90 8.240 9.041 -0.801 1
1 978 . 6 1 1 A 90 90 TYR HA H 90 3.920 4.089 -0.169 1
1 983 . 6 1 1 A 90 90 TYR C C 90 176.400 177.146 -0.746 1
1 984 . 6 1 1 A 90 90 TYR CA C 90 62.300 62.435 -0.135 1
1 985 . 6 1 1 A 90 90 TYR CB C 90 39.500 38.652 0.848 1
1 988 . 6 1 1 A 90 90 TYR N N 90 126.100 126.392 -0.292 1
1 989 . 6 1 1 A 91 91 SER H H 91 9.160 8.238 0.922 1
1 990 . 6 1 1 A 91 91 SER HA H 91 4.000 4.100 -0.100 1
1 993 . 6 1 1 A 91 91 SER C C 91 178.000 176.477 1.523 1
1 994 . 6 1 1 A 91 91 SER CA C 91 62.600 61.850 0.750 1
1 995 . 6 1 1 A 91 91 SER CB C 91 62.200 62.849 -0.649 1
1 996 . 6 1 1 A 91 91 SER N N 91 116.600 116.853 -0.253 1
1 997 . 6 1 1 A 92 92 GLU H H 92 8.590 7.914 0.676 1
1 998 . 6 1 1 A 92 92 GLU HA H 92 4.050 4.206 -0.156 1
1 1003 . 6 1 1 A 92 92 GLU C C 92 179.400 178.498 0.902 1
1 1004 . 6 1 1 A 92 92 GLU CA C 92 58.900 58.346 0.554 1
1 1005 . 6 1 1 A 92 92 GLU CB C 92 30.600 29.338 1.262 1
1 1007 . 6 1 1 A 92 92 GLU N N 92 120.200 121.849 -1.649 1
1 1008 . 6 1 1 A 93 93 PHE H H 93 7.870 8.366 -0.496 1
1 1009 . 6 1 1 A 93 93 PHE HA H 93 4.050 4.107 -0.057 1
1 1015 . 6 1 1 A 93 93 PHE C C 93 176.500 177.392 -0.892 1
1 1016 . 6 1 1 A 93 93 PHE CA C 93 62.200 61.206 0.994 1
1 1017 . 6 1 1 A 93 93 PHE CB C 93 39.700 39.187 0.513 1
1 1021 . 6 1 1 A 93 93 PHE N N 93 120.200 121.988 -1.788 1
1 1022 . 6 1 1 A 94 94 GLN H H 94 8.190 8.197 -0.007 1
1 1023 . 6 1 1 A 94 94 GLN HA H 94 3.390 3.811 -0.421 1
1 1030 . 6 1 1 A 94 94 GLN C C 94 178.600 178.328 0.272 1
1 1031 . 6 1 1 A 94 94 GLN CA C 94 58.800 57.576 1.224 1
1 1032 . 6 1 1 A 94 94 GLN CB C 94 28.400 28.164 0.236 1
1 1034 . 6 1 1 A 94 94 GLN N N 94 116.800 118.706 -1.906 1
1 1036 . 6 1 1 A 95 95 LYS H H 95 7.060 7.411 -0.351 1
1 1037 . 6 1 1 A 95 95 LYS HA H 95 3.780 4.109 -0.329 1
1 1046 . 6 1 1 A 95 95 LYS C C 95 179.300 179.045 0.255 1
1 1047 . 6 1 1 A 95 95 LYS CA C 95 59.900 58.735 1.165 1
1 1048 . 6 1 1 A 95 95 LYS CB C 95 32.700 31.802 0.898 1
1 1052 . 6 1 1 A 95 95 LYS N N 95 117.500 120.261 -2.761 1
1 1053 . 6 1 1 A 96 96 ILE H H 96 7.240 7.724 -0.484 1
1 1054 . 6 1 1 A 96 96 ILE HA H 96 3.420 3.713 -0.293 1
1 1064 . 6 1 1 A 96 96 ILE C C 96 177.800 178.154 -0.354 1
1 1065 . 6 1 1 A 96 96 ILE CA C 96 64.300 64.403 -0.103 1
1 1066 . 6 1 1 A 96 96 ILE CB C 96 37.400 36.679 0.721 1
1 1070 . 6 1 1 A 96 96 ILE N N 96 120.700 121.217 -0.517 1
1 1071 . 6 1 1 A 97 97 LEU H H 97 7.690 7.664 0.026 1
1 1072 . 6 1 1 A 97 97 LEU HA H 97 3.580 3.541 0.039 1
1 1082 . 6 1 1 A 97 97 LEU C C 97 179.900 179.228 0.672 1
1 1083 . 6 1 1 A 97 97 LEU CA C 97 58.100 57.575 0.525 1
1 1084 . 6 1 1 A 97 97 LEU CB C 97 41.500 40.974 0.526 1
1 1088 . 6 1 1 A 97 97 LEU N N 97 120.000 120.555 -0.555 1
1 1089 . 6 1 1 A 98 98 LYS H H 98 7.510 8.179 -0.669 1
1 1090 . 6 1 1 A 98 98 LYS HA H 98 3.950 3.900 0.050 1
1 1099 . 6 1 1 A 98 98 LYS C C 98 178.700 178.239 0.461 1
1 1100 . 6 1 1 A 98 98 LYS CA C 98 58.700 58.445 0.255 1
1 1101 . 6 1 1 A 98 98 LYS CB C 98 32.500 32.161 0.339 1
1 1105 . 6 1 1 A 98 98 LYS N N 98 117.300 119.743 -2.443 1
1 1106 . 6 1 1 A 99 99 LYS H H 99 7.470 7.959 -0.489 1
1 1107 . 6 1 1 A 99 99 LYS HA H 99 4.080 3.951 0.129 1
1 1116 . 6 1 1 A 99 99 LYS C C 99 178.100 178.339 -0.239 1
1 1117 . 6 1 1 A 99 99 LYS CA C 99 58.400 59.538 -1.138 1
1 1118 . 6 1 1 A 99 99 LYS CB C 99 33.000 32.433 0.567 1
1 1122 . 6 1 1 A 99 99 LYS N N 99 119.000 118.647 0.353 1
1 1123 . 6 1 1 A 100 100 ARG H H 100 8.020 8.064 -0.044 1
1 1124 . 6 1 1 A 100 100 ARG HA H 100 4.210 4.220 -0.010 1
1 1131 . 6 1 1 A 100 100 ARG C C 100 177.500 176.253 1.247 1
1 1132 . 6 1 1 A 100 100 ARG CA C 100 56.700 57.890 -1.190 1
1 1133 . 6 1 1 A 100 100 ARG CB C 100 30.500 31.096 -0.596 1
1 1136 . 6 1 1 A 100 100 ARG N N 100 117.300 118.551 -1.251 1
1 1137 . 6 1 1 A 101 101 GLY H H 101 7.910 8.302 -0.392 1
1 1138 . 6 1 1 A 101 101 GLY HA2 H 101 3.980 4.000 -0.020 1
1 1139 . 6 1 1 A 101 101 GLY HA3 H 101 4.020 4.018 0.002 1
1 1140 . 6 1 1 A 101 101 GLY C C 101 174.400 174.461 -0.061 1
1 1141 . 6 1 1 A 101 101 GLY CA C 101 46.000 45.014 0.986 1
1 1142 . 6 1 1 A 101 101 GLY N N 101 108.000 107.329 0.671 1
1 1143 . 6 1 1 A 102 102 THR H H 102 7.880 7.876 0.004 1
1 1144 . 6 1 1 A 102 102 THR HA H 102 4.360 4.150 0.210 1
1 1149 . 6 1 1 A 102 102 THR C C 102 174.400 173.547 0.853 1
1 1150 . 6 1 1 A 102 102 THR CA C 102 62.100 63.474 -1.374 1
1 1151 . 6 1 1 A 102 102 THR CB C 102 70.500 68.872 1.628 1
1 1153 . 6 1 1 A 102 102 THR N N 102 113.900 117.173 -3.273 1
1 1154 . 6 1 1 A 103 103 LYS H H 103 8.440 8.848 -0.408 1
1 1155 . 6 1 1 A 103 103 LYS C C 103 176.400 175.225 1.175 1
1 1156 . 6 1 1 A 103 103 LYS CA C 103 56.600 54.950 1.650 1
1 1157 . 6 1 1 A 103 103 LYS CB C 103 33.300 33.863 -0.563 1
1 1158 . 6 1 1 A 103 103 LYS N N 103 124.000 128.144 -4.144 1
1 1159 . 6 1 1 A 104 104 LEU H H 104 8.180 8.587 -0.407 1
1 1160 . 6 1 1 A 104 104 LEU HA H 104 4.270 4.531 -0.261 1
1 1170 . 6 1 1 A 104 104 LEU C C 104 177.100 176.114 0.986 1
1 1171 . 6 1 1 A 104 104 LEU CA C 104 55.500 53.534 1.966 1
1 1172 . 6 1 1 A 104 104 LEU CB C 104 42.500 41.364 1.136 1
1 1176 . 6 1 1 A 104 104 LEU N N 104 123.500 129.162 -5.662 1
1 1177 . 6 1 1 A 105 105 GLU H H 105 8.270 8.270 0.000 1
1 1178 . 6 1 1 A 105 105 GLU CA C 105 56.700 58.520 -1.820 1
1 1179 . 6 1 1 A 105 105 GLU CB C 105 30.800 28.397 2.403 1
1 13 . 7 1 1 A 2 2 ASN HA H 2 4.980 5.168 -0.188 1
1 18 . 7 1 1 A 2 2 ASN C C 2 176.300 176.636 -0.336 1
1 19 . 7 1 1 A 2 2 ASN CA C 2 52.500 51.633 0.867 1
1 20 . 7 1 1 A 2 2 ASN CB C 2 40.900 41.002 -0.102 1
1 22 . 7 1 1 A 3 3 SER H H 3 9.940 8.980 0.960 1
1 23 . 7 1 1 A 3 3 SER HA H 3 3.720 4.177 -0.457 1
1 26 . 7 1 1 A 3 3 SER C C 3 175.900 176.819 -0.919 1
1 27 . 7 1 1 A 3 3 SER CA C 3 63.300 61.826 1.474 1
1 28 . 7 1 1 A 3 3 SER CB C 3 61.700 62.419 -0.719 1
1 29 . 7 1 1 A 3 3 SER N N 3 118.200 116.238 1.962 1
1 30 . 7 1 1 A 4 4 GLU H H 4 8.450 8.258 0.192 1
1 31 . 7 1 1 A 4 4 GLU HA H 4 4.010 4.006 0.004 1
1 36 . 7 1 1 A 4 4 GLU C C 4 178.800 178.959 -0.159 1
1 37 . 7 1 1 A 4 4 GLU CA C 4 60.300 59.291 1.009 1
1 38 . 7 1 1 A 4 4 GLU CB C 4 29.100 29.409 -0.309 1
1 40 . 7 1 1 A 4 4 GLU N N 4 123.600 122.245 1.355 1
1 41 . 7 1 1 A 5 5 VAL H H 5 7.590 7.997 -0.407 1
1 42 . 7 1 1 A 5 5 VAL HA H 5 3.850 3.696 0.154 1
1 50 . 7 1 1 A 5 5 VAL C C 5 179.100 178.034 1.066 1
1 51 . 7 1 1 A 5 5 VAL CA C 5 65.800 66.566 -0.766 1
1 52 . 7 1 1 A 5 5 VAL CB C 5 32.300 31.481 0.819 1
1 55 . 7 1 1 A 5 5 VAL N N 5 119.300 118.935 0.365 1
1 56 . 7 1 1 A 6 6 ILE H H 6 7.240 8.038 -0.798 1
1 57 . 7 1 1 A 6 6 ILE HA H 6 3.580 3.648 -0.068 1
1 67 . 7 1 1 A 6 6 ILE C C 6 177.000 178.117 -1.117 1
1 68 . 7 1 1 A 6 6 ILE CA C 6 65.300 65.937 -0.637 1
1 69 . 7 1 1 A 6 6 ILE CB C 6 37.900 37.886 0.014 1
1 73 . 7 1 1 A 6 6 ILE N N 6 120.300 120.206 0.094 1
1 74 . 7 1 1 A 7 7 LYS H H 7 8.050 8.141 -0.091 1
1 75 . 7 1 1 A 7 7 LYS HA H 7 3.570 3.173 0.397 1
1 84 . 7 1 1 A 7 7 LYS C C 7 178.700 179.740 -1.040 1
1 85 . 7 1 1 A 7 7 LYS CA C 7 61.300 60.235 1.065 1
1 86 . 7 1 1 A 7 7 LYS CB C 7 32.200 32.079 0.121 1
1 90 . 7 1 1 A 7 7 LYS N N 7 119.200 118.824 0.376 1
1 91 . 7 1 1 A 8 8 GLU H H 8 8.100 7.768 0.332 1
1 92 . 7 1 1 A 8 8 GLU HA H 8 4.000 4.044 -0.044 1
1 97 . 7 1 1 A 8 8 GLU C C 8 178.500 179.199 -0.699 1
1 98 . 7 1 1 A 8 8 GLU CA C 8 59.700 59.009 0.691 1
1 99 . 7 1 1 A 8 8 GLU CB C 8 29.600 30.087 -0.487 1
1 101 . 7 1 1 A 8 8 GLU N N 8 119.400 120.142 -0.742 1
1 102 . 7 1 1 A 9 9 PHE H H 9 7.720 8.148 -0.428 1
1 103 . 7 1 1 A 9 9 PHE HA H 9 4.160 4.092 0.068 1
1 109 . 7 1 1 A 9 9 PHE C C 9 176.900 176.737 0.163 1
1 110 . 7 1 1 A 9 9 PHE CA C 9 61.300 61.313 -0.013 1
1 111 . 7 1 1 A 9 9 PHE CB C 9 39.400 39.131 0.269 1
1 115 . 7 1 1 A 9 9 PHE N N 9 121.300 121.881 -0.581 1
1 116 . 7 1 1 A 10 10 LEU H H 10 8.060 8.625 -0.565 1
1 117 . 7 1 1 A 10 10 LEU HA H 10 3.660 3.682 -0.022 1
1 127 . 7 1 1 A 10 10 LEU C C 10 179.000 179.136 -0.136 1
1 128 . 7 1 1 A 10 10 LEU CA C 10 58.000 57.536 0.464 1
1 129 . 7 1 1 A 10 10 LEU CB C 10 41.400 41.084 0.316 1
1 133 . 7 1 1 A 10 10 LEU N N 10 118.000 119.114 -1.114 1
1 134 . 7 1 1 A 11 11 GLU H H 11 7.990 8.580 -0.590 1
1 135 . 7 1 1 A 11 11 GLU HA H 11 4.110 4.037 0.073 1
1 140 . 7 1 1 A 11 11 GLU C C 11 174.200 178.311 -4.111 1
1 141 . 7 1 1 A 11 11 GLU CA C 11 59.200 59.369 -0.169 1
1 142 . 7 1 1 A 11 11 GLU CB C 11 29.300 29.203 0.097 1
1 144 . 7 1 1 A 11 11 GLU N N 11 118.300 120.762 -2.462 1
1 145 . 7 1 1 A 12 12 ASP H H 12 8.080 8.141 -0.061 1
1 146 . 7 1 1 A 12 12 ASP HA H 12 4.340 4.348 -0.008 1
1 149 . 7 1 1 A 12 12 ASP C C 12 178.900 178.702 0.198 1
1 150 . 7 1 1 A 12 12 ASP CA C 12 57.600 57.391 0.209 1
1 151 . 7 1 1 A 12 12 ASP CB C 12 41.000 41.524 -0.524 1
1 152 . 7 1 1 A 12 12 ASP N N 12 121.800 120.430 1.370 1
1 153 . 7 1 1 A 13 13 ILE H H 13 7.610 7.389 0.221 1
1 154 . 7 1 1 A 13 13 ILE HA H 13 4.240 3.782 0.458 1
1 164 . 7 1 1 A 13 13 ILE C C 13 176.800 176.390 0.410 1
1 165 . 7 1 1 A 13 13 ILE CA C 13 62.100 62.752 -0.652 1
1 166 . 7 1 1 A 13 13 ILE CB C 13 38.300 38.344 -0.044 1
1 170 . 7 1 1 A 13 13 ILE N N 13 110.800 116.836 -6.036 1
1 171 . 7 1 1 A 14 14 GLY H H 14 7.640 8.349 -0.709 1
1 172 . 7 1 1 A 14 14 GLY HA2 H 14 3.810 3.917 -0.107 1
1 173 . 7 1 1 A 14 14 GLY HA3 H 14 3.880 3.937 -0.057 1
1 174 . 7 1 1 A 14 14 GLY C C 14 175.200 174.289 0.911 1
1 175 . 7 1 1 A 14 14 GLY CA C 14 46.900 45.658 1.242 1
1 176 . 7 1 1 A 14 14 GLY N N 14 111.800 109.342 2.458 1
1 177 . 7 1 1 A 15 15 GLU H H 15 7.870 7.705 0.165 1
1 178 . 7 1 1 A 15 15 GLU HA H 15 4.680 4.680 0.000 1
1 183 . 7 1 1 A 15 15 GLU C C 15 175.100 176.072 -0.972 1
1 184 . 7 1 1 A 15 15 GLU CA C 15 54.800 55.042 -0.242 1
1 185 . 7 1 1 A 15 15 GLU CB C 15 32.200 31.400 0.800 1
1 187 . 7 1 1 A 15 15 GLU N N 15 119.200 119.682 -0.482 1
1 188 . 7 1 1 A 16 16 ASP H H 16 8.220 8.678 -0.458 1
1 189 . 7 1 1 A 16 16 ASP HA H 16 4.680 4.921 -0.241 1
1 192 . 7 1 1 A 16 16 ASP C C 16 174.600 175.554 -0.954 1
1 193 . 7 1 1 A 16 16 ASP CA C 16 53.600 54.372 -0.772 1
1 194 . 7 1 1 A 16 16 ASP CB C 16 42.900 41.466 1.434 1
1 195 . 7 1 1 A 16 16 ASP N N 16 120.600 121.416 -0.816 1
1 196 . 7 1 1 A 17 17 TYR H H 17 7.540 8.850 -1.310 1
1 197 . 7 1 1 A 17 17 TYR HA H 17 4.910 5.579 -0.669 1
1 202 . 7 1 1 A 17 17 TYR C C 17 173.600 174.367 -0.767 1
1 203 . 7 1 1 A 17 17 TYR CA C 17 56.200 55.932 0.268 1
1 204 . 7 1 1 A 17 17 TYR CB C 17 41.100 40.711 0.389 1
1 207 . 7 1 1 A 17 17 TYR N N 17 112.700 121.109 -8.409 1
1 208 . 7 1 1 A 18 18 ILE H H 18 7.950 9.041 -1.091 1
1 209 . 7 1 1 A 18 18 ILE HA H 18 4.330 4.426 -0.096 1
1 219 . 7 1 1 A 18 18 ILE C C 18 174.700 174.968 -0.268 1
1 220 . 7 1 1 A 18 18 ILE CA C 18 60.300 61.268 -0.968 1
1 221 . 7 1 1 A 18 18 ILE CB C 18 41.000 36.932 4.068 1
1 225 . 7 1 1 A 18 18 ILE N N 18 120.400 126.374 -5.974 1
1 226 . 7 1 1 A 19 19 GLU H H 19 8.760 8.456 0.304 1
1 227 . 7 1 1 A 19 19 GLU HA H 19 5.200 4.728 0.472 1
1 232 . 7 1 1 A 19 19 GLU C C 19 175.200 175.602 -0.402 1
1 233 . 7 1 1 A 19 19 GLU CA C 19 55.500 56.399 -0.899 1
1 234 . 7 1 1 A 19 19 GLU CB C 19 32.400 30.337 2.063 1
1 236 . 7 1 1 A 19 19 GLU N N 19 129.000 128.556 0.444 1
1 237 . 7 1 1 A 20 20 LEU H H 20 8.730 9.243 -0.513 1
1 238 . 7 1 1 A 20 20 LEU HA H 20 4.620 4.946 -0.326 1
1 248 . 7 1 1 A 20 20 LEU C C 20 176.200 176.366 -0.166 1
1 249 . 7 1 1 A 20 20 LEU CA C 20 54.100 53.338 0.762 1
1 250 . 7 1 1 A 20 20 LEU CB C 20 44.400 43.829 0.571 1
1 254 . 7 1 1 A 20 20 LEU N N 20 128.400 128.548 -0.148 1
1 255 . 7 1 1 A 21 21 GLU H H 21 8.700 8.689 0.011 1
1 256 . 7 1 1 A 21 21 GLU HA H 21 3.870 3.970 -0.100 1
1 261 . 7 1 1 A 21 21 GLU C C 21 176.100 177.019 -0.919 1
1 262 . 7 1 1 A 21 21 GLU CA C 21 58.800 57.617 1.183 1
1 263 . 7 1 1 A 21 21 GLU CB C 21 28.200 29.166 -0.966 1
1 265 . 7 1 1 A 21 21 GLU N N 21 122.600 120.405 2.195 1
1 266 . 7 1 1 A 22 22 ASN H H 22 8.640 8.961 -0.321 1
1 267 . 7 1 1 A 22 22 ASN HA H 22 4.540 4.352 0.188 1
1 272 . 7 1 1 A 22 22 ASN C C 22 173.800 173.962 -0.162 1
1 273 . 7 1 1 A 22 22 ASN CA C 22 54.600 55.156 -0.556 1
1 274 . 7 1 1 A 22 22 ASN CB C 22 38.400 37.159 1.241 1
1 275 . 7 1 1 A 22 22 ASN N N 22 118.000 119.321 -1.321 1
1 277 . 7 1 1 A 23 23 GLU H H 23 7.740 7.777 -0.037 1
1 278 . 7 1 1 A 23 23 GLU HA H 23 5.430 5.248 0.182 1
1 283 . 7 1 1 A 23 23 GLU C C 23 175.400 175.066 0.334 1
1 284 . 7 1 1 A 23 23 GLU CA C 23 54.900 54.891 0.009 1
1 285 . 7 1 1 A 23 23 GLU CB C 23 34.500 33.481 1.019 1
1 287 . 7 1 1 A 23 23 GLU N N 23 116.400 118.105 -1.705 1
1 288 . 7 1 1 A 24 24 ILE H H 24 9.050 9.430 -0.380 1
1 289 . 7 1 1 A 24 24 ILE HA H 24 4.810 5.048 -0.238 1
1 299 . 7 1 1 A 24 24 ILE C C 24 174.600 175.151 -0.551 1
1 300 . 7 1 1 A 24 24 ILE CA C 24 60.700 60.555 0.145 1
1 301 . 7 1 1 A 24 24 ILE CB C 24 41.300 40.217 1.083 1
1 305 . 7 1 1 A 24 24 ILE N N 24 122.800 121.746 1.054 1
1 306 . 7 1 1 A 25 25 HIS H H 25 9.490 9.340 0.150 1
1 307 . 7 1 1 A 25 25 HIS HA H 25 5.090 5.341 -0.251 1
1 312 . 7 1 1 A 25 25 HIS C C 25 176.100 175.193 0.907 1
1 313 . 7 1 1 A 25 25 HIS CA C 25 56.100 55.264 0.836 1
1 314 . 7 1 1 A 25 25 HIS CB C 25 33.100 31.163 1.937 1
1 317 . 7 1 1 A 25 25 HIS N N 25 127.300 125.816 1.484 1
1 318 . 7 1 1 A 26 26 LEU H H 26 8.820 8.763 0.057 1
1 319 . 7 1 1 A 26 26 LEU HA H 26 5.160 5.012 0.148 1
1 329 . 7 1 1 A 26 26 LEU C C 26 178.000 175.779 2.221 1
1 330 . 7 1 1 A 26 26 LEU CA C 26 52.900 53.500 -0.600 1
1 331 . 7 1 1 A 26 26 LEU CB C 26 48.100 44.556 3.544 1
1 335 . 7 1 1 A 26 26 LEU N N 26 121.600 125.038 -3.438 1
1 336 . 7 1 1 A 27 27 LYS H H 27 8.990 8.755 0.235 1
1 337 . 7 1 1 A 27 27 LYS HA H 27 4.630 4.764 -0.134 1
1 345 . 7 1 1 A 27 27 LYS CA C 27 55.700 53.792 1.908 1
1 346 . 7 1 1 A 27 27 LYS CB C 27 31.900 32.729 -0.829 1
1 350 . 7 1 1 A 27 27 LYS N N 27 125.900 120.752 5.148 1
1 351 . 7 1 1 A 28 28 PRO HA H 28 4.500 4.464 0.036 1
1 358 . 7 1 1 A 28 28 PRO C C 28 177.900 178.186 -0.286 1
1 359 . 7 1 1 A 28 28 PRO CA C 28 67.400 66.016 1.384 1
1 360 . 7 1 1 A 28 28 PRO CB C 28 32.100 31.740 0.360 1
1 363 . 7 1 1 A 29 29 GLU H H 29 9.880 8.275 1.605 1
1 364 . 7 1 1 A 29 29 GLU HA H 29 4.140 4.302 -0.162 1
1 369 . 7 1 1 A 29 29 GLU C C 29 178.800 179.434 -0.634 1
1 370 . 7 1 1 A 29 29 GLU CA C 29 60.600 59.798 0.802 1
1 371 . 7 1 1 A 29 29 GLU CB C 29 29.200 29.296 -0.096 1
1 373 . 7 1 1 A 29 29 GLU N N 29 117.100 118.356 -1.256 1
1 374 . 7 1 1 A 30 30 VAL H H 30 7.050 7.776 -0.726 1
1 375 . 7 1 1 A 30 30 VAL HA H 30 3.850 3.726 0.124 1
1 383 . 7 1 1 A 30 30 VAL C C 30 177.700 178.297 -0.597 1
1 384 . 7 1 1 A 30 30 VAL CA C 30 65.600 66.529 -0.929 1
1 385 . 7 1 1 A 30 30 VAL CB C 30 32.100 31.605 0.495 1
1 388 . 7 1 1 A 30 30 VAL N N 30 120.900 119.741 1.159 1
1 389 . 7 1 1 A 31 31 PHE H H 31 8.980 8.858 0.122 1
1 390 . 7 1 1 A 31 31 PHE HA H 31 3.870 4.284 -0.414 1
1 394 . 7 1 1 A 31 31 PHE C C 31 176.700 177.273 -0.573 1
1 395 . 7 1 1 A 31 31 PHE CA C 31 62.200 61.990 0.210 1
1 396 . 7 1 1 A 31 31 PHE CB C 31 39.300 39.114 0.186 1
1 398 . 7 1 1 A 31 31 PHE N N 31 121.100 120.631 0.469 1
1 399 . 7 1 1 A 32 32 TYR H H 32 8.640 8.291 0.349 1
1 400 . 7 1 1 A 32 32 TYR HA H 32 3.880 4.682 -0.802 1
1 405 . 7 1 1 A 32 32 TYR C C 32 176.000 178.382 -2.382 1
1 406 . 7 1 1 A 32 32 TYR CA C 32 63.300 61.970 1.330 1
1 407 . 7 1 1 A 32 32 TYR CB C 32 39.100 38.778 0.322 1
1 410 . 7 1 1 A 32 32 TYR N N 32 117.400 120.885 -3.485 1
1 411 . 7 1 1 A 33 33 GLU H H 33 7.400 8.316 -0.916 1
1 412 . 7 1 1 A 33 33 GLU HA H 33 4.050 4.095 -0.045 1
1 417 . 7 1 1 A 33 33 GLU C C 33 180.200 179.604 0.596 1
1 418 . 7 1 1 A 33 33 GLU CA C 33 59.500 59.319 0.181 1
1 419 . 7 1 1 A 33 33 GLU CB C 33 29.300 29.846 -0.546 1
1 421 . 7 1 1 A 33 33 GLU N N 33 116.100 118.280 -2.180 1
1 422 . 7 1 1 A 34 34 VAL H H 34 8.530 8.075 0.455 1
1 423 . 7 1 1 A 34 34 VAL HA H 34 3.350 3.597 -0.247 1
1 431 . 7 1 1 A 34 34 VAL C C 34 175.800 178.339 -2.539 1
1 432 . 7 1 1 A 34 34 VAL CA C 34 66.400 66.324 0.076 1
1 433 . 7 1 1 A 34 34 VAL CB C 34 32.200 31.690 0.510 1
1 436 . 7 1 1 A 34 34 VAL N N 34 120.600 120.799 -0.199 1
1 437 . 7 1 1 A 35 35 TRP H H 35 9.100 8.386 0.714 1
1 438 . 7 1 1 A 35 35 TRP HA H 35 3.340 3.710 -0.370 1
1 447 . 7 1 1 A 35 35 TRP C C 35 178.000 178.382 -0.382 1
1 448 . 7 1 1 A 35 35 TRP CA C 35 61.800 60.542 1.258 1
1 449 . 7 1 1 A 35 35 TRP CB C 35 27.900 29.349 -1.449 1
1 455 . 7 1 1 A 35 35 TRP N N 35 121.700 121.372 0.328 1
1 457 . 7 1 1 A 36 36 LYS H H 36 7.970 7.794 0.176 1
1 458 . 7 1 1 A 36 36 LYS HA H 36 3.330 3.644 -0.314 1
1 467 . 7 1 1 A 36 36 LYS C C 36 180.000 178.258 1.742 1
1 468 . 7 1 1 A 36 36 LYS CA C 36 59.000 58.744 0.256 1
1 469 . 7 1 1 A 36 36 LYS CB C 36 31.800 32.180 -0.380 1
1 473 . 7 1 1 A 36 36 LYS N N 36 116.300 118.102 -1.802 1
1 474 . 7 1 1 A 37 37 TYR H H 37 7.750 7.888 -0.138 1
1 475 . 7 1 1 A 37 37 TYR HA H 37 3.940 3.904 0.036 1
1 480 . 7 1 1 A 37 37 TYR C C 37 177.600 177.776 -0.176 1
1 481 . 7 1 1 A 37 37 TYR CA C 37 61.200 61.033 0.167 1
1 482 . 7 1 1 A 37 37 TYR CB C 37 38.800 38.349 0.451 1
1 485 . 7 1 1 A 37 37 TYR N N 37 122.700 121.633 1.067 1
1 486 . 7 1 1 A 38 38 VAL H H 38 7.660 7.422 0.238 1
1 487 . 7 1 1 A 38 38 VAL HA H 38 3.870 3.725 0.145 1
1 495 . 7 1 1 A 38 38 VAL C C 38 175.600 176.001 -0.401 1
1 496 . 7 1 1 A 38 38 VAL CA C 38 61.100 62.401 -1.301 1
1 497 . 7 1 1 A 38 38 VAL CB C 38 30.700 31.940 -1.240 1
1 500 . 7 1 1 A 38 38 VAL N N 38 108.200 113.323 -5.123 1
1 501 . 7 1 1 A 39 39 GLY H H 39 7.090 7.581 -0.491 1
1 502 . 7 1 1 A 39 39 GLY HA2 H 39 3.320 3.748 -0.428 1
1 503 . 7 1 1 A 39 39 GLY HA3 H 39 3.730 3.778 -0.048 1
1 504 . 7 1 1 A 39 39 GLY C C 39 173.600 174.419 -0.819 1
1 505 . 7 1 1 A 39 39 GLY CA C 39 46.100 44.757 1.343 1
1 506 . 7 1 1 A 39 39 GLY N N 39 107.600 110.532 -2.932 1
1 507 . 7 1 1 A 40 40 GLU H H 40 7.730 8.092 -0.362 1
1 508 . 7 1 1 A 40 40 GLU HA H 40 1.090 2.802 -1.712 1
1 513 . 7 1 1 A 40 40 GLU CA C 40 55.700 56.358 -0.658 1
1 514 . 7 1 1 A 40 40 GLU CB C 40 27.200 27.471 -0.271 1
1 516 . 7 1 1 A 40 40 GLU N N 40 114.400 112.680 1.720 1
1 517 . 7 1 1 A 41 41 PRO HA H 41 4.310 4.610 -0.300 1
1 524 . 7 1 1 A 41 41 PRO CA C 41 62.300 62.218 0.082 1
1 525 . 7 1 1 A 41 41 PRO CB C 41 32.700 32.650 0.050 1
1 528 . 7 1 1 A 42 42 GLU H H 42 8.110 8.563 -0.453 1
1 529 . 7 1 1 A 42 42 GLU C C 42 175.800 176.539 -0.739 1
1 530 . 7 1 1 A 42 42 GLU CA C 42 57.800 56.819 0.981 1
1 531 . 7 1 1 A 42 42 GLU CB C 42 30.600 30.052 0.548 1
1 533 . 7 1 1 A 42 42 GLU N N 42 119.100 121.094 -1.994 1
1 534 . 7 1 1 A 43 43 LEU H H 43 8.140 8.921 -0.781 1
1 535 . 7 1 1 A 43 43 LEU HA H 43 4.840 4.869 -0.029 1
1 545 . 7 1 1 A 43 43 LEU C C 43 177.300 176.169 1.131 1
1 546 . 7 1 1 A 43 43 LEU CA C 43 53.700 53.583 0.117 1
1 547 . 7 1 1 A 43 43 LEU CB C 43 43.900 43.354 0.546 1
1 551 . 7 1 1 A 43 43 LEU N N 43 124.700 126.994 -2.294 1
1 552 . 7 1 1 A 44 44 LYS H H 44 8.640 8.156 0.484 1
1 553 . 7 1 1 A 44 44 LYS HA H 44 4.500 4.685 -0.185 1
1 562 . 7 1 1 A 44 44 LYS C C 44 174.500 175.716 -1.216 1
1 563 . 7 1 1 A 44 44 LYS CA C 44 54.700 55.205 -0.505 1
1 564 . 7 1 1 A 44 44 LYS CB C 44 36.200 33.823 2.377 1
1 568 . 7 1 1 A 44 44 LYS N N 44 123.300 123.608 -0.308 1
1 569 . 7 1 1 A 45 45 THR H H 45 7.990 8.807 -0.817 1
1 570 . 7 1 1 A 45 45 THR HA H 45 5.700 5.729 -0.029 1
1 575 . 7 1 1 A 45 45 THR C C 45 175.100 173.915 1.185 1
1 576 . 7 1 1 A 45 45 THR CA C 45 59.600 59.658 -0.058 1
1 577 . 7 1 1 A 45 45 THR CB C 45 73.400 71.245 2.155 1
1 579 . 7 1 1 A 45 45 THR N N 45 106.900 113.823 -6.923 1
1 580 . 7 1 1 A 46 46 TYR H H 46 8.470 9.169 -0.699 1
1 581 . 7 1 1 A 46 46 TYR HA H 46 4.930 5.894 -0.964 1
1 586 . 7 1 1 A 46 46 TYR C C 46 172.400 173.702 -1.302 1
1 587 . 7 1 1 A 46 46 TYR CA C 46 57.100 55.210 1.890 1
1 588 . 7 1 1 A 46 46 TYR CB C 46 40.200 41.934 -1.734 1
1 591 . 7 1 1 A 46 46 TYR N N 46 117.100 119.117 -2.017 1
1 592 . 7 1 1 A 47 47 VAL H H 47 8.430 9.096 -0.666 1
1 593 . 7 1 1 A 47 47 VAL HA H 47 4.890 4.594 0.296 1
1 601 . 7 1 1 A 47 47 VAL C C 47 175.800 174.337 1.463 1
1 602 . 7 1 1 A 47 47 VAL CA C 47 60.800 62.106 -1.306 1
1 603 . 7 1 1 A 47 47 VAL CB C 47 34.800 31.769 3.031 1
1 606 . 7 1 1 A 47 47 VAL N N 47 119.200 122.910 -3.710 1
1 607 . 7 1 1 A 48 48 ILE H H 48 8.680 9.068 -0.388 1
1 608 . 7 1 1 A 48 48 ILE HA H 48 4.560 4.854 -0.294 1
1 618 . 7 1 1 A 48 48 ILE C C 48 174.500 174.543 -0.043 1
1 619 . 7 1 1 A 48 48 ILE CA C 48 59.700 60.200 -0.500 1
1 620 . 7 1 1 A 48 48 ILE CB C 48 41.500 40.181 1.319 1
1 624 . 7 1 1 A 48 48 ILE N N 48 124.400 128.846 -4.446 1
1 625 . 7 1 1 A 49 49 GLU H H 49 8.320 9.057 -0.737 1
1 626 . 7 1 1 A 49 49 GLU C C 49 175.500 174.989 0.511 1
1 627 . 7 1 1 A 49 49 GLU CA C 49 55.500 55.546 -0.046 1
1 628 . 7 1 1 A 49 49 GLU CB C 49 31.800 30.934 0.866 1
1 630 . 7 1 1 A 49 49 GLU N N 49 123.400 130.705 -7.305 1
1 631 . 7 1 1 A 50 50 ASP H H 50 8.610 8.913 -0.303 1
1 632 . 7 1 1 A 50 50 ASP C C 50 175.100 174.432 0.668 1
1 633 . 7 1 1 A 50 50 ASP CA C 50 53.100 52.833 0.267 1
1 634 . 7 1 1 A 50 50 ASP CB C 50 44.000 44.700 -0.700 1
1 635 . 7 1 1 A 50 50 ASP N N 50 124.300 127.904 -3.604 1
1 636 . 7 1 1 A 51 51 GLU H H 51 8.450 8.837 -0.387 1
1 637 . 7 1 1 A 51 51 GLU C C 51 175.900 176.232 -0.332 1
1 638 . 7 1 1 A 51 51 GLU CA C 51 56.000 55.295 0.705 1
1 639 . 7 1 1 A 51 51 GLU CB C 51 31.700 31.382 0.318 1
1 640 . 7 1 1 A 51 51 GLU N N 51 121.300 121.494 -0.194 1
1 641 . 7 1 1 A 52 52 ILE H H 52 8.480 8.583 -0.103 1
1 642 . 7 1 1 A 52 52 ILE C C 52 175.400 175.052 0.348 1
1 643 . 7 1 1 A 52 52 ILE CA C 52 60.400 61.498 -1.098 1
1 644 . 7 1 1 A 52 52 ILE CB C 52 40.000 36.701 3.299 1
1 645 . 7 1 1 A 52 52 ILE N N 52 122.700 119.950 2.750 1
1 646 . 7 1 1 A 53 53 VAL H H 53 8.140 8.425 -0.285 1
1 647 . 7 1 1 A 53 53 VAL C C 53 175.600 175.399 0.201 1
1 648 . 7 1 1 A 53 53 VAL CA C 53 61.900 61.524 0.376 1
1 649 . 7 1 1 A 53 53 VAL CB C 53 33.200 31.651 1.549 1
1 650 . 7 1 1 A 53 53 VAL N N 53 124.400 124.660 -0.260 1
1 651 . 7 1 1 A 54 54 GLU H H 54 8.540 8.796 -0.256 1
1 652 . 7 1 1 A 54 54 GLU CA C 54 55.600 53.675 1.925 1
1 653 . 7 1 1 A 54 54 GLU CB C 54 34.300 30.037 4.263 1
1 654 . 7 1 1 A 54 54 GLU N N 54 125.900 128.070 -2.170 1
1 655 . 7 1 1 A 55 55 PRO C C 55 177.500 177.465 0.035 1
1 656 . 7 1 1 A 55 55 PRO CA C 55 63.400 65.458 -2.058 1
1 657 . 7 1 1 A 55 55 PRO CB C 55 32.300 31.834 0.466 1
1 658 . 7 1 1 A 56 56 GLY H H 56 8.420 7.586 0.834 1
1 659 . 7 1 1 A 56 56 GLY HA2 H 56 3.830 3.961 -0.131 1
1 660 . 7 1 1 A 56 56 GLY HA3 H 56 4.000 3.980 0.020 1
1 661 . 7 1 1 A 56 56 GLY C C 56 174.500 173.753 0.747 1
1 662 . 7 1 1 A 56 56 GLY CA C 56 45.400 45.461 -0.061 1
1 663 . 7 1 1 A 56 56 GLY N N 56 109.700 105.431 4.269 1
1 664 . 7 1 1 A 57 57 GLU H H 57 8.180 7.698 0.482 1
1 665 . 7 1 1 A 57 57 GLU C C 57 176.300 175.193 1.107 1
1 666 . 7 1 1 A 57 57 GLU CA C 57 57.500 55.029 2.471 1
1 667 . 7 1 1 A 57 57 GLU CB C 57 30.400 31.212 -0.812 1
1 668 . 7 1 1 A 57 57 GLU N N 57 120.900 121.579 -0.679 1
1 669 . 7 1 1 A 58 58 TYR H H 58 8.020 8.560 -0.540 1
1 670 . 7 1 1 A 58 58 TYR C C 58 175.100 175.912 -0.812 1
1 671 . 7 1 1 A 58 58 TYR CA C 58 57.400 58.416 -1.016 1
1 672 . 7 1 1 A 58 58 TYR CB C 58 38.900 39.304 -0.404 1
1 673 . 7 1 1 A 58 58 TYR N N 58 118.800 126.865 -8.065 1
1 674 . 7 1 1 A 59 59 ASP H H 59 7.950 9.158 -1.208 1
1 675 . 7 1 1 A 59 59 ASP CA C 59 52.700 52.189 0.511 1
1 676 . 7 1 1 A 59 59 ASP CB C 59 41.000 42.021 -1.021 1
1 677 . 7 1 1 A 59 59 ASP N N 59 123.500 123.317 0.183 1
1 678 . 7 1 1 A 61 61 PRO HA H 61 4.510 4.583 -0.073 1
1 685 . 7 1 1 A 61 61 PRO C C 61 176.500 176.067 0.433 1
1 686 . 7 1 1 A 61 61 PRO CA C 61 63.700 62.654 1.046 1
1 687 . 7 1 1 A 61 61 PRO CB C 61 34.200 30.701 3.499 1
1 690 . 7 1 1 A 62 62 GLU H H 62 8.490 8.456 0.034 1
1 691 . 7 1 1 A 62 62 GLU N N 62 124.600 123.720 0.880 1
1 692 . 7 1 1 A 64 64 LYS C C 64 176.300 173.569 2.731 1
1 693 . 7 1 1 A 64 64 LYS CA C 64 57.000 55.773 1.227 1
1 694 . 7 1 1 A 64 64 LYS CB C 64 33.100 36.625 -3.525 1
1 695 . 7 1 1 A 65 65 TYR H H 65 7.960 8.911 -0.951 1
1 696 . 7 1 1 A 65 65 TYR C C 65 176.000 174.290 1.710 1
1 697 . 7 1 1 A 65 65 TYR CA C 65 57.800 56.285 1.515 1
1 698 . 7 1 1 A 65 65 TYR CB C 65 38.800 39.192 -0.392 1
1 699 . 7 1 1 A 65 65 TYR N N 65 119.300 127.189 -7.889 1
1 700 . 7 1 1 A 66 66 THR H H 66 7.820 8.489 -0.669 1
1 701 . 7 1 1 A 66 66 THR HA H 66 4.280 4.260 0.020 1
1 706 . 7 1 1 A 66 66 THR C C 66 174.100 174.114 -0.014 1
1 707 . 7 1 1 A 66 66 THR CA C 66 62.100 62.503 -0.403 1
1 708 . 7 1 1 A 66 66 THR CB C 66 70.000 69.158 0.842 1
1 710 . 7 1 1 A 66 66 THR N N 66 113.900 122.586 -8.686 1
1 711 . 7 1 1 A 67 67 ASN H H 67 8.270 8.491 -0.221 1
1 712 . 7 1 1 A 67 67 ASN C C 67 174.100 175.091 -0.991 1
1 713 . 7 1 1 A 67 67 ASN CA C 67 53.400 53.597 -0.197 1
1 714 . 7 1 1 A 67 67 ASN CB C 67 39.300 38.693 0.607 1
1 715 . 7 1 1 A 67 67 ASN N N 67 121.400 123.894 -2.494 1
1 716 . 7 1 1 A 68 68 VAL H H 68 7.660 8.769 -1.109 1
1 717 . 7 1 1 A 68 68 VAL C C 68 175.500 174.481 1.019 1
1 718 . 7 1 1 A 68 68 VAL CA C 68 61.800 62.264 -0.464 1
1 719 . 7 1 1 A 68 68 VAL CB C 68 33.700 31.676 2.024 1
1 720 . 7 1 1 A 68 68 VAL N N 68 119.400 125.840 -6.440 1
1 721 . 7 1 1 A 69 69 LYS H H 69 8.690 8.892 -0.202 1
1 722 . 7 1 1 A 69 69 LYS C C 69 175.200 175.162 0.038 1
1 723 . 7 1 1 A 69 69 LYS CA C 69 55.200 54.528 0.672 1
1 724 . 7 1 1 A 69 69 LYS CB C 69 35.200 35.017 0.183 1
1 725 . 7 1 1 A 69 69 LYS N N 69 126.500 128.830 -2.330 1
1 726 . 7 1 1 A 70 70 LYS H H 70 8.230 8.768 -0.538 1
1 727 . 7 1 1 A 70 70 LYS C C 70 176.400 175.754 0.646 1
1 728 . 7 1 1 A 70 70 LYS CA C 70 55.600 56.159 -0.559 1
1 729 . 7 1 1 A 70 70 LYS CB C 70 33.800 33.370 0.430 1
1 730 . 7 1 1 A 70 70 LYS N N 70 122.700 126.318 -3.618 1
1 731 . 7 1 1 A 71 71 VAL H H 71 8.530 9.266 -0.736 1
1 732 . 7 1 1 A 71 71 VAL HA H 71 4.510 4.594 -0.084 1
1 733 . 7 1 1 A 71 71 VAL C C 71 174.700 175.052 -0.352 1
1 734 . 7 1 1 A 71 71 VAL CA C 71 60.900 61.161 -0.261 1
1 735 . 7 1 1 A 71 71 VAL CB C 71 34.800 33.587 1.213 1
1 738 . 7 1 1 A 71 71 VAL N N 71 121.200 124.219 -3.019 1
1 739 . 7 1 1 A 72 72 LYS H H 72 8.210 8.980 -0.770 1
1 740 . 7 1 1 A 72 72 LYS HA H 72 4.800 4.624 0.176 1
1 747 . 7 1 1 A 72 72 LYS C C 72 176.200 175.391 0.809 1
1 748 . 7 1 1 A 72 72 LYS CA C 72 55.700 55.992 -0.292 1
1 749 . 7 1 1 A 72 72 LYS CB C 72 33.700 32.781 0.919 1
1 752 . 7 1 1 A 72 72 LYS N N 72 123.600 127.623 -4.023 1
1 753 . 7 1 1 A 73 73 ILE H H 73 8.890 9.335 -0.445 1
1 754 . 7 1 1 A 73 73 ILE C C 73 174.400 174.172 0.228 1
1 755 . 7 1 1 A 73 73 ILE CA C 73 60.400 60.376 0.024 1
1 756 . 7 1 1 A 73 73 ILE CB C 73 40.800 37.892 2.908 1
1 760 . 7 1 1 A 73 73 ILE N N 73 125.100 126.479 -1.379 1
1 761 . 7 1 1 A 74 74 LYS H H 74 8.420 8.836 -0.416 1
1 762 . 7 1 1 A 74 74 LYS HA H 74 4.800 4.773 0.027 1
1 771 . 7 1 1 A 74 74 LYS C C 74 175.600 175.148 0.452 1
1 772 . 7 1 1 A 74 74 LYS CA C 74 56.200 55.489 0.711 1
1 773 . 7 1 1 A 74 74 LYS CB C 74 34.300 33.392 0.908 1
1 777 . 7 1 1 A 74 74 LYS N N 74 126.400 128.393 -1.993 1
1 778 . 7 1 1 A 75 75 LYS H H 75 9.090 8.585 0.505 1
1 779 . 7 1 1 A 75 75 LYS HA H 75 4.800 4.886 -0.086 1
1 788 . 7 1 1 A 75 75 LYS C C 75 174.900 175.099 -0.199 1
1 789 . 7 1 1 A 75 75 LYS CA C 75 53.200 54.281 -1.081 1
1 790 . 7 1 1 A 75 75 LYS CB C 75 34.200 34.585 -0.385 1
1 794 . 7 1 1 A 75 75 LYS N N 75 127.500 127.149 0.351 1
1 795 . 7 1 1 A 76 76 VAL H H 76 8.610 8.905 -0.295 1
1 796 . 7 1 1 A 76 76 VAL HA H 76 5.340 5.259 0.081 1
1 804 . 7 1 1 A 76 76 VAL C C 76 171.400 174.213 -2.813 1
1 805 . 7 1 1 A 76 76 VAL CA C 76 58.000 59.567 -1.567 1
1 806 . 7 1 1 A 76 76 VAL CB C 76 36.400 34.915 1.485 1
1 809 . 7 1 1 A 76 76 VAL N N 76 120.100 121.118 -1.018 1
1 810 . 7 1 1 A 77 77 TYR H H 77 9.110 9.359 -0.249 1
1 811 . 7 1 1 A 77 77 TYR HA H 77 6.150 6.069 0.081 1
1 816 . 7 1 1 A 77 77 TYR C C 77 173.600 173.117 0.483 1
1 817 . 7 1 1 A 77 77 TYR CA C 77 56.200 55.776 0.424 1
1 818 . 7 1 1 A 77 77 TYR CB C 77 44.000 42.002 1.998 1
1 821 . 7 1 1 A 77 77 TYR N N 77 121.300 122.123 -0.823 1
1 822 . 7 1 1 A 78 78 PHE H H 78 8.190 8.728 -0.538 1
1 823 . 7 1 1 A 78 78 PHE HA H 78 5.130 5.663 -0.533 1
1 829 . 7 1 1 A 78 78 PHE C C 78 173.600 173.045 0.555 1
1 830 . 7 1 1 A 78 78 PHE CA C 78 55.900 55.243 0.657 1
1 831 . 7 1 1 A 78 78 PHE CB C 78 42.500 42.773 -0.273 1
1 835 . 7 1 1 A 78 78 PHE N N 78 112.700 117.046 -4.346 1
1 836 . 7 1 1 A 79 79 GLU H H 79 8.920 8.881 0.039 1
1 837 . 7 1 1 A 79 79 GLU HA H 79 5.390 4.877 0.513 1
1 842 . 7 1 1 A 79 79 GLU C C 79 177.000 176.870 0.130 1
1 843 . 7 1 1 A 79 79 GLU CA C 79 54.900 55.375 -0.475 1
1 844 . 7 1 1 A 79 79 GLU CB C 79 33.600 31.716 1.884 1
1 846 . 7 1 1 A 79 79 GLU N N 79 120.500 120.121 0.379 1
1 847 . 7 1 1 A 80 80 THR H H 80 8.970 8.695 0.275 1
1 848 . 7 1 1 A 80 80 THR HA H 80 4.700 4.773 -0.073 1
1 854 . 7 1 1 A 80 80 THR C C 80 177.000 176.249 0.751 1
1 855 . 7 1 1 A 80 80 THR CA C 80 61.300 60.927 0.373 1
1 856 . 7 1 1 A 80 80 THR CB C 80 70.500 71.281 -0.781 1
1 858 . 7 1 1 A 80 80 THR N N 80 113.200 115.895 -2.695 1
1 859 . 7 1 1 A 81 81 LEU H H 81 8.610 8.889 -0.279 1
1 860 . 7 1 1 A 81 81 LEU HA H 81 4.230 4.072 0.158 1
1 870 . 7 1 1 A 81 81 LEU C C 81 177.400 177.399 0.001 1
1 871 . 7 1 1 A 81 81 LEU CA C 81 57.700 57.594 0.106 1
1 872 . 7 1 1 A 81 81 LEU CB C 81 42.400 41.418 0.982 1
1 876 . 7 1 1 A 81 81 LEU N N 81 120.900 122.447 -1.547 1
1 877 . 7 1 1 A 82 82 ASP H H 82 8.850 7.982 0.868 1
1 878 . 7 1 1 A 82 82 ASP HA H 82 4.670 4.559 0.111 1
1 881 . 7 1 1 A 82 82 ASP C C 82 174.100 175.797 -1.697 1
1 882 . 7 1 1 A 82 82 ASP CA C 82 52.700 53.002 -0.302 1
1 883 . 7 1 1 A 82 82 ASP CB C 82 37.900 39.743 -1.843 1
1 884 . 7 1 1 A 82 82 ASP N N 82 112.300 115.786 -3.486 1
1 885 . 7 1 1 A 83 83 ASN H H 83 7.790 8.101 -0.311 1
1 886 . 7 1 1 A 83 83 ASN HA H 83 4.270 4.424 -0.154 1
1 891 . 7 1 1 A 83 83 ASN C C 83 176.100 174.585 1.515 1
1 892 . 7 1 1 A 83 83 ASN CA C 83 55.300 54.560 0.740 1
1 893 . 7 1 1 A 83 83 ASN CB C 83 36.900 37.031 -0.131 1
1 894 . 7 1 1 A 83 83 ASN N N 83 113.000 112.672 0.328 1
1 896 . 7 1 1 A 84 84 VAL H H 84 7.660 7.750 -0.090 1
1 897 . 7 1 1 A 84 84 VAL HA H 84 4.270 4.055 0.215 1
1 905 . 7 1 1 A 84 84 VAL C C 84 175.800 175.156 0.644 1
1 906 . 7 1 1 A 84 84 VAL CA C 84 61.500 62.664 -1.164 1
1 907 . 7 1 1 A 84 84 VAL CB C 84 33.500 32.092 1.408 1
1 910 . 7 1 1 A 84 84 VAL N N 84 119.700 119.640 0.060 1
1 911 . 7 1 1 A 85 85 ARG H H 85 8.180 8.514 -0.334 1
1 912 . 7 1 1 A 85 85 ARG HA H 85 4.870 4.687 0.183 1
1 920 . 7 1 1 A 85 85 ARG C C 85 174.000 174.935 -0.935 1
1 921 . 7 1 1 A 85 85 ARG CA C 85 55.700 55.681 0.019 1
1 922 . 7 1 1 A 85 85 ARG CB C 85 32.600 30.732 1.868 1
1 925 . 7 1 1 A 85 85 ARG N N 85 124.800 127.605 -2.805 1
1 927 . 7 1 1 A 86 86 VAL H H 86 8.570 8.164 0.406 1
1 928 . 7 1 1 A 86 86 VAL HA H 86 4.580 4.556 0.024 1
1 936 . 7 1 1 A 86 86 VAL C C 86 175.700 175.233 0.467 1
1 937 . 7 1 1 A 86 86 VAL CA C 86 61.700 62.428 -0.728 1
1 938 . 7 1 1 A 86 86 VAL CB C 86 30.900 31.064 -0.164 1
1 941 . 7 1 1 A 86 86 VAL N N 86 127.300 125.663 1.637 1
1 942 . 7 1 1 A 87 87 VAL H H 87 8.790 9.249 -0.459 1
1 943 . 7 1 1 A 87 87 VAL HA H 87 5.010 5.053 -0.043 1
1 951 . 7 1 1 A 87 87 VAL C C 87 175.500 174.626 0.874 1
1 952 . 7 1 1 A 87 87 VAL CA C 87 61.900 61.013 0.887 1
1 953 . 7 1 1 A 87 87 VAL CB C 87 36.300 33.841 2.459 1
1 956 . 7 1 1 A 87 87 VAL N N 87 125.700 129.025 -3.325 1
1 957 . 7 1 1 A 88 88 THR H H 88 8.350 8.874 -0.524 1
1 958 . 7 1 1 A 88 88 THR HA H 88 4.620 4.615 0.005 1
1 964 . 7 1 1 A 88 88 THR C C 88 173.300 172.367 0.933 1
1 965 . 7 1 1 A 88 88 THR CA C 88 61.700 60.828 0.872 1
1 966 . 7 1 1 A 88 88 THR CB C 88 70.400 72.422 -2.022 1
1 968 . 7 1 1 A 88 88 THR N N 88 117.500 121.424 -3.924 1
1 969 . 7 1 1 A 89 89 ASP H H 89 7.700 8.581 -0.881 1
1 970 . 7 1 1 A 89 89 ASP HA H 89 4.480 4.527 -0.047 1
1 973 . 7 1 1 A 89 89 ASP C C 89 175.900 177.060 -1.160 1
1 974 . 7 1 1 A 89 89 ASP CA C 89 55.900 54.515 1.385 1
1 975 . 7 1 1 A 89 89 ASP CB C 89 43.900 41.858 2.042 1
1 976 . 7 1 1 A 89 89 ASP N N 89 120.800 125.704 -4.904 1
1 977 . 7 1 1 A 90 90 TYR H H 90 8.240 8.559 -0.319 1
1 978 . 7 1 1 A 90 90 TYR HA H 90 3.920 4.105 -0.185 1
1 983 . 7 1 1 A 90 90 TYR C C 90 176.400 177.626 -1.226 1
1 984 . 7 1 1 A 90 90 TYR CA C 90 62.300 60.892 1.408 1
1 985 . 7 1 1 A 90 90 TYR CB C 90 39.500 39.009 0.491 1
1 988 . 7 1 1 A 90 90 TYR N N 90 126.100 128.261 -2.161 1
1 989 . 7 1 1 A 91 91 SER H H 91 9.160 7.906 1.254 1
1 990 . 7 1 1 A 91 91 SER HA H 91 4.000 4.094 -0.094 1
1 993 . 7 1 1 A 91 91 SER C C 91 178.000 177.331 0.669 1
1 994 . 7 1 1 A 91 91 SER CA C 91 62.600 61.480 1.120 1
1 995 . 7 1 1 A 91 91 SER CB C 91 62.200 62.714 -0.514 1
1 996 . 7 1 1 A 91 91 SER N N 91 116.600 114.816 1.784 1
1 997 . 7 1 1 A 92 92 GLU H H 92 8.590 8.017 0.573 1
1 998 . 7 1 1 A 92 92 GLU HA H 92 4.050 4.002 0.048 1
1 1003 . 7 1 1 A 92 92 GLU C C 92 179.400 178.831 0.569 1
1 1004 . 7 1 1 A 92 92 GLU CA C 92 58.900 59.464 -0.564 1
1 1005 . 7 1 1 A 92 92 GLU CB C 92 30.600 29.124 1.476 1
1 1007 . 7 1 1 A 92 92 GLU N N 92 120.200 121.509 -1.309 1
1 1008 . 7 1 1 A 93 93 PHE H H 93 7.870 8.028 -0.158 1
1 1009 . 7 1 1 A 93 93 PHE HA H 93 4.050 4.010 0.040 1
1 1015 . 7 1 1 A 93 93 PHE C C 93 176.500 177.994 -1.494 1
1 1016 . 7 1 1 A 93 93 PHE CA C 93 62.200 61.254 0.946 1
1 1017 . 7 1 1 A 93 93 PHE CB C 93 39.700 39.003 0.697 1
1 1021 . 7 1 1 A 93 93 PHE N N 93 120.200 120.813 -0.613 1
1 1022 . 7 1 1 A 94 94 GLN H H 94 8.190 8.173 0.017 1
1 1023 . 7 1 1 A 94 94 GLN HA H 94 3.390 3.462 -0.072 1
1 1030 . 7 1 1 A 94 94 GLN C C 94 178.600 178.352 0.248 1
1 1031 . 7 1 1 A 94 94 GLN CA C 94 58.800 59.168 -0.368 1
1 1032 . 7 1 1 A 94 94 GLN CB C 94 28.400 28.282 0.118 1
1 1034 . 7 1 1 A 94 94 GLN N N 94 116.800 118.001 -1.201 1
1 1036 . 7 1 1 A 95 95 LYS H H 95 7.060 7.587 -0.527 1
1 1037 . 7 1 1 A 95 95 LYS HA H 95 3.780 3.969 -0.189 1
1 1046 . 7 1 1 A 95 95 LYS C C 95 179.300 179.318 -0.018 1
1 1047 . 7 1 1 A 95 95 LYS CA C 95 59.900 59.091 0.809 1
1 1048 . 7 1 1 A 95 95 LYS CB C 95 32.700 32.357 0.343 1
1 1052 . 7 1 1 A 95 95 LYS N N 95 117.500 119.365 -1.865 1
1 1053 . 7 1 1 A 96 96 ILE H H 96 7.240 7.527 -0.287 1
1 1054 . 7 1 1 A 96 96 ILE HA H 96 3.420 3.492 -0.072 1
1 1064 . 7 1 1 A 96 96 ILE C C 96 177.800 178.078 -0.278 1
1 1065 . 7 1 1 A 96 96 ILE CA C 96 64.300 65.212 -0.912 1
1 1066 . 7 1 1 A 96 96 ILE CB C 96 37.400 37.090 0.310 1
1 1070 . 7 1 1 A 96 96 ILE N N 96 120.700 120.476 0.224 1
1 1071 . 7 1 1 A 97 97 LEU H H 97 7.690 7.900 -0.210 1
1 1072 . 7 1 1 A 97 97 LEU HA H 97 3.580 3.657 -0.077 1
1 1082 . 7 1 1 A 97 97 LEU C C 97 179.900 178.953 0.947 1
1 1083 . 7 1 1 A 97 97 LEU CA C 97 58.100 58.025 0.075 1
1 1084 . 7 1 1 A 97 97 LEU CB C 97 41.500 41.308 0.192 1
1 1088 . 7 1 1 A 97 97 LEU N N 97 120.000 120.402 -0.402 1
1 1089 . 7 1 1 A 98 98 LYS H H 98 7.510 7.994 -0.484 1
1 1090 . 7 1 1 A 98 98 LYS HA H 98 3.950 3.988 -0.038 1
1 1099 . 7 1 1 A 98 98 LYS C C 98 178.700 179.158 -0.458 1
1 1100 . 7 1 1 A 98 98 LYS CA C 98 58.700 59.615 -0.915 1
1 1101 . 7 1 1 A 98 98 LYS CB C 98 32.500 32.162 0.338 1
1 1105 . 7 1 1 A 98 98 LYS N N 98 117.300 117.929 -0.629 1
1 1106 . 7 1 1 A 99 99 LYS H H 99 7.470 8.348 -0.878 1
1 1107 . 7 1 1 A 99 99 LYS HA H 99 4.080 3.925 0.155 1
1 1116 . 7 1 1 A 99 99 LYS C C 99 178.100 178.681 -0.581 1
1 1117 . 7 1 1 A 99 99 LYS CA C 99 58.400 59.613 -1.213 1
1 1118 . 7 1 1 A 99 99 LYS CB C 99 33.000 32.345 0.655 1
1 1122 . 7 1 1 A 99 99 LYS N N 99 119.000 120.633 -1.633 1
1 1123 . 7 1 1 A 100 100 ARG H H 100 8.020 7.771 0.249 1
1 1124 . 7 1 1 A 100 100 ARG HA H 100 4.210 4.312 -0.102 1
1 1131 . 7 1 1 A 100 100 ARG C C 100 177.500 176.679 0.821 1
1 1132 . 7 1 1 A 100 100 ARG CA C 100 56.700 55.817 0.883 1
1 1133 . 7 1 1 A 100 100 ARG CB C 100 30.500 30.874 -0.374 1
1 1136 . 7 1 1 A 100 100 ARG N N 100 117.300 115.819 1.481 1
1 1137 . 7 1 1 A 101 101 GLY H H 101 7.910 7.732 0.178 1
1 1138 . 7 1 1 A 101 101 GLY HA2 H 101 3.980 3.915 0.065 1
1 1139 . 7 1 1 A 101 101 GLY HA3 H 101 4.020 3.924 0.096 1
1 1140 . 7 1 1 A 101 101 GLY C C 101 174.400 175.050 -0.650 1
1 1141 . 7 1 1 A 101 101 GLY CA C 101 46.000 46.343 -0.343 1
1 1142 . 7 1 1 A 101 101 GLY N N 101 108.000 108.969 -0.969 1
1 1143 . 7 1 1 A 102 102 THR H H 102 7.880 8.088 -0.208 1
1 1144 . 7 1 1 A 102 102 THR HA H 102 4.360 4.171 0.189 1
1 1149 . 7 1 1 A 102 102 THR C C 102 174.400 174.083 0.317 1
1 1150 . 7 1 1 A 102 102 THR CA C 102 62.100 63.681 -1.581 1
1 1151 . 7 1 1 A 102 102 THR CB C 102 70.500 69.430 1.070 1
1 1153 . 7 1 1 A 102 102 THR N N 102 113.900 116.170 -2.270 1
1 1154 . 7 1 1 A 103 103 LYS H H 103 8.440 8.504 -0.064 1
1 1155 . 7 1 1 A 103 103 LYS C C 103 176.400 175.417 0.983 1
1 1156 . 7 1 1 A 103 103 LYS CA C 103 56.600 56.349 0.251 1
1 1157 . 7 1 1 A 103 103 LYS CB C 103 33.300 32.980 0.320 1
1 1158 . 7 1 1 A 103 103 LYS N N 103 124.000 127.537 -3.537 1
1 1159 . 7 1 1 A 104 104 LEU H H 104 8.180 8.830 -0.650 1
1 1160 . 7 1 1 A 104 104 LEU HA H 104 4.270 4.574 -0.304 1
1 1170 . 7 1 1 A 104 104 LEU C C 104 177.100 176.666 0.434 1
1 1171 . 7 1 1 A 104 104 LEU CA C 104 55.500 53.960 1.540 1
1 1172 . 7 1 1 A 104 104 LEU CB C 104 42.500 42.292 0.208 1
1 1176 . 7 1 1 A 104 104 LEU N N 104 123.500 126.959 -3.459 1
1 1177 . 7 1 1 A 105 105 GLU H H 105 8.270 8.524 -0.254 1
1 1178 . 7 1 1 A 105 105 GLU CA C 105 56.700 56.201 0.499 1
1 1179 . 7 1 1 A 105 105 GLU CB C 105 30.800 29.845 0.955 1
1 13 . 8 1 1 A 2 2 ASN HA H 2 4.980 5.139 -0.159 1
1 18 . 8 1 1 A 2 2 ASN C C 2 176.300 175.809 0.491 1
1 19 . 8 1 1 A 2 2 ASN CA C 2 52.500 51.267 1.233 1
1 20 . 8 1 1 A 2 2 ASN CB C 2 40.900 42.129 -1.229 1
1 22 . 8 1 1 A 3 3 SER H H 3 9.940 8.443 1.497 1
1 23 . 8 1 1 A 3 3 SER HA H 3 3.720 4.163 -0.443 1
1 26 . 8 1 1 A 3 3 SER C C 3 175.900 176.818 -0.918 1
1 27 . 8 1 1 A 3 3 SER CA C 3 63.300 61.482 1.818 1
1 28 . 8 1 1 A 3 3 SER CB C 3 61.700 62.611 -0.911 1
1 29 . 8 1 1 A 3 3 SER N N 3 118.200 116.393 1.807 1
1 30 . 8 1 1 A 4 4 GLU H H 4 8.450 8.114 0.336 1
1 31 . 8 1 1 A 4 4 GLU HA H 4 4.010 4.046 -0.036 1
1 36 . 8 1 1 A 4 4 GLU C C 4 178.800 179.081 -0.281 1
1 37 . 8 1 1 A 4 4 GLU CA C 4 60.300 59.041 1.259 1
1 38 . 8 1 1 A 4 4 GLU CB C 4 29.100 29.537 -0.437 1
1 40 . 8 1 1 A 4 4 GLU N N 4 123.600 122.620 0.980 1
1 41 . 8 1 1 A 5 5 VAL H H 5 7.590 7.889 -0.299 1
1 42 . 8 1 1 A 5 5 VAL HA H 5 3.850 3.641 0.209 1
1 50 . 8 1 1 A 5 5 VAL C C 5 179.100 178.395 0.705 1
1 51 . 8 1 1 A 5 5 VAL CA C 5 65.800 66.649 -0.849 1
1 52 . 8 1 1 A 5 5 VAL CB C 5 32.300 31.425 0.875 1
1 55 . 8 1 1 A 5 5 VAL N N 5 119.300 119.974 -0.674 1
1 56 . 8 1 1 A 6 6 ILE H H 6 7.240 8.142 -0.902 1
1 57 . 8 1 1 A 6 6 ILE HA H 6 3.580 3.443 0.137 1
1 67 . 8 1 1 A 6 6 ILE C C 6 177.000 177.935 -0.935 1
1 68 . 8 1 1 A 6 6 ILE CA C 6 65.300 65.582 -0.282 1
1 69 . 8 1 1 A 6 6 ILE CB C 6 37.900 37.797 0.103 1
1 73 . 8 1 1 A 6 6 ILE N N 6 120.300 120.705 -0.405 1
1 74 . 8 1 1 A 7 7 LYS H H 7 8.050 8.269 -0.219 1
1 75 . 8 1 1 A 7 7 LYS HA H 7 3.570 3.467 0.103 1
1 84 . 8 1 1 A 7 7 LYS C C 7 178.700 179.457 -0.757 1
1 85 . 8 1 1 A 7 7 LYS CA C 7 61.300 60.488 0.812 1
1 86 . 8 1 1 A 7 7 LYS CB C 7 32.200 32.142 0.058 1
1 90 . 8 1 1 A 7 7 LYS N N 7 119.200 119.014 0.186 1
1 91 . 8 1 1 A 8 8 GLU H H 8 8.100 8.217 -0.117 1
1 92 . 8 1 1 A 8 8 GLU HA H 8 4.000 4.115 -0.115 1
1 97 . 8 1 1 A 8 8 GLU C C 8 178.500 178.946 -0.446 1
1 98 . 8 1 1 A 8 8 GLU CA C 8 59.700 58.926 0.774 1
1 99 . 8 1 1 A 8 8 GLU CB C 8 29.600 29.469 0.131 1
1 101 . 8 1 1 A 8 8 GLU N N 8 119.400 119.311 0.089 1
1 102 . 8 1 1 A 9 9 PHE H H 9 7.720 8.284 -0.564 1
1 103 . 8 1 1 A 9 9 PHE HA H 9 4.160 4.082 0.078 1
1 109 . 8 1 1 A 9 9 PHE C C 9 176.900 176.682 0.218 1
1 110 . 8 1 1 A 9 9 PHE CA C 9 61.300 61.246 0.054 1
1 111 . 8 1 1 A 9 9 PHE CB C 9 39.400 39.037 0.363 1
1 115 . 8 1 1 A 9 9 PHE N N 9 121.300 122.681 -1.381 1
1 116 . 8 1 1 A 10 10 LEU H H 10 8.060 8.301 -0.241 1
1 117 . 8 1 1 A 10 10 LEU HA H 10 3.660 3.728 -0.068 1
1 127 . 8 1 1 A 10 10 LEU C C 10 179.000 179.284 -0.284 1
1 128 . 8 1 1 A 10 10 LEU CA C 10 58.000 57.576 0.424 1
1 129 . 8 1 1 A 10 10 LEU CB C 10 41.400 41.172 0.228 1
1 133 . 8 1 1 A 10 10 LEU N N 10 118.000 118.242 -0.242 1
1 134 . 8 1 1 A 11 11 GLU H H 11 7.990 8.648 -0.658 1
1 135 . 8 1 1 A 11 11 GLU HA H 11 4.110 4.044 0.066 1
1 140 . 8 1 1 A 11 11 GLU C C 11 174.200 178.186 -3.986 1
1 141 . 8 1 1 A 11 11 GLU CA C 11 59.200 59.313 -0.113 1
1 142 . 8 1 1 A 11 11 GLU CB C 11 29.300 29.146 0.154 1
1 144 . 8 1 1 A 11 11 GLU N N 11 118.300 120.920 -2.620 1
1 145 . 8 1 1 A 12 12 ASP H H 12 8.080 7.969 0.111 1
1 146 . 8 1 1 A 12 12 ASP HA H 12 4.340 4.338 0.002 1
1 149 . 8 1 1 A 12 12 ASP C C 12 178.900 178.402 0.498 1
1 150 . 8 1 1 A 12 12 ASP CA C 12 57.600 57.639 -0.039 1
1 151 . 8 1 1 A 12 12 ASP CB C 12 41.000 41.450 -0.450 1
1 152 . 8 1 1 A 12 12 ASP N N 12 121.800 120.070 1.730 1
1 153 . 8 1 1 A 13 13 ILE H H 13 7.610 7.167 0.443 1
1 154 . 8 1 1 A 13 13 ILE HA H 13 4.240 4.062 0.178 1
1 164 . 8 1 1 A 13 13 ILE C C 13 176.800 177.014 -0.214 1
1 165 . 8 1 1 A 13 13 ILE CA C 13 62.100 61.388 0.712 1
1 166 . 8 1 1 A 13 13 ILE CB C 13 38.300 38.254 0.046 1
1 170 . 8 1 1 A 13 13 ILE N N 13 110.800 112.979 -2.179 1
1 171 . 8 1 1 A 14 14 GLY H H 14 7.640 7.958 -0.318 1
1 172 . 8 1 1 A 14 14 GLY HA2 H 14 3.810 3.947 -0.137 1
1 173 . 8 1 1 A 14 14 GLY HA3 H 14 3.880 3.963 -0.083 1
1 174 . 8 1 1 A 14 14 GLY C C 14 175.200 174.493 0.707 1
1 175 . 8 1 1 A 14 14 GLY CA C 14 46.900 46.432 0.468 1
1 176 . 8 1 1 A 14 14 GLY N N 14 111.800 112.496 -0.696 1
1 177 . 8 1 1 A 15 15 GLU H H 15 7.870 8.157 -0.287 1
1 178 . 8 1 1 A 15 15 GLU HA H 15 4.680 4.708 -0.028 1
1 183 . 8 1 1 A 15 15 GLU C C 15 175.100 175.352 -0.252 1
1 184 . 8 1 1 A 15 15 GLU CA C 15 54.800 55.264 -0.464 1
1 185 . 8 1 1 A 15 15 GLU CB C 15 32.200 31.588 0.612 1
1 187 . 8 1 1 A 15 15 GLU N N 15 119.200 119.190 0.010 1
1 188 . 8 1 1 A 16 16 ASP H H 16 8.220 8.714 -0.494 1
1 189 . 8 1 1 A 16 16 ASP HA H 16 4.680 5.080 -0.400 1
1 192 . 8 1 1 A 16 16 ASP C C 16 174.600 175.431 -0.831 1
1 193 . 8 1 1 A 16 16 ASP CA C 16 53.600 52.913 0.687 1
1 194 . 8 1 1 A 16 16 ASP CB C 16 42.900 42.829 0.071 1
1 195 . 8 1 1 A 16 16 ASP N N 16 120.600 120.059 0.541 1
1 196 . 8 1 1 A 17 17 TYR H H 17 7.540 8.689 -1.149 1
1 197 . 8 1 1 A 17 17 TYR HA H 17 4.910 5.665 -0.755 1
1 202 . 8 1 1 A 17 17 TYR C C 17 173.600 173.391 0.209 1
1 203 . 8 1 1 A 17 17 TYR CA C 17 56.200 55.605 0.595 1
1 204 . 8 1 1 A 17 17 TYR CB C 17 41.100 41.184 -0.084 1
1 207 . 8 1 1 A 17 17 TYR N N 17 112.700 118.702 -6.002 1
1 208 . 8 1 1 A 18 18 ILE H H 18 7.950 9.172 -1.222 1
1 209 . 8 1 1 A 18 18 ILE HA H 18 4.330 4.504 -0.174 1
1 219 . 8 1 1 A 18 18 ILE C C 18 174.700 174.592 0.108 1
1 220 . 8 1 1 A 18 18 ILE CA C 18 60.300 61.358 -1.058 1
1 221 . 8 1 1 A 18 18 ILE CB C 18 41.000 36.840 4.160 1
1 225 . 8 1 1 A 18 18 ILE N N 18 120.400 125.694 -5.294 1
1 226 . 8 1 1 A 19 19 GLU H H 19 8.760 9.036 -0.276 1
1 227 . 8 1 1 A 19 19 GLU HA H 19 5.200 5.407 -0.207 1
1 232 . 8 1 1 A 19 19 GLU C C 19 175.200 176.055 -0.855 1
1 233 . 8 1 1 A 19 19 GLU CA C 19 55.500 55.256 0.244 1
1 234 . 8 1 1 A 19 19 GLU CB C 19 32.400 31.210 1.190 1
1 236 . 8 1 1 A 19 19 GLU N N 19 129.000 128.785 0.215 1
1 237 . 8 1 1 A 20 20 LEU H H 20 8.730 9.009 -0.279 1
1 238 . 8 1 1 A 20 20 LEU HA H 20 4.620 4.526 0.094 1
1 248 . 8 1 1 A 20 20 LEU C C 20 176.200 177.094 -0.894 1
1 249 . 8 1 1 A 20 20 LEU CA C 20 54.100 54.266 -0.166 1
1 250 . 8 1 1 A 20 20 LEU CB C 20 44.400 42.337 2.063 1
1 254 . 8 1 1 A 20 20 LEU N N 20 128.400 128.069 0.331 1
1 255 . 8 1 1 A 21 21 GLU H H 21 8.700 8.612 0.088 1
1 256 . 8 1 1 A 21 21 GLU HA H 21 3.870 4.090 -0.220 1
1 261 . 8 1 1 A 21 21 GLU C C 21 176.100 176.833 -0.733 1
1 262 . 8 1 1 A 21 21 GLU CA C 21 58.800 56.964 1.836 1
1 263 . 8 1 1 A 21 21 GLU CB C 21 28.200 29.313 -1.113 1
1 265 . 8 1 1 A 21 21 GLU N N 21 122.600 119.975 2.625 1
1 266 . 8 1 1 A 22 22 ASN H H 22 8.640 8.581 0.059 1
1 267 . 8 1 1 A 22 22 ASN HA H 22 4.540 4.339 0.201 1
1 272 . 8 1 1 A 22 22 ASN C C 22 173.800 173.780 0.020 1
1 273 . 8 1 1 A 22 22 ASN CA C 22 54.600 54.560 0.040 1
1 274 . 8 1 1 A 22 22 ASN CB C 22 38.400 36.804 1.596 1
1 275 . 8 1 1 A 22 22 ASN N N 22 118.000 120.835 -2.835 1
1 277 . 8 1 1 A 23 23 GLU H H 23 7.740 7.473 0.267 1
1 278 . 8 1 1 A 23 23 GLU HA H 23 5.430 5.293 0.137 1
1 283 . 8 1 1 A 23 23 GLU C C 23 175.400 175.175 0.225 1
1 284 . 8 1 1 A 23 23 GLU CA C 23 54.900 55.074 -0.174 1
1 285 . 8 1 1 A 23 23 GLU CB C 23 34.500 32.225 2.275 1
1 287 . 8 1 1 A 23 23 GLU N N 23 116.400 116.896 -0.496 1
1 288 . 8 1 1 A 24 24 ILE H H 24 9.050 9.284 -0.234 1
1 289 . 8 1 1 A 24 24 ILE HA H 24 4.810 4.727 0.083 1
1 299 . 8 1 1 A 24 24 ILE C C 24 174.600 174.918 -0.318 1
1 300 . 8 1 1 A 24 24 ILE CA C 24 60.700 60.306 0.394 1
1 301 . 8 1 1 A 24 24 ILE CB C 24 41.300 38.499 2.801 1
1 305 . 8 1 1 A 24 24 ILE N N 24 122.800 125.851 -3.051 1
1 306 . 8 1 1 A 25 25 HIS H H 25 9.490 9.699 -0.209 1
1 307 . 8 1 1 A 25 25 HIS HA H 25 5.090 5.709 -0.619 1
1 312 . 8 1 1 A 25 25 HIS C C 25 176.100 174.844 1.256 1
1 313 . 8 1 1 A 25 25 HIS CA C 25 56.100 55.104 0.996 1
1 314 . 8 1 1 A 25 25 HIS CB C 25 33.100 31.481 1.619 1
1 317 . 8 1 1 A 25 25 HIS N N 25 127.300 126.516 0.784 1
1 318 . 8 1 1 A 26 26 LEU H H 26 8.820 8.547 0.273 1
1 319 . 8 1 1 A 26 26 LEU HA H 26 5.160 4.945 0.215 1
1 329 . 8 1 1 A 26 26 LEU C C 26 178.000 176.189 1.811 1
1 330 . 8 1 1 A 26 26 LEU CA C 26 52.900 53.440 -0.540 1
1 331 . 8 1 1 A 26 26 LEU CB C 26 48.100 43.586 4.514 1
1 335 . 8 1 1 A 26 26 LEU N N 26 121.600 125.141 -3.541 1
1 336 . 8 1 1 A 27 27 LYS H H 27 8.990 8.740 0.250 1
1 337 . 8 1 1 A 27 27 LYS HA H 27 4.630 4.567 0.063 1
1 345 . 8 1 1 A 27 27 LYS CA C 27 55.700 54.540 1.160 1
1 346 . 8 1 1 A 27 27 LYS CB C 27 31.900 32.131 -0.231 1
1 350 . 8 1 1 A 27 27 LYS N N 27 125.900 120.874 5.026 1
1 351 . 8 1 1 A 28 28 PRO HA H 28 4.500 4.504 -0.004 1
1 358 . 8 1 1 A 28 28 PRO C C 28 177.900 178.317 -0.417 1
1 359 . 8 1 1 A 28 28 PRO CA C 28 67.400 66.034 1.366 1
1 360 . 8 1 1 A 28 28 PRO CB C 28 32.100 31.788 0.312 1
1 363 . 8 1 1 A 29 29 GLU H H 29 9.880 8.319 1.561 1
1 364 . 8 1 1 A 29 29 GLU HA H 29 4.140 4.409 -0.269 1
1 369 . 8 1 1 A 29 29 GLU C C 29 178.800 179.504 -0.704 1
1 370 . 8 1 1 A 29 29 GLU CA C 29 60.600 59.835 0.765 1
1 371 . 8 1 1 A 29 29 GLU CB C 29 29.200 29.408 -0.208 1
1 373 . 8 1 1 A 29 29 GLU N N 29 117.100 118.387 -1.287 1
1 374 . 8 1 1 A 30 30 VAL H H 30 7.050 7.700 -0.650 1
1 375 . 8 1 1 A 30 30 VAL HA H 30 3.850 3.793 0.057 1
1 383 . 8 1 1 A 30 30 VAL C C 30 177.700 178.336 -0.636 1
1 384 . 8 1 1 A 30 30 VAL CA C 30 65.600 66.579 -0.979 1
1 385 . 8 1 1 A 30 30 VAL CB C 30 32.100 31.864 0.236 1
1 388 . 8 1 1 A 30 30 VAL N N 30 120.900 120.204 0.696 1
1 389 . 8 1 1 A 31 31 PHE H H 31 8.980 9.030 -0.050 1
1 390 . 8 1 1 A 31 31 PHE HA H 31 3.870 4.270 -0.400 1
1 394 . 8 1 1 A 31 31 PHE C C 31 176.700 177.311 -0.611 1
1 395 . 8 1 1 A 31 31 PHE CA C 31 62.200 61.884 0.316 1
1 396 . 8 1 1 A 31 31 PHE CB C 31 39.300 39.149 0.151 1
1 398 . 8 1 1 A 31 31 PHE N N 31 121.100 120.295 0.805 1
1 399 . 8 1 1 A 32 32 TYR H H 32 8.640 8.578 0.062 1
1 400 . 8 1 1 A 32 32 TYR HA H 32 3.880 4.610 -0.730 1
1 405 . 8 1 1 A 32 32 TYR C C 32 176.000 178.422 -2.422 1
1 406 . 8 1 1 A 32 32 TYR CA C 32 63.300 62.120 1.180 1
1 407 . 8 1 1 A 32 32 TYR CB C 32 39.100 39.155 -0.055 1
1 410 . 8 1 1 A 32 32 TYR N N 32 117.400 120.761 -3.361 1
1 411 . 8 1 1 A 33 33 GLU H H 33 7.400 8.100 -0.700 1
1 412 . 8 1 1 A 33 33 GLU HA H 33 4.050 4.077 -0.027 1
1 417 . 8 1 1 A 33 33 GLU C C 33 180.200 179.226 0.974 1
1 418 . 8 1 1 A 33 33 GLU CA C 33 59.500 58.913 0.587 1
1 419 . 8 1 1 A 33 33 GLU CB C 33 29.300 29.532 -0.232 1
1 421 . 8 1 1 A 33 33 GLU N N 33 116.100 118.737 -2.637 1
1 422 . 8 1 1 A 34 34 VAL H H 34 8.530 7.636 0.894 1
1 423 . 8 1 1 A 34 34 VAL HA H 34 3.350 3.440 -0.090 1
1 431 . 8 1 1 A 34 34 VAL C C 34 175.800 178.000 -2.200 1
1 432 . 8 1 1 A 34 34 VAL CA C 34 66.400 66.058 0.342 1
1 433 . 8 1 1 A 34 34 VAL CB C 34 32.200 31.558 0.642 1
1 436 . 8 1 1 A 34 34 VAL N N 34 120.600 120.377 0.223 1
1 437 . 8 1 1 A 35 35 TRP H H 35 9.100 8.436 0.664 1
1 438 . 8 1 1 A 35 35 TRP HA H 35 3.340 3.875 -0.535 1
1 447 . 8 1 1 A 35 35 TRP C C 35 178.000 178.591 -0.591 1
1 448 . 8 1 1 A 35 35 TRP CA C 35 61.800 59.883 1.917 1
1 449 . 8 1 1 A 35 35 TRP CB C 35 27.900 29.716 -1.816 1
1 455 . 8 1 1 A 35 35 TRP N N 35 121.700 121.700 0.000 1
1 457 . 8 1 1 A 36 36 LYS H H 36 7.970 7.604 0.366 1
1 458 . 8 1 1 A 36 36 LYS HA H 36 3.330 3.587 -0.257 1
1 467 . 8 1 1 A 36 36 LYS C C 36 180.000 178.378 1.622 1
1 468 . 8 1 1 A 36 36 LYS CA C 36 59.000 58.982 0.018 1
1 469 . 8 1 1 A 36 36 LYS CB C 36 31.800 32.248 -0.448 1
1 473 . 8 1 1 A 36 36 LYS N N 36 116.300 118.558 -2.258 1
1 474 . 8 1 1 A 37 37 TYR H H 37 7.750 8.037 -0.287 1
1 475 . 8 1 1 A 37 37 TYR HA H 37 3.940 3.906 0.034 1
1 480 . 8 1 1 A 37 37 TYR C C 37 177.600 177.712 -0.112 1
1 481 . 8 1 1 A 37 37 TYR CA C 37 61.200 61.026 0.174 1
1 482 . 8 1 1 A 37 37 TYR CB C 37 38.800 38.475 0.325 1
1 485 . 8 1 1 A 37 37 TYR N N 37 122.700 121.092 1.608 1
1 486 . 8 1 1 A 38 38 VAL H H 38 7.660 7.614 0.046 1
1 487 . 8 1 1 A 38 38 VAL HA H 38 3.870 4.082 -0.212 1
1 495 . 8 1 1 A 38 38 VAL C C 38 175.600 175.998 -0.398 1
1 496 . 8 1 1 A 38 38 VAL CA C 38 61.100 61.736 -0.636 1
1 497 . 8 1 1 A 38 38 VAL CB C 38 30.700 31.339 -0.639 1
1 500 . 8 1 1 A 38 38 VAL N N 38 108.200 112.984 -4.784 1
1 501 . 8 1 1 A 39 39 GLY H H 39 7.090 7.761 -0.671 1
1 502 . 8 1 1 A 39 39 GLY HA2 H 39 3.320 3.729 -0.409 1
1 503 . 8 1 1 A 39 39 GLY HA3 H 39 3.730 3.763 -0.033 1
1 504 . 8 1 1 A 39 39 GLY C C 39 173.600 174.464 -0.864 1
1 505 . 8 1 1 A 39 39 GLY CA C 39 46.100 45.091 1.009 1
1 506 . 8 1 1 A 39 39 GLY N N 39 107.600 110.313 -2.713 1
1 507 . 8 1 1 A 40 40 GLU H H 40 7.730 7.930 -0.200 1
1 508 . 8 1 1 A 40 40 GLU HA H 40 1.090 2.914 -1.824 1
1 513 . 8 1 1 A 40 40 GLU CA C 40 55.700 56.736 -1.036 1
1 514 . 8 1 1 A 40 40 GLU CB C 40 27.200 27.741 -0.541 1
1 516 . 8 1 1 A 40 40 GLU N N 40 114.400 119.035 -4.635 1
1 517 . 8 1 1 A 41 41 PRO HA H 41 4.310 4.650 -0.340 1
1 524 . 8 1 1 A 41 41 PRO CA C 41 62.300 62.205 0.095 1
1 525 . 8 1 1 A 41 41 PRO CB C 41 32.700 32.563 0.137 1
1 528 . 8 1 1 A 42 42 GLU H H 42 8.110 8.657 -0.547 1
1 529 . 8 1 1 A 42 42 GLU C C 42 175.800 176.491 -0.691 1
1 530 . 8 1 1 A 42 42 GLU CA C 42 57.800 56.981 0.819 1
1 531 . 8 1 1 A 42 42 GLU CB C 42 30.600 30.593 0.007 1
1 533 . 8 1 1 A 42 42 GLU N N 42 119.100 121.003 -1.903 1
1 534 . 8 1 1 A 43 43 LEU H H 43 8.140 8.798 -0.658 1
1 535 . 8 1 1 A 43 43 LEU HA H 43 4.840 5.248 -0.408 1
1 545 . 8 1 1 A 43 43 LEU C C 43 177.300 175.592 1.708 1
1 546 . 8 1 1 A 43 43 LEU CA C 43 53.700 53.277 0.423 1
1 547 . 8 1 1 A 43 43 LEU CB C 43 43.900 45.172 -1.272 1
1 551 . 8 1 1 A 43 43 LEU N N 43 124.700 124.092 0.608 1
1 552 . 8 1 1 A 44 44 LYS H H 44 8.640 8.648 -0.008 1
1 553 . 8 1 1 A 44 44 LYS HA H 44 4.500 4.977 -0.477 1
1 562 . 8 1 1 A 44 44 LYS C C 44 174.500 176.038 -1.538 1
1 563 . 8 1 1 A 44 44 LYS CA C 44 54.700 54.905 -0.205 1
1 564 . 8 1 1 A 44 44 LYS CB C 44 36.200 34.705 1.495 1
1 568 . 8 1 1 A 44 44 LYS N N 44 123.300 121.077 2.223 1
1 569 . 8 1 1 A 45 45 THR H H 45 7.990 8.847 -0.857 1
1 570 . 8 1 1 A 45 45 THR HA H 45 5.700 5.711 -0.011 1
1 575 . 8 1 1 A 45 45 THR C C 45 175.100 173.901 1.199 1
1 576 . 8 1 1 A 45 45 THR CA C 45 59.600 59.664 -0.064 1
1 577 . 8 1 1 A 45 45 THR CB C 45 73.400 71.272 2.128 1
1 579 . 8 1 1 A 45 45 THR N N 45 106.900 113.457 -6.557 1
1 580 . 8 1 1 A 46 46 TYR H H 46 8.470 9.094 -0.624 1
1 581 . 8 1 1 A 46 46 TYR HA H 46 4.930 5.661 -0.731 1
1 586 . 8 1 1 A 46 46 TYR C C 46 172.400 173.118 -0.718 1
1 587 . 8 1 1 A 46 46 TYR CA C 46 57.100 55.517 1.583 1
1 588 . 8 1 1 A 46 46 TYR CB C 46 40.200 42.301 -2.101 1
1 591 . 8 1 1 A 46 46 TYR N N 46 117.100 118.931 -1.831 1
1 592 . 8 1 1 A 47 47 VAL H H 47 8.430 9.050 -0.620 1
1 593 . 8 1 1 A 47 47 VAL HA H 47 4.890 4.460 0.430 1
1 601 . 8 1 1 A 47 47 VAL C C 47 175.800 175.491 0.309 1
1 602 . 8 1 1 A 47 47 VAL CA C 47 60.800 61.471 -0.671 1
1 603 . 8 1 1 A 47 47 VAL CB C 47 34.800 32.816 1.984 1
1 606 . 8 1 1 A 47 47 VAL N N 47 119.200 121.465 -2.265 1
1 607 . 8 1 1 A 48 48 ILE H H 48 8.680 9.060 -0.380 1
1 608 . 8 1 1 A 48 48 ILE HA H 48 4.560 4.985 -0.425 1
1 618 . 8 1 1 A 48 48 ILE C C 48 174.500 174.692 -0.192 1
1 619 . 8 1 1 A 48 48 ILE CA C 48 59.700 58.977 0.723 1
1 620 . 8 1 1 A 48 48 ILE CB C 48 41.500 40.002 1.498 1
1 624 . 8 1 1 A 48 48 ILE N N 48 124.400 123.463 0.937 1
1 625 . 8 1 1 A 49 49 GLU H H 49 8.320 9.007 -0.687 1
1 626 . 8 1 1 A 49 49 GLU C C 49 175.500 174.068 1.432 1
1 627 . 8 1 1 A 49 49 GLU CA C 49 55.500 55.191 0.309 1
1 628 . 8 1 1 A 49 49 GLU CB C 49 31.800 30.170 1.630 1
1 630 . 8 1 1 A 49 49 GLU N N 49 123.400 122.867 0.533 1
1 631 . 8 1 1 A 50 50 ASP H H 50 8.610 9.017 -0.407 1
1 632 . 8 1 1 A 50 50 ASP C C 50 175.100 175.308 -0.208 1
1 633 . 8 1 1 A 50 50 ASP CA C 50 53.100 52.787 0.313 1
1 634 . 8 1 1 A 50 50 ASP CB C 50 44.000 42.163 1.837 1
1 635 . 8 1 1 A 50 50 ASP N N 50 124.300 126.375 -2.075 1
1 636 . 8 1 1 A 51 51 GLU H H 51 8.450 8.874 -0.424 1
1 637 . 8 1 1 A 51 51 GLU C C 51 175.900 175.683 0.217 1
1 638 . 8 1 1 A 51 51 GLU CA C 51 56.000 58.148 -2.148 1
1 639 . 8 1 1 A 51 51 GLU CB C 51 31.700 32.200 -0.500 1
1 640 . 8 1 1 A 51 51 GLU N N 51 121.300 127.030 -5.730 1
1 641 . 8 1 1 A 52 52 ILE H H 52 8.480 7.434 1.046 1
1 642 . 8 1 1 A 52 52 ILE C C 52 175.400 173.932 1.468 1
1 643 . 8 1 1 A 52 52 ILE CA C 52 60.400 60.609 -0.209 1
1 644 . 8 1 1 A 52 52 ILE CB C 52 40.000 40.687 -0.687 1
1 645 . 8 1 1 A 52 52 ILE N N 52 122.700 118.535 4.165 1
1 646 . 8 1 1 A 53 53 VAL H H 53 8.140 8.910 -0.770 1
1 647 . 8 1 1 A 53 53 VAL C C 53 175.600 175.159 0.441 1
1 648 . 8 1 1 A 53 53 VAL CA C 53 61.900 59.472 2.428 1
1 649 . 8 1 1 A 53 53 VAL CB C 53 33.200 34.023 -0.823 1
1 650 . 8 1 1 A 53 53 VAL N N 53 124.400 125.603 -1.203 1
1 651 . 8 1 1 A 54 54 GLU H H 54 8.540 8.527 0.013 1
1 652 . 8 1 1 A 54 54 GLU CA C 54 55.600 54.526 1.074 1
1 653 . 8 1 1 A 54 54 GLU CB C 54 34.300 30.448 3.852 1
1 654 . 8 1 1 A 54 54 GLU N N 54 125.900 121.705 4.195 1
1 655 . 8 1 1 A 55 55 PRO C C 55 177.500 176.398 1.102 1
1 656 . 8 1 1 A 55 55 PRO CA C 55 63.400 62.276 1.124 1
1 657 . 8 1 1 A 55 55 PRO CB C 55 32.300 33.375 -1.075 1
1 658 . 8 1 1 A 56 56 GLY H H 56 8.420 8.343 0.077 1
1 659 . 8 1 1 A 56 56 GLY HA2 H 56 3.830 4.182 -0.352 1
1 660 . 8 1 1 A 56 56 GLY HA3 H 56 4.000 4.189 -0.189 1
1 661 . 8 1 1 A 56 56 GLY C C 56 174.500 175.370 -0.870 1
1 662 . 8 1 1 A 56 56 GLY CA C 56 45.400 45.678 -0.278 1
1 663 . 8 1 1 A 56 56 GLY N N 56 109.700 107.653 2.047 1
1 664 . 8 1 1 A 57 57 GLU H H 57 8.180 7.898 0.282 1
1 665 . 8 1 1 A 57 57 GLU C C 57 176.300 175.896 0.404 1
1 666 . 8 1 1 A 57 57 GLU CA C 57 57.500 58.907 -1.407 1
1 667 . 8 1 1 A 57 57 GLU CB C 57 30.400 29.450 0.950 1
1 668 . 8 1 1 A 57 57 GLU N N 57 120.900 120.178 0.722 1
1 669 . 8 1 1 A 58 58 TYR H H 58 8.020 7.834 0.186 1
1 670 . 8 1 1 A 58 58 TYR C C 58 175.100 174.348 0.752 1
1 671 . 8 1 1 A 58 58 TYR CA C 58 57.400 56.440 0.960 1
1 672 . 8 1 1 A 58 58 TYR CB C 58 38.900 38.776 0.124 1
1 673 . 8 1 1 A 58 58 TYR N N 58 118.800 117.159 1.641 1
1 674 . 8 1 1 A 59 59 ASP H H 59 7.950 9.030 -1.080 1
1 675 . 8 1 1 A 59 59 ASP CA C 59 52.700 51.626 1.074 1
1 676 . 8 1 1 A 59 59 ASP CB C 59 41.000 41.668 -0.668 1
1 677 . 8 1 1 A 59 59 ASP N N 59 123.500 126.564 -3.064 1
1 678 . 8 1 1 A 61 61 PRO HA H 61 4.510 4.551 -0.041 1
1 685 . 8 1 1 A 61 61 PRO C C 61 176.500 176.910 -0.410 1
1 686 . 8 1 1 A 61 61 PRO CA C 61 63.700 62.627 1.073 1
1 687 . 8 1 1 A 61 61 PRO CB C 61 34.200 32.982 1.218 1
1 690 . 8 1 1 A 62 62 GLU H H 62 8.490 8.759 -0.269 1
1 691 . 8 1 1 A 62 62 GLU N N 62 124.600 121.369 3.231 1
1 692 . 8 1 1 A 64 64 LYS C C 64 176.300 174.379 1.921 1
1 693 . 8 1 1 A 64 64 LYS CA C 64 57.000 54.991 2.009 1
1 694 . 8 1 1 A 64 64 LYS CB C 64 33.100 35.631 -2.531 1
1 695 . 8 1 1 A 65 65 TYR H H 65 7.960 8.683 -0.723 1
1 696 . 8 1 1 A 65 65 TYR C C 65 176.000 172.668 3.332 1
1 697 . 8 1 1 A 65 65 TYR CA C 65 57.800 55.759 2.041 1
1 698 . 8 1 1 A 65 65 TYR CB C 65 38.800 41.924 -3.124 1
1 699 . 8 1 1 A 65 65 TYR N N 65 119.300 122.074 -2.774 1
1 700 . 8 1 1 A 66 66 THR H H 66 7.820 8.790 -0.970 1
1 701 . 8 1 1 A 66 66 THR HA H 66 4.280 4.916 -0.636 1
1 706 . 8 1 1 A 66 66 THR C C 66 174.100 173.536 0.564 1
1 707 . 8 1 1 A 66 66 THR CA C 66 62.100 61.483 0.617 1
1 708 . 8 1 1 A 66 66 THR CB C 66 70.000 71.181 -1.181 1
1 710 . 8 1 1 A 66 66 THR N N 66 113.900 115.112 -1.212 1
1 711 . 8 1 1 A 67 67 ASN H H 67 8.270 8.969 -0.699 1
1 712 . 8 1 1 A 67 67 ASN C C 67 174.100 175.265 -1.165 1
1 713 . 8 1 1 A 67 67 ASN CA C 67 53.400 52.596 0.804 1
1 714 . 8 1 1 A 67 67 ASN CB C 67 39.300 38.862 0.438 1
1 715 . 8 1 1 A 67 67 ASN N N 67 121.400 126.891 -5.491 1
1 716 . 8 1 1 A 68 68 VAL H H 68 7.660 8.920 -1.260 1
1 717 . 8 1 1 A 68 68 VAL C C 68 175.500 174.659 0.841 1
1 718 . 8 1 1 A 68 68 VAL CA C 68 61.800 59.531 2.269 1
1 719 . 8 1 1 A 68 68 VAL CB C 68 33.700 35.112 -1.412 1
1 720 . 8 1 1 A 68 68 VAL N N 68 119.400 121.549 -2.149 1
1 721 . 8 1 1 A 69 69 LYS H H 69 8.690 8.399 0.291 1
1 722 . 8 1 1 A 69 69 LYS C C 69 175.200 175.262 -0.062 1
1 723 . 8 1 1 A 69 69 LYS CA C 69 55.200 54.597 0.603 1
1 724 . 8 1 1 A 69 69 LYS CB C 69 35.200 36.063 -0.863 1
1 725 . 8 1 1 A 69 69 LYS N N 69 126.500 120.843 5.657 1
1 726 . 8 1 1 A 70 70 LYS H H 70 8.230 9.033 -0.803 1
1 727 . 8 1 1 A 70 70 LYS C C 70 176.400 174.240 2.160 1
1 728 . 8 1 1 A 70 70 LYS CA C 70 55.600 55.067 0.533 1
1 729 . 8 1 1 A 70 70 LYS CB C 70 33.800 34.187 -0.387 1
1 730 . 8 1 1 A 70 70 LYS N N 70 122.700 123.599 -0.899 1
1 731 . 8 1 1 A 71 71 VAL H H 71 8.530 8.980 -0.450 1
1 732 . 8 1 1 A 71 71 VAL HA H 71 4.510 4.700 -0.190 1
1 733 . 8 1 1 A 71 71 VAL C C 71 174.700 174.356 0.344 1
1 734 . 8 1 1 A 71 71 VAL CA C 71 60.900 60.622 0.278 1
1 735 . 8 1 1 A 71 71 VAL CB C 71 34.800 33.537 1.263 1
1 738 . 8 1 1 A 71 71 VAL N N 71 121.200 125.593 -4.393 1
1 739 . 8 1 1 A 72 72 LYS H H 72 8.210 8.893 -0.683 1
1 740 . 8 1 1 A 72 72 LYS HA H 72 4.800 4.578 0.222 1
1 747 . 8 1 1 A 72 72 LYS C C 72 176.200 175.335 0.865 1
1 748 . 8 1 1 A 72 72 LYS CA C 72 55.700 55.947 -0.247 1
1 749 . 8 1 1 A 72 72 LYS CB C 72 33.700 32.331 1.369 1
1 752 . 8 1 1 A 72 72 LYS N N 72 123.600 127.973 -4.373 1
1 753 . 8 1 1 A 73 73 ILE H H 73 8.890 9.122 -0.232 1
1 754 . 8 1 1 A 73 73 ILE C C 73 174.400 174.320 0.080 1
1 755 . 8 1 1 A 73 73 ILE CA C 73 60.400 60.205 0.195 1
1 756 . 8 1 1 A 73 73 ILE CB C 73 40.800 38.168 2.632 1
1 760 . 8 1 1 A 73 73 ILE N N 73 125.100 125.917 -0.817 1
1 761 . 8 1 1 A 74 74 LYS H H 74 8.420 8.876 -0.456 1
1 762 . 8 1 1 A 74 74 LYS HA H 74 4.800 4.780 0.020 1
1 771 . 8 1 1 A 74 74 LYS C C 74 175.600 175.239 0.361 1
1 772 . 8 1 1 A 74 74 LYS CA C 74 56.200 55.575 0.625 1
1 773 . 8 1 1 A 74 74 LYS CB C 74 34.300 33.481 0.819 1
1 777 . 8 1 1 A 74 74 LYS N N 74 126.400 128.641 -2.241 1
1 778 . 8 1 1 A 75 75 LYS H H 75 9.090 8.807 0.283 1
1 779 . 8 1 1 A 75 75 LYS HA H 75 4.800 4.933 -0.133 1
1 788 . 8 1 1 A 75 75 LYS C C 75 174.900 174.619 0.281 1
1 789 . 8 1 1 A 75 75 LYS CA C 75 53.200 54.417 -1.217 1
1 790 . 8 1 1 A 75 75 LYS CB C 75 34.200 36.168 -1.968 1
1 794 . 8 1 1 A 75 75 LYS N N 75 127.500 125.382 2.118 1
1 795 . 8 1 1 A 76 76 VAL H H 76 8.610 8.919 -0.309 1
1 796 . 8 1 1 A 76 76 VAL HA H 76 5.340 5.401 -0.061 1
1 804 . 8 1 1 A 76 76 VAL C C 76 171.400 173.896 -2.496 1
1 805 . 8 1 1 A 76 76 VAL CA C 76 58.000 59.713 -1.713 1
1 806 . 8 1 1 A 76 76 VAL CB C 76 36.400 35.392 1.008 1
1 809 . 8 1 1 A 76 76 VAL N N 76 120.100 121.110 -1.010 1
1 810 . 8 1 1 A 77 77 TYR H H 77 9.110 9.341 -0.231 1
1 811 . 8 1 1 A 77 77 TYR HA H 77 6.150 5.559 0.591 1
1 816 . 8 1 1 A 77 77 TYR C C 77 173.600 173.321 0.279 1
1 817 . 8 1 1 A 77 77 TYR CA C 77 56.200 55.870 0.330 1
1 818 . 8 1 1 A 77 77 TYR CB C 77 44.000 40.780 3.220 1
1 821 . 8 1 1 A 77 77 TYR N N 77 121.300 121.990 -0.690 1
1 822 . 8 1 1 A 78 78 PHE H H 78 8.190 8.612 -0.422 1
1 823 . 8 1 1 A 78 78 PHE HA H 78 5.130 5.505 -0.375 1
1 829 . 8 1 1 A 78 78 PHE C C 78 173.600 172.674 0.926 1
1 830 . 8 1 1 A 78 78 PHE CA C 78 55.900 55.079 0.821 1
1 831 . 8 1 1 A 78 78 PHE CB C 78 42.500 42.718 -0.218 1
1 835 . 8 1 1 A 78 78 PHE N N 78 112.700 116.754 -4.054 1
1 836 . 8 1 1 A 79 79 GLU H H 79 8.920 8.869 0.051 1
1 837 . 8 1 1 A 79 79 GLU HA H 79 5.390 5.052 0.338 1
1 842 . 8 1 1 A 79 79 GLU C C 79 177.000 177.014 -0.014 1
1 843 . 8 1 1 A 79 79 GLU CA C 79 54.900 55.104 -0.204 1
1 844 . 8 1 1 A 79 79 GLU CB C 79 33.600 32.034 1.566 1
1 846 . 8 1 1 A 79 79 GLU N N 79 120.500 119.535 0.965 1
1 847 . 8 1 1 A 80 80 THR H H 80 8.970 9.169 -0.199 1
1 848 . 8 1 1 A 80 80 THR HA H 80 4.700 4.949 -0.249 1
1 854 . 8 1 1 A 80 80 THR C C 80 177.000 176.388 0.612 1
1 855 . 8 1 1 A 80 80 THR CA C 80 61.300 60.494 0.806 1
1 856 . 8 1 1 A 80 80 THR CB C 80 70.500 71.431 -0.931 1
1 858 . 8 1 1 A 80 80 THR N N 80 113.200 115.840 -2.640 1
1 859 . 8 1 1 A 81 81 LEU H H 81 8.610 8.816 -0.206 1
1 860 . 8 1 1 A 81 81 LEU HA H 81 4.230 4.092 0.138 1
1 870 . 8 1 1 A 81 81 LEU C C 81 177.400 176.744 0.656 1
1 871 . 8 1 1 A 81 81 LEU CA C 81 57.700 57.389 0.311 1
1 872 . 8 1 1 A 81 81 LEU CB C 81 42.400 41.947 0.453 1
1 876 . 8 1 1 A 81 81 LEU N N 81 120.900 119.034 1.866 1
1 877 . 8 1 1 A 82 82 ASP H H 82 8.850 7.984 0.866 1
1 878 . 8 1 1 A 82 82 ASP HA H 82 4.670 4.545 0.125 1
1 881 . 8 1 1 A 82 82 ASP C C 82 174.100 176.552 -2.452 1
1 882 . 8 1 1 A 82 82 ASP CA C 82 52.700 52.992 -0.292 1
1 883 . 8 1 1 A 82 82 ASP CB C 82 37.900 39.526 -1.626 1
1 884 . 8 1 1 A 82 82 ASP N N 82 112.300 118.024 -5.724 1
1 885 . 8 1 1 A 83 83 ASN H H 83 7.790 8.171 -0.381 1
1 886 . 8 1 1 A 83 83 ASN HA H 83 4.270 4.325 -0.055 1
1 891 . 8 1 1 A 83 83 ASN C C 83 176.100 173.842 2.258 1
1 892 . 8 1 1 A 83 83 ASN CA C 83 55.300 54.574 0.726 1
1 893 . 8 1 1 A 83 83 ASN CB C 83 36.900 37.966 -1.066 1
1 894 . 8 1 1 A 83 83 ASN N N 83 113.000 116.205 -3.205 1
1 896 . 8 1 1 A 84 84 VAL H H 84 7.660 7.818 -0.158 1
1 897 . 8 1 1 A 84 84 VAL HA H 84 4.270 4.189 0.081 1
1 905 . 8 1 1 A 84 84 VAL C C 84 175.800 175.128 0.672 1
1 906 . 8 1 1 A 84 84 VAL CA C 84 61.500 61.840 -0.340 1
1 907 . 8 1 1 A 84 84 VAL CB C 84 33.500 32.967 0.533 1
1 910 . 8 1 1 A 84 84 VAL N N 84 119.700 119.302 0.398 1
1 911 . 8 1 1 A 85 85 ARG H H 85 8.180 9.182 -1.002 1
1 912 . 8 1 1 A 85 85 ARG HA H 85 4.870 4.932 -0.062 1
1 920 . 8 1 1 A 85 85 ARG C C 85 174.000 174.958 -0.958 1
1 921 . 8 1 1 A 85 85 ARG CA C 85 55.700 54.962 0.738 1
1 922 . 8 1 1 A 85 85 ARG CB C 85 32.600 31.179 1.421 1
1 925 . 8 1 1 A 85 85 ARG N N 85 124.800 127.177 -2.377 1
1 927 . 8 1 1 A 86 86 VAL H H 86 8.570 8.304 0.266 1
1 928 . 8 1 1 A 86 86 VAL HA H 86 4.580 4.479 0.101 1
1 936 . 8 1 1 A 86 86 VAL C C 86 175.700 174.988 0.712 1
1 937 . 8 1 1 A 86 86 VAL CA C 86 61.700 61.752 -0.052 1
1 938 . 8 1 1 A 86 86 VAL CB C 86 30.900 31.245 -0.345 1
1 941 . 8 1 1 A 86 86 VAL N N 86 127.300 125.452 1.848 1
1 942 . 8 1 1 A 87 87 VAL H H 87 8.790 9.051 -0.261 1
1 943 . 8 1 1 A 87 87 VAL HA H 87 5.010 4.804 0.206 1
1 951 . 8 1 1 A 87 87 VAL C C 87 175.500 174.517 0.983 1
1 952 . 8 1 1 A 87 87 VAL CA C 87 61.900 60.885 1.015 1
1 953 . 8 1 1 A 87 87 VAL CB C 87 36.300 33.395 2.905 1
1 956 . 8 1 1 A 87 87 VAL N N 87 125.700 128.678 -2.978 1
1 957 . 8 1 1 A 88 88 THR H H 88 8.350 8.870 -0.520 1
1 958 . 8 1 1 A 88 88 THR HA H 88 4.620 4.589 0.031 1
1 964 . 8 1 1 A 88 88 THR C C 88 173.300 172.974 0.326 1
1 965 . 8 1 1 A 88 88 THR CA C 88 61.700 60.769 0.931 1
1 966 . 8 1 1 A 88 88 THR CB C 88 70.400 72.093 -1.693 1
1 968 . 8 1 1 A 88 88 THR N N 88 117.500 120.462 -2.962 1
1 969 . 8 1 1 A 89 89 ASP H H 89 7.700 8.565 -0.865 1
1 970 . 8 1 1 A 89 89 ASP HA H 89 4.480 4.646 -0.166 1
1 973 . 8 1 1 A 89 89 ASP C C 89 175.900 176.668 -0.768 1
1 974 . 8 1 1 A 89 89 ASP CA C 89 55.900 54.858 1.042 1
1 975 . 8 1 1 A 89 89 ASP CB C 89 43.900 40.943 2.957 1
1 976 . 8 1 1 A 89 89 ASP N N 89 120.800 123.960 -3.160 1
1 977 . 8 1 1 A 90 90 TYR H H 90 8.240 9.079 -0.839 1
1 978 . 8 1 1 A 90 90 TYR HA H 90 3.920 4.133 -0.213 1
1 983 . 8 1 1 A 90 90 TYR C C 90 176.400 177.515 -1.115 1
1 984 . 8 1 1 A 90 90 TYR CA C 90 62.300 62.531 -0.231 1
1 985 . 8 1 1 A 90 90 TYR CB C 90 39.500 38.751 0.749 1
1 988 . 8 1 1 A 90 90 TYR N N 90 126.100 126.433 -0.333 1
1 989 . 8 1 1 A 91 91 SER H H 91 9.160 8.516 0.644 1
1 990 . 8 1 1 A 91 91 SER HA H 91 4.000 3.921 0.079 1
1 993 . 8 1 1 A 91 91 SER C C 91 178.000 177.366 0.634 1
1 994 . 8 1 1 A 91 91 SER CA C 91 62.600 61.716 0.884 1
1 995 . 8 1 1 A 91 91 SER CB C 91 62.200 62.978 -0.778 1
1 996 . 8 1 1 A 91 91 SER N N 91 116.600 114.213 2.387 1
1 997 . 8 1 1 A 92 92 GLU H H 92 8.590 8.228 0.362 1
1 998 . 8 1 1 A 92 92 GLU HA H 92 4.050 4.064 -0.014 1
1 1003 . 8 1 1 A 92 92 GLU C C 92 179.400 178.932 0.468 1
1 1004 . 8 1 1 A 92 92 GLU CA C 92 58.900 59.072 -0.172 1
1 1005 . 8 1 1 A 92 92 GLU CB C 92 30.600 29.127 1.473 1
1 1007 . 8 1 1 A 92 92 GLU N N 92 120.200 121.113 -0.913 1
1 1008 . 8 1 1 A 93 93 PHE H H 93 7.870 8.014 -0.144 1
1 1009 . 8 1 1 A 93 93 PHE HA H 93 4.050 4.043 0.007 1
1 1015 . 8 1 1 A 93 93 PHE C C 93 176.500 177.854 -1.354 1
1 1016 . 8 1 1 A 93 93 PHE CA C 93 62.200 61.273 0.927 1
1 1017 . 8 1 1 A 93 93 PHE CB C 93 39.700 39.226 0.474 1
1 1021 . 8 1 1 A 93 93 PHE N N 93 120.200 120.517 -0.317 1
1 1022 . 8 1 1 A 94 94 GLN H H 94 8.190 8.206 -0.016 1
1 1023 . 8 1 1 A 94 94 GLN HA H 94 3.390 3.579 -0.189 1
1 1030 . 8 1 1 A 94 94 GLN C C 94 178.600 178.603 -0.003 1
1 1031 . 8 1 1 A 94 94 GLN CA C 94 58.800 59.104 -0.304 1
1 1032 . 8 1 1 A 94 94 GLN CB C 94 28.400 27.953 0.447 1
1 1034 . 8 1 1 A 94 94 GLN N N 94 116.800 118.115 -1.315 1
1 1036 . 8 1 1 A 95 95 LYS H H 95 7.060 7.382 -0.322 1
1 1037 . 8 1 1 A 95 95 LYS HA H 95 3.780 4.005 -0.225 1
1 1046 . 8 1 1 A 95 95 LYS C C 95 179.300 178.986 0.314 1
1 1047 . 8 1 1 A 95 95 LYS CA C 95 59.900 59.101 0.799 1
1 1048 . 8 1 1 A 95 95 LYS CB C 95 32.700 32.398 0.302 1
1 1052 . 8 1 1 A 95 95 LYS N N 95 117.500 120.182 -2.682 1
1 1053 . 8 1 1 A 96 96 ILE H H 96 7.240 7.608 -0.368 1
1 1054 . 8 1 1 A 96 96 ILE HA H 96 3.420 3.396 0.024 1
1 1064 . 8 1 1 A 96 96 ILE C C 96 177.800 178.120 -0.320 1
1 1065 . 8 1 1 A 96 96 ILE CA C 96 64.300 65.633 -1.333 1
1 1066 . 8 1 1 A 96 96 ILE CB C 96 37.400 37.602 -0.202 1
1 1070 . 8 1 1 A 96 96 ILE N N 96 120.700 120.562 0.138 1
1 1071 . 8 1 1 A 97 97 LEU H H 97 7.690 7.524 0.166 1
1 1072 . 8 1 1 A 97 97 LEU HA H 97 3.580 3.666 -0.086 1
1 1082 . 8 1 1 A 97 97 LEU C C 97 179.900 179.307 0.593 1
1 1083 . 8 1 1 A 97 97 LEU CA C 97 58.100 57.771 0.329 1
1 1084 . 8 1 1 A 97 97 LEU CB C 97 41.500 40.639 0.861 1
1 1088 . 8 1 1 A 97 97 LEU N N 97 120.000 118.767 1.233 1
1 1089 . 8 1 1 A 98 98 LYS H H 98 7.510 7.898 -0.388 1
1 1090 . 8 1 1 A 98 98 LYS HA H 98 3.950 3.838 0.112 1
1 1099 . 8 1 1 A 98 98 LYS C C 98 178.700 178.867 -0.167 1
1 1100 . 8 1 1 A 98 98 LYS CA C 98 58.700 58.923 -0.223 1
1 1101 . 8 1 1 A 98 98 LYS CB C 98 32.500 32.113 0.387 1
1 1105 . 8 1 1 A 98 98 LYS N N 98 117.300 120.649 -3.349 1
1 1106 . 8 1 1 A 99 99 LYS H H 99 7.470 7.947 -0.477 1
1 1107 . 8 1 1 A 99 99 LYS HA H 99 4.080 4.024 0.056 1
1 1116 . 8 1 1 A 99 99 LYS C C 99 178.100 179.350 -1.250 1
1 1117 . 8 1 1 A 99 99 LYS CA C 99 58.400 59.856 -1.456 1
1 1118 . 8 1 1 A 99 99 LYS CB C 99 33.000 31.994 1.006 1
1 1122 . 8 1 1 A 99 99 LYS N N 99 119.000 118.357 0.643 1
1 1123 . 8 1 1 A 100 100 ARG H H 100 8.020 7.462 0.558 1
1 1124 . 8 1 1 A 100 100 ARG HA H 100 4.210 4.143 0.067 1
1 1131 . 8 1 1 A 100 100 ARG C C 100 177.500 177.043 0.457 1
1 1132 . 8 1 1 A 100 100 ARG CA C 100 56.700 56.411 0.289 1
1 1133 . 8 1 1 A 100 100 ARG CB C 100 30.500 30.312 0.188 1
1 1136 . 8 1 1 A 100 100 ARG N N 100 117.300 116.889 0.411 1
1 1137 . 8 1 1 A 101 101 GLY H H 101 7.910 7.660 0.250 1
1 1138 . 8 1 1 A 101 101 GLY HA2 H 101 3.980 3.899 0.081 1
1 1139 . 8 1 1 A 101 101 GLY HA3 H 101 4.020 3.911 0.109 1
1 1140 . 8 1 1 A 101 101 GLY C C 101 174.400 174.944 -0.544 1
1 1141 . 8 1 1 A 101 101 GLY CA C 101 46.000 46.338 -0.338 1
1 1142 . 8 1 1 A 101 101 GLY N N 101 108.000 107.866 0.134 1
1 1143 . 8 1 1 A 102 102 THR H H 102 7.880 7.787 0.093 1
1 1144 . 8 1 1 A 102 102 THR HA H 102 4.360 4.121 0.239 1
1 1149 . 8 1 1 A 102 102 THR C C 102 174.400 173.936 0.464 1
1 1150 . 8 1 1 A 102 102 THR CA C 102 62.100 63.610 -1.510 1
1 1151 . 8 1 1 A 102 102 THR CB C 102 70.500 69.312 1.188 1
1 1153 . 8 1 1 A 102 102 THR N N 102 113.900 116.331 -2.431 1
1 1154 . 8 1 1 A 103 103 LYS H H 103 8.440 9.001 -0.561 1
1 1155 . 8 1 1 A 103 103 LYS C C 103 176.400 176.683 -0.283 1
1 1156 . 8 1 1 A 103 103 LYS CA C 103 56.600 55.505 1.095 1
1 1157 . 8 1 1 A 103 103 LYS CB C 103 33.300 33.333 -0.033 1
1 1158 . 8 1 1 A 103 103 LYS N N 103 124.000 126.770 -2.770 1
1 1159 . 8 1 1 A 104 104 LEU H H 104 8.180 8.817 -0.637 1
1 1160 . 8 1 1 A 104 104 LEU HA H 104 4.270 4.230 0.040 1
1 1170 . 8 1 1 A 104 104 LEU C C 104 177.100 176.378 0.722 1
1 1171 . 8 1 1 A 104 104 LEU CA C 104 55.500 55.222 0.278 1
1 1172 . 8 1 1 A 104 104 LEU CB C 104 42.500 41.496 1.004 1
1 1176 . 8 1 1 A 104 104 LEU N N 104 123.500 124.350 -0.850 1
1 1177 . 8 1 1 A 105 105 GLU H H 105 8.270 7.674 0.596 1
1 1178 . 8 1 1 A 105 105 GLU CA C 105 56.700 55.484 1.216 1
1 1179 . 8 1 1 A 105 105 GLU CB C 105 30.800 29.955 0.845 1
1 13 . 9 1 1 A 2 2 ASN HA H 2 4.980 5.181 -0.201 1
1 18 . 9 1 1 A 2 2 ASN C C 2 176.300 175.216 1.084 1
1 19 . 9 1 1 A 2 2 ASN CA C 2 52.500 51.230 1.270 1
1 20 . 9 1 1 A 2 2 ASN CB C 2 40.900 41.864 -0.964 1
1 22 . 9 1 1 A 3 3 SER H H 3 9.940 9.575 0.365 1
1 23 . 9 1 1 A 3 3 SER HA H 3 3.720 4.084 -0.364 1
1 26 . 9 1 1 A 3 3 SER C C 3 175.900 176.751 -0.851 1
1 27 . 9 1 1 A 3 3 SER CA C 3 63.300 61.676 1.624 1
1 28 . 9 1 1 A 3 3 SER CB C 3 61.700 63.170 -1.470 1
1 29 . 9 1 1 A 3 3 SER N N 3 118.200 116.181 2.019 1
1 30 . 9 1 1 A 4 4 GLU H H 4 8.450 7.641 0.809 1
1 31 . 9 1 1 A 4 4 GLU HA H 4 4.010 4.028 -0.018 1
1 36 . 9 1 1 A 4 4 GLU C C 4 178.800 179.667 -0.867 1
1 37 . 9 1 1 A 4 4 GLU CA C 4 60.300 59.030 1.270 1
1 38 . 9 1 1 A 4 4 GLU CB C 4 29.100 29.686 -0.586 1
1 40 . 9 1 1 A 4 4 GLU N N 4 123.600 122.226 1.374 1
1 41 . 9 1 1 A 5 5 VAL H H 5 7.590 7.963 -0.373 1
1 42 . 9 1 1 A 5 5 VAL HA H 5 3.850 3.705 0.145 1
1 50 . 9 1 1 A 5 5 VAL C C 5 179.100 178.575 0.525 1
1 51 . 9 1 1 A 5 5 VAL CA C 5 65.800 66.177 -0.377 1
1 52 . 9 1 1 A 5 5 VAL CB C 5 32.300 31.666 0.634 1
1 55 . 9 1 1 A 5 5 VAL N N 5 119.300 120.653 -1.353 1
1 56 . 9 1 1 A 6 6 ILE H H 6 7.240 8.207 -0.967 1
1 57 . 9 1 1 A 6 6 ILE HA H 6 3.580 3.612 -0.032 1
1 67 . 9 1 1 A 6 6 ILE C C 6 177.000 177.847 -0.847 1
1 68 . 9 1 1 A 6 6 ILE CA C 6 65.300 65.838 -0.538 1
1 69 . 9 1 1 A 6 6 ILE CB C 6 37.900 37.902 -0.002 1
1 73 . 9 1 1 A 6 6 ILE N N 6 120.300 121.017 -0.717 1
1 74 . 9 1 1 A 7 7 LYS H H 7 8.050 7.791 0.259 1
1 75 . 9 1 1 A 7 7 LYS HA H 7 3.570 3.637 -0.067 1
1 84 . 9 1 1 A 7 7 LYS C C 7 178.700 179.935 -1.235 1
1 85 . 9 1 1 A 7 7 LYS CA C 7 61.300 60.393 0.907 1
1 86 . 9 1 1 A 7 7 LYS CB C 7 32.200 32.102 0.098 1
1 90 . 9 1 1 A 7 7 LYS N N 7 119.200 118.579 0.621 1
1 91 . 9 1 1 A 8 8 GLU H H 8 8.100 8.420 -0.320 1
1 92 . 9 1 1 A 8 8 GLU HA H 8 4.000 4.070 -0.070 1
1 97 . 9 1 1 A 8 8 GLU C C 8 178.500 179.228 -0.728 1
1 98 . 9 1 1 A 8 8 GLU CA C 8 59.700 59.633 0.067 1
1 99 . 9 1 1 A 8 8 GLU CB C 8 29.600 29.539 0.061 1
1 101 . 9 1 1 A 8 8 GLU N N 8 119.400 120.001 -0.601 1
1 102 . 9 1 1 A 9 9 PHE H H 9 7.720 8.072 -0.352 1
1 103 . 9 1 1 A 9 9 PHE HA H 9 4.160 3.995 0.165 1
1 109 . 9 1 1 A 9 9 PHE C C 9 176.900 176.556 0.344 1
1 110 . 9 1 1 A 9 9 PHE CA C 9 61.300 61.243 0.057 1
1 111 . 9 1 1 A 9 9 PHE CB C 9 39.400 38.966 0.434 1
1 115 . 9 1 1 A 9 9 PHE N N 9 121.300 121.625 -0.325 1
1 116 . 9 1 1 A 10 10 LEU H H 10 8.060 8.374 -0.314 1
1 117 . 9 1 1 A 10 10 LEU HA H 10 3.660 3.715 -0.055 1
1 127 . 9 1 1 A 10 10 LEU C C 10 179.000 179.118 -0.118 1
1 128 . 9 1 1 A 10 10 LEU CA C 10 58.000 57.645 0.355 1
1 129 . 9 1 1 A 10 10 LEU CB C 10 41.400 41.105 0.295 1
1 133 . 9 1 1 A 10 10 LEU N N 10 118.000 118.602 -0.602 1
1 134 . 9 1 1 A 11 11 GLU H H 11 7.990 8.692 -0.702 1
1 135 . 9 1 1 A 11 11 GLU HA H 11 4.110 4.017 0.093 1
1 140 . 9 1 1 A 11 11 GLU C C 11 174.200 179.073 -4.873 1
1 141 . 9 1 1 A 11 11 GLU CA C 11 59.200 59.730 -0.530 1
1 142 . 9 1 1 A 11 11 GLU CB C 11 29.300 29.088 0.212 1
1 144 . 9 1 1 A 11 11 GLU N N 11 118.300 119.160 -0.860 1
1 145 . 9 1 1 A 12 12 ASP H H 12 8.080 8.127 -0.047 1
1 146 . 9 1 1 A 12 12 ASP HA H 12 4.340 4.308 0.032 1
1 149 . 9 1 1 A 12 12 ASP C C 12 178.900 178.279 0.621 1
1 150 . 9 1 1 A 12 12 ASP CA C 12 57.600 57.827 -0.227 1
1 151 . 9 1 1 A 12 12 ASP CB C 12 41.000 41.510 -0.510 1
1 152 . 9 1 1 A 12 12 ASP N N 12 121.800 119.332 2.468 1
1 153 . 9 1 1 A 13 13 ILE H H 13 7.610 7.494 0.116 1
1 154 . 9 1 1 A 13 13 ILE HA H 13 4.240 3.969 0.271 1
1 164 . 9 1 1 A 13 13 ILE C C 13 176.800 176.810 -0.010 1
1 165 . 9 1 1 A 13 13 ILE CA C 13 62.100 61.446 0.654 1
1 166 . 9 1 1 A 13 13 ILE CB C 13 38.300 38.464 -0.164 1
1 170 . 9 1 1 A 13 13 ILE N N 13 110.800 112.840 -2.040 1
1 171 . 9 1 1 A 14 14 GLY H H 14 7.640 8.033 -0.393 1
1 172 . 9 1 1 A 14 14 GLY HA2 H 14 3.810 3.930 -0.120 1
1 173 . 9 1 1 A 14 14 GLY HA3 H 14 3.880 3.937 -0.057 1
1 174 . 9 1 1 A 14 14 GLY C C 14 175.200 174.268 0.932 1
1 175 . 9 1 1 A 14 14 GLY CA C 14 46.900 46.364 0.536 1
1 176 . 9 1 1 A 14 14 GLY N N 14 111.800 112.924 -1.124 1
1 177 . 9 1 1 A 15 15 GLU H H 15 7.870 8.332 -0.462 1
1 178 . 9 1 1 A 15 15 GLU HA H 15 4.680 4.754 -0.074 1
1 183 . 9 1 1 A 15 15 GLU C C 15 175.100 174.442 0.658 1
1 184 . 9 1 1 A 15 15 GLU CA C 15 54.800 55.093 -0.293 1
1 185 . 9 1 1 A 15 15 GLU CB C 15 32.200 32.486 -0.286 1
1 187 . 9 1 1 A 15 15 GLU N N 15 119.200 119.361 -0.161 1
1 188 . 9 1 1 A 16 16 ASP H H 16 8.220 8.683 -0.463 1
1 189 . 9 1 1 A 16 16 ASP HA H 16 4.680 5.320 -0.640 1
1 192 . 9 1 1 A 16 16 ASP C C 16 174.600 174.397 0.203 1
1 193 . 9 1 1 A 16 16 ASP CA C 16 53.600 52.892 0.708 1
1 194 . 9 1 1 A 16 16 ASP CB C 16 42.900 44.656 -1.756 1
1 195 . 9 1 1 A 16 16 ASP N N 16 120.600 120.759 -0.159 1
1 196 . 9 1 1 A 17 17 TYR H H 17 7.540 8.578 -1.038 1
1 197 . 9 1 1 A 17 17 TYR HA H 17 4.910 5.856 -0.946 1
1 202 . 9 1 1 A 17 17 TYR C C 17 173.600 173.559 0.041 1
1 203 . 9 1 1 A 17 17 TYR CA C 17 56.200 55.235 0.965 1
1 204 . 9 1 1 A 17 17 TYR CB C 17 41.100 42.151 -1.051 1
1 207 . 9 1 1 A 17 17 TYR N N 17 112.700 122.072 -9.372 1
1 208 . 9 1 1 A 18 18 ILE H H 18 7.950 9.132 -1.182 1
1 209 . 9 1 1 A 18 18 ILE HA H 18 4.330 4.556 -0.226 1
1 219 . 9 1 1 A 18 18 ILE C C 18 174.700 174.646 0.054 1
1 220 . 9 1 1 A 18 18 ILE CA C 18 60.300 61.101 -0.801 1
1 221 . 9 1 1 A 18 18 ILE CB C 18 41.000 37.284 3.716 1
1 225 . 9 1 1 A 18 18 ILE N N 18 120.400 122.881 -2.481 1
1 226 . 9 1 1 A 19 19 GLU H H 19 8.760 9.040 -0.280 1
1 227 . 9 1 1 A 19 19 GLU HA H 19 5.200 4.994 0.206 1
1 232 . 9 1 1 A 19 19 GLU C C 19 175.200 175.385 -0.185 1
1 233 . 9 1 1 A 19 19 GLU CA C 19 55.500 55.683 -0.183 1
1 234 . 9 1 1 A 19 19 GLU CB C 19 32.400 31.074 1.326 1
1 236 . 9 1 1 A 19 19 GLU N N 19 129.000 128.719 0.281 1
1 237 . 9 1 1 A 20 20 LEU H H 20 8.730 9.213 -0.483 1
1 238 . 9 1 1 A 20 20 LEU HA H 20 4.620 4.977 -0.357 1
1 248 . 9 1 1 A 20 20 LEU C C 20 176.200 176.513 -0.313 1
1 249 . 9 1 1 A 20 20 LEU CA C 20 54.100 53.344 0.756 1
1 250 . 9 1 1 A 20 20 LEU CB C 20 44.400 43.704 0.696 1
1 254 . 9 1 1 A 20 20 LEU N N 20 128.400 128.228 0.172 1
1 255 . 9 1 1 A 21 21 GLU H H 21 8.700 8.732 -0.032 1
1 256 . 9 1 1 A 21 21 GLU HA H 21 3.870 3.947 -0.077 1
1 261 . 9 1 1 A 21 21 GLU C C 21 176.100 176.934 -0.834 1
1 262 . 9 1 1 A 21 21 GLU CA C 21 58.800 57.559 1.241 1
1 263 . 9 1 1 A 21 21 GLU CB C 21 28.200 29.257 -1.057 1
1 265 . 9 1 1 A 21 21 GLU N N 21 122.600 120.740 1.860 1
1 266 . 9 1 1 A 22 22 ASN H H 22 8.640 9.006 -0.366 1
1 267 . 9 1 1 A 22 22 ASN HA H 22 4.540 4.340 0.200 1
1 272 . 9 1 1 A 22 22 ASN C C 22 173.800 173.916 -0.116 1
1 273 . 9 1 1 A 22 22 ASN CA C 22 54.600 54.670 -0.070 1
1 274 . 9 1 1 A 22 22 ASN CB C 22 38.400 36.951 1.449 1
1 275 . 9 1 1 A 22 22 ASN N N 22 118.000 120.385 -2.385 1
1 277 . 9 1 1 A 23 23 GLU H H 23 7.740 7.804 -0.064 1
1 278 . 9 1 1 A 23 23 GLU HA H 23 5.430 5.066 0.364 1
1 283 . 9 1 1 A 23 23 GLU C C 23 175.400 175.330 0.070 1
1 284 . 9 1 1 A 23 23 GLU CA C 23 54.900 55.103 -0.203 1
1 285 . 9 1 1 A 23 23 GLU CB C 23 34.500 31.845 2.655 1
1 287 . 9 1 1 A 23 23 GLU N N 23 116.400 117.558 -1.158 1
1 288 . 9 1 1 A 24 24 ILE H H 24 9.050 9.143 -0.093 1
1 289 . 9 1 1 A 24 24 ILE HA H 24 4.810 4.893 -0.083 1
1 299 . 9 1 1 A 24 24 ILE C C 24 174.600 174.785 -0.185 1
1 300 . 9 1 1 A 24 24 ILE CA C 24 60.700 60.384 0.316 1
1 301 . 9 1 1 A 24 24 ILE CB C 24 41.300 38.321 2.979 1
1 305 . 9 1 1 A 24 24 ILE N N 24 122.800 125.683 -2.883 1
1 306 . 9 1 1 A 25 25 HIS H H 25 9.490 9.577 -0.087 1
1 307 . 9 1 1 A 25 25 HIS HA H 25 5.090 5.547 -0.457 1
1 312 . 9 1 1 A 25 25 HIS C C 25 176.100 174.522 1.578 1
1 313 . 9 1 1 A 25 25 HIS CA C 25 56.100 55.444 0.656 1
1 314 . 9 1 1 A 25 25 HIS CB C 25 33.100 31.046 2.054 1
1 317 . 9 1 1 A 25 25 HIS N N 25 127.300 126.811 0.489 1
1 318 . 9 1 1 A 26 26 LEU H H 26 8.820 8.980 -0.160 1
1 319 . 9 1 1 A 26 26 LEU HA H 26 5.160 5.017 0.143 1
1 329 . 9 1 1 A 26 26 LEU C C 26 178.000 176.428 1.572 1
1 330 . 9 1 1 A 26 26 LEU CA C 26 52.900 53.271 -0.371 1
1 331 . 9 1 1 A 26 26 LEU CB C 26 48.100 44.494 3.606 1
1 335 . 9 1 1 A 26 26 LEU N N 26 121.600 125.146 -3.546 1
1 336 . 9 1 1 A 27 27 LYS H H 27 8.990 8.940 0.050 1
1 337 . 9 1 1 A 27 27 LYS HA H 27 4.630 4.508 0.122 1
1 345 . 9 1 1 A 27 27 LYS CA C 27 55.700 54.557 1.143 1
1 346 . 9 1 1 A 27 27 LYS CB C 27 31.900 32.387 -0.487 1
1 350 . 9 1 1 A 27 27 LYS N N 27 125.900 121.400 4.500 1
1 351 . 9 1 1 A 28 28 PRO HA H 28 4.500 4.510 -0.010 1
1 358 . 9 1 1 A 28 28 PRO C C 28 177.900 179.000 -1.100 1
1 359 . 9 1 1 A 28 28 PRO CA C 28 67.400 65.938 1.462 1
1 360 . 9 1 1 A 28 28 PRO CB C 28 32.100 31.889 0.211 1
1 363 . 9 1 1 A 29 29 GLU H H 29 9.880 8.709 1.171 1
1 364 . 9 1 1 A 29 29 GLU HA H 29 4.140 4.184 -0.044 1
1 369 . 9 1 1 A 29 29 GLU C C 29 178.800 178.755 0.045 1
1 370 . 9 1 1 A 29 29 GLU CA C 29 60.600 59.298 1.302 1
1 371 . 9 1 1 A 29 29 GLU CB C 29 29.200 29.322 -0.122 1
1 373 . 9 1 1 A 29 29 GLU N N 29 117.100 117.472 -0.372 1
1 374 . 9 1 1 A 30 30 VAL H H 30 7.050 7.741 -0.691 1
1 375 . 9 1 1 A 30 30 VAL HA H 30 3.850 3.993 -0.143 1
1 383 . 9 1 1 A 30 30 VAL C C 30 177.700 177.921 -0.221 1
1 384 . 9 1 1 A 30 30 VAL CA C 30 65.600 65.026 0.574 1
1 385 . 9 1 1 A 30 30 VAL CB C 30 32.100 31.829 0.271 1
1 388 . 9 1 1 A 30 30 VAL N N 30 120.900 120.549 0.351 1
1 389 . 9 1 1 A 31 31 PHE H H 31 8.980 8.722 0.258 1
1 390 . 9 1 1 A 31 31 PHE HA H 31 3.870 4.331 -0.461 1
1 394 . 9 1 1 A 31 31 PHE C C 31 176.700 177.354 -0.654 1
1 395 . 9 1 1 A 31 31 PHE CA C 31 62.200 61.824 0.376 1
1 396 . 9 1 1 A 31 31 PHE CB C 31 39.300 39.156 0.144 1
1 398 . 9 1 1 A 31 31 PHE N N 31 121.100 120.929 0.171 1
1 399 . 9 1 1 A 32 32 TYR H H 32 8.640 8.252 0.388 1
1 400 . 9 1 1 A 32 32 TYR HA H 32 3.880 4.383 -0.503 1
1 405 . 9 1 1 A 32 32 TYR C C 32 176.000 178.174 -2.174 1
1 406 . 9 1 1 A 32 32 TYR CA C 32 63.300 62.047 1.253 1
1 407 . 9 1 1 A 32 32 TYR CB C 32 39.100 38.767 0.333 1
1 410 . 9 1 1 A 32 32 TYR N N 32 117.400 120.525 -3.125 1
1 411 . 9 1 1 A 33 33 GLU H H 33 7.400 7.934 -0.534 1
1 412 . 9 1 1 A 33 33 GLU HA H 33 4.050 4.232 -0.182 1
1 417 . 9 1 1 A 33 33 GLU C C 33 180.200 179.275 0.925 1
1 418 . 9 1 1 A 33 33 GLU CA C 33 59.500 58.930 0.570 1
1 419 . 9 1 1 A 33 33 GLU CB C 33 29.300 30.024 -0.724 1
1 421 . 9 1 1 A 33 33 GLU N N 33 116.100 119.220 -3.120 1
1 422 . 9 1 1 A 34 34 VAL H H 34 8.530 7.691 0.839 1
1 423 . 9 1 1 A 34 34 VAL HA H 34 3.350 3.399 -0.049 1
1 431 . 9 1 1 A 34 34 VAL C C 34 175.800 178.237 -2.437 1
1 432 . 9 1 1 A 34 34 VAL CA C 34 66.400 66.120 0.280 1
1 433 . 9 1 1 A 34 34 VAL CB C 34 32.200 31.581 0.619 1
1 436 . 9 1 1 A 34 34 VAL N N 34 120.600 120.470 0.130 1
1 437 . 9 1 1 A 35 35 TRP H H 35 9.100 8.312 0.788 1
1 438 . 9 1 1 A 35 35 TRP HA H 35 3.340 3.711 -0.371 1
1 447 . 9 1 1 A 35 35 TRP C C 35 178.000 178.226 -0.226 1
1 448 . 9 1 1 A 35 35 TRP CA C 35 61.800 60.388 1.412 1
1 449 . 9 1 1 A 35 35 TRP CB C 35 27.900 29.184 -1.284 1
1 455 . 9 1 1 A 35 35 TRP N N 35 121.700 121.713 -0.013 1
1 457 . 9 1 1 A 36 36 LYS H H 36 7.970 7.801 0.169 1
1 458 . 9 1 1 A 36 36 LYS HA H 36 3.330 3.627 -0.297 1
1 467 . 9 1 1 A 36 36 LYS C C 36 180.000 178.252 1.748 1
1 468 . 9 1 1 A 36 36 LYS CA C 36 59.000 58.391 0.609 1
1 469 . 9 1 1 A 36 36 LYS CB C 36 31.800 32.300 -0.500 1
1 473 . 9 1 1 A 36 36 LYS N N 36 116.300 118.451 -2.151 1
1 474 . 9 1 1 A 37 37 TYR H H 37 7.750 7.944 -0.194 1
1 475 . 9 1 1 A 37 37 TYR HA H 37 3.940 3.886 0.054 1
1 480 . 9 1 1 A 37 37 TYR C C 37 177.600 177.566 0.034 1
1 481 . 9 1 1 A 37 37 TYR CA C 37 61.200 60.954 0.246 1
1 482 . 9 1 1 A 37 37 TYR CB C 37 38.800 38.404 0.396 1
1 485 . 9 1 1 A 37 37 TYR N N 37 122.700 121.615 1.085 1
1 486 . 9 1 1 A 38 38 VAL H H 38 7.660 7.294 0.366 1
1 487 . 9 1 1 A 38 38 VAL HA H 38 3.870 3.972 -0.102 1
1 495 . 9 1 1 A 38 38 VAL C C 38 175.600 175.598 0.002 1
1 496 . 9 1 1 A 38 38 VAL CA C 38 61.100 61.215 -0.115 1
1 497 . 9 1 1 A 38 38 VAL CB C 38 30.700 31.340 -0.640 1
1 500 . 9 1 1 A 38 38 VAL N N 38 108.200 112.599 -4.399 1
1 501 . 9 1 1 A 39 39 GLY H H 39 7.090 7.712 -0.622 1
1 502 . 9 1 1 A 39 39 GLY HA2 H 39 3.320 3.717 -0.397 1
1 503 . 9 1 1 A 39 39 GLY HA3 H 39 3.730 3.746 -0.016 1
1 504 . 9 1 1 A 39 39 GLY C C 39 173.600 174.410 -0.810 1
1 505 . 9 1 1 A 39 39 GLY CA C 39 46.100 45.072 1.028 1
1 506 . 9 1 1 A 39 39 GLY N N 39 107.600 110.197 -2.597 1
1 507 . 9 1 1 A 40 40 GLU H H 40 7.730 8.029 -0.299 1
1 508 . 9 1 1 A 40 40 GLU HA H 40 1.090 2.806 -1.716 1
1 513 . 9 1 1 A 40 40 GLU CA C 40 55.700 56.340 -0.640 1
1 514 . 9 1 1 A 40 40 GLU CB C 40 27.200 27.478 -0.278 1
1 516 . 9 1 1 A 40 40 GLU N N 40 114.400 111.661 2.739 1
1 517 . 9 1 1 A 41 41 PRO HA H 41 4.310 4.473 -0.163 1
1 524 . 9 1 1 A 41 41 PRO CA C 41 62.300 62.401 -0.101 1
1 525 . 9 1 1 A 41 41 PRO CB C 41 32.700 32.546 0.154 1
1 528 . 9 1 1 A 42 42 GLU H H 42 8.110 8.574 -0.464 1
1 529 . 9 1 1 A 42 42 GLU C C 42 175.800 176.432 -0.632 1
1 530 . 9 1 1 A 42 42 GLU CA C 42 57.800 57.057 0.743 1
1 531 . 9 1 1 A 42 42 GLU CB C 42 30.600 30.348 0.252 1
1 533 . 9 1 1 A 42 42 GLU N N 42 119.100 121.551 -2.451 1
1 534 . 9 1 1 A 43 43 LEU H H 43 8.140 8.928 -0.788 1
1 535 . 9 1 1 A 43 43 LEU HA H 43 4.840 5.038 -0.198 1
1 545 . 9 1 1 A 43 43 LEU C C 43 177.300 175.121 2.179 1
1 546 . 9 1 1 A 43 43 LEU CA C 43 53.700 53.373 0.327 1
1 547 . 9 1 1 A 43 43 LEU CB C 43 43.900 44.027 -0.127 1
1 551 . 9 1 1 A 43 43 LEU N N 43 124.700 125.127 -0.427 1
1 552 . 9 1 1 A 44 44 LYS H H 44 8.640 8.631 0.009 1
1 553 . 9 1 1 A 44 44 LYS HA H 44 4.500 4.947 -0.447 1
1 562 . 9 1 1 A 44 44 LYS C C 44 174.500 175.719 -1.219 1
1 563 . 9 1 1 A 44 44 LYS CA C 44 54.700 54.330 0.370 1
1 564 . 9 1 1 A 44 44 LYS CB C 44 36.200 34.386 1.814 1
1 568 . 9 1 1 A 44 44 LYS N N 44 123.300 124.879 -1.579 1
1 569 . 9 1 1 A 45 45 THR H H 45 7.990 8.693 -0.703 1
1 570 . 9 1 1 A 45 45 THR HA H 45 5.700 5.507 0.193 1
1 575 . 9 1 1 A 45 45 THR C C 45 175.100 174.014 1.086 1
1 576 . 9 1 1 A 45 45 THR CA C 45 59.600 60.015 -0.415 1
1 577 . 9 1 1 A 45 45 THR CB C 45 73.400 70.569 2.831 1
1 579 . 9 1 1 A 45 45 THR N N 45 106.900 115.999 -9.099 1
1 580 . 9 1 1 A 46 46 TYR H H 46 8.470 9.471 -1.001 1
1 581 . 9 1 1 A 46 46 TYR HA H 46 4.930 5.871 -0.941 1
1 586 . 9 1 1 A 46 46 TYR C C 46 172.400 174.026 -1.626 1
1 587 . 9 1 1 A 46 46 TYR CA C 46 57.100 55.274 1.826 1
1 588 . 9 1 1 A 46 46 TYR CB C 46 40.200 41.943 -1.743 1
1 591 . 9 1 1 A 46 46 TYR N N 46 117.100 118.952 -1.852 1
1 592 . 9 1 1 A 47 47 VAL H H 47 8.430 9.036 -0.606 1
1 593 . 9 1 1 A 47 47 VAL HA H 47 4.890 4.410 0.480 1
1 601 . 9 1 1 A 47 47 VAL C C 47 175.800 173.911 1.889 1
1 602 . 9 1 1 A 47 47 VAL CA C 47 60.800 61.340 -0.540 1
1 603 . 9 1 1 A 47 47 VAL CB C 47 34.800 32.700 2.100 1
1 606 . 9 1 1 A 47 47 VAL N N 47 119.200 120.870 -1.670 1
1 607 . 9 1 1 A 48 48 ILE H H 48 8.680 8.968 -0.288 1
1 608 . 9 1 1 A 48 48 ILE HA H 48 4.560 4.828 -0.268 1
1 618 . 9 1 1 A 48 48 ILE C C 48 174.500 174.640 -0.140 1
1 619 . 9 1 1 A 48 48 ILE CA C 48 59.700 60.021 -0.321 1
1 620 . 9 1 1 A 48 48 ILE CB C 48 41.500 40.339 1.161 1
1 624 . 9 1 1 A 48 48 ILE N N 48 124.400 129.215 -4.815 1
1 625 . 9 1 1 A 49 49 GLU H H 49 8.320 8.964 -0.644 1
1 626 . 9 1 1 A 49 49 GLU C C 49 175.500 174.756 0.744 1
1 627 . 9 1 1 A 49 49 GLU CA C 49 55.500 56.136 -0.636 1
1 628 . 9 1 1 A 49 49 GLU CB C 49 31.800 30.523 1.277 1
1 630 . 9 1 1 A 49 49 GLU N N 49 123.400 130.666 -7.266 1
1 631 . 9 1 1 A 50 50 ASP H H 50 8.610 8.999 -0.389 1
1 632 . 9 1 1 A 50 50 ASP C C 50 175.100 174.851 0.249 1
1 633 . 9 1 1 A 50 50 ASP CA C 50 53.100 53.002 0.098 1
1 634 . 9 1 1 A 50 50 ASP CB C 50 44.000 44.212 -0.212 1
1 635 . 9 1 1 A 50 50 ASP N N 50 124.300 127.601 -3.301 1
1 636 . 9 1 1 A 51 51 GLU H H 51 8.450 8.739 -0.289 1
1 637 . 9 1 1 A 51 51 GLU C C 51 175.900 174.953 0.947 1
1 638 . 9 1 1 A 51 51 GLU CA C 51 56.000 55.468 0.532 1
1 639 . 9 1 1 A 51 51 GLU CB C 51 31.700 30.953 0.747 1
1 640 . 9 1 1 A 51 51 GLU N N 51 121.300 123.711 -2.411 1
1 641 . 9 1 1 A 52 52 ILE H H 52 8.480 8.863 -0.383 1
1 642 . 9 1 1 A 52 52 ILE C C 52 175.400 174.497 0.903 1
1 643 . 9 1 1 A 52 52 ILE CA C 52 60.400 60.502 -0.102 1
1 644 . 9 1 1 A 52 52 ILE CB C 52 40.000 40.124 -0.124 1
1 645 . 9 1 1 A 52 52 ILE N N 52 122.700 126.898 -4.198 1
1 646 . 9 1 1 A 53 53 VAL H H 53 8.140 8.786 -0.646 1
1 647 . 9 1 1 A 53 53 VAL C C 53 175.600 175.050 0.550 1
1 648 . 9 1 1 A 53 53 VAL CA C 53 61.900 62.108 -0.208 1
1 649 . 9 1 1 A 53 53 VAL CB C 53 33.200 33.058 0.142 1
1 650 . 9 1 1 A 53 53 VAL N N 53 124.400 129.758 -5.358 1
1 651 . 9 1 1 A 54 54 GLU H H 54 8.540 8.636 -0.096 1
1 652 . 9 1 1 A 54 54 GLU CA C 54 55.600 54.139 1.461 1
1 653 . 9 1 1 A 54 54 GLU CB C 54 34.300 31.029 3.271 1
1 654 . 9 1 1 A 54 54 GLU N N 54 125.900 127.346 -1.446 1
1 655 . 9 1 1 A 55 55 PRO C C 55 177.500 176.614 0.886 1
1 656 . 9 1 1 A 55 55 PRO CA C 55 63.400 63.765 -0.365 1
1 657 . 9 1 1 A 55 55 PRO CB C 55 32.300 32.138 0.162 1
1 658 . 9 1 1 A 56 56 GLY H H 56 8.420 8.580 -0.160 1
1 659 . 9 1 1 A 56 56 GLY HA2 H 56 3.830 4.216 -0.386 1
1 660 . 9 1 1 A 56 56 GLY HA3 H 56 4.000 4.225 -0.225 1
1 661 . 9 1 1 A 56 56 GLY C C 56 174.500 175.389 -0.889 1
1 662 . 9 1 1 A 56 56 GLY CA C 56 45.400 45.771 -0.371 1
1 663 . 9 1 1 A 56 56 GLY N N 56 109.700 109.824 -0.124 1
1 664 . 9 1 1 A 57 57 GLU H H 57 8.180 8.003 0.177 1
1 665 . 9 1 1 A 57 57 GLU C C 57 176.300 175.247 1.053 1
1 666 . 9 1 1 A 57 57 GLU CA C 57 57.500 58.576 -1.076 1
1 667 . 9 1 1 A 57 57 GLU CB C 57 30.400 30.240 0.160 1
1 668 . 9 1 1 A 57 57 GLU N N 57 120.900 119.738 1.162 1
1 669 . 9 1 1 A 58 58 TYR H H 58 8.020 7.762 0.258 1
1 670 . 9 1 1 A 58 58 TYR C C 58 175.100 174.398 0.702 1
1 671 . 9 1 1 A 58 58 TYR CA C 58 57.400 56.815 0.585 1
1 672 . 9 1 1 A 58 58 TYR CB C 58 38.900 42.463 -3.563 1
1 673 . 9 1 1 A 58 58 TYR N N 58 118.800 116.902 1.898 1
1 674 . 9 1 1 A 59 59 ASP H H 59 7.950 8.731 -0.781 1
1 675 . 9 1 1 A 59 59 ASP CA C 59 52.700 51.106 1.594 1
1 676 . 9 1 1 A 59 59 ASP CB C 59 41.000 41.457 -0.457 1
1 677 . 9 1 1 A 59 59 ASP N N 59 123.500 120.546 2.954 1
1 678 . 9 1 1 A 61 61 PRO HA H 61 4.510 4.272 0.238 1
1 685 . 9 1 1 A 61 61 PRO C C 61 176.500 176.233 0.267 1
1 686 . 9 1 1 A 61 61 PRO CA C 61 63.700 64.960 -1.260 1
1 687 . 9 1 1 A 61 61 PRO CB C 61 34.200 32.069 2.131 1
1 690 . 9 1 1 A 62 62 GLU H H 62 8.490 8.000 0.490 1
1 691 . 9 1 1 A 62 62 GLU N N 62 124.600 118.972 5.628 1
1 692 . 9 1 1 A 64 64 LYS C C 64 176.300 174.635 1.665 1
1 693 . 9 1 1 A 64 64 LYS CA C 64 57.000 54.627 2.373 1
1 694 . 9 1 1 A 64 64 LYS CB C 64 33.100 35.780 -2.680 1
1 695 . 9 1 1 A 65 65 TYR H H 65 7.960 9.053 -1.093 1
1 696 . 9 1 1 A 65 65 TYR C C 65 176.000 175.795 0.205 1
1 697 . 9 1 1 A 65 65 TYR CA C 65 57.800 55.890 1.910 1
1 698 . 9 1 1 A 65 65 TYR CB C 65 38.800 41.453 -2.653 1
1 699 . 9 1 1 A 65 65 TYR N N 65 119.300 121.596 -2.296 1
1 700 . 9 1 1 A 66 66 THR H H 66 7.820 8.795 -0.975 1
1 701 . 9 1 1 A 66 66 THR HA H 66 4.280 4.775 -0.495 1
1 706 . 9 1 1 A 66 66 THR C C 66 174.100 174.625 -0.525 1
1 707 . 9 1 1 A 66 66 THR CA C 66 62.100 60.705 1.395 1
1 708 . 9 1 1 A 66 66 THR CB C 66 70.000 71.728 -1.728 1
1 710 . 9 1 1 A 66 66 THR N N 66 113.900 114.410 -0.510 1
1 711 . 9 1 1 A 67 67 ASN H H 67 8.270 8.641 -0.371 1
1 712 . 9 1 1 A 67 67 ASN C C 67 174.100 176.021 -1.921 1
1 713 . 9 1 1 A 67 67 ASN CA C 67 53.400 52.437 0.963 1
1 714 . 9 1 1 A 67 67 ASN CB C 67 39.300 40.434 -1.134 1
1 715 . 9 1 1 A 67 67 ASN N N 67 121.400 118.700 2.700 1
1 716 . 9 1 1 A 68 68 VAL H H 68 7.660 8.511 -0.851 1
1 717 . 9 1 1 A 68 68 VAL C C 68 175.500 175.392 0.108 1
1 718 . 9 1 1 A 68 68 VAL CA C 68 61.800 62.209 -0.409 1
1 719 . 9 1 1 A 68 68 VAL CB C 68 33.700 32.290 1.410 1
1 720 . 9 1 1 A 68 68 VAL N N 68 119.400 120.883 -1.483 1
1 721 . 9 1 1 A 69 69 LYS H H 69 8.690 8.170 0.520 1
1 722 . 9 1 1 A 69 69 LYS C C 69 175.200 175.147 0.053 1
1 723 . 9 1 1 A 69 69 LYS CA C 69 55.200 54.943 0.257 1
1 724 . 9 1 1 A 69 69 LYS CB C 69 35.200 33.856 1.344 1
1 725 . 9 1 1 A 69 69 LYS N N 69 126.500 126.325 0.175 1
1 726 . 9 1 1 A 70 70 LYS H H 70 8.230 8.837 -0.607 1
1 727 . 9 1 1 A 70 70 LYS C C 70 176.400 176.298 0.102 1
1 728 . 9 1 1 A 70 70 LYS CA C 70 55.600 56.262 -0.662 1
1 729 . 9 1 1 A 70 70 LYS CB C 70 33.800 33.212 0.588 1
1 730 . 9 1 1 A 70 70 LYS N N 70 122.700 127.005 -4.305 1
1 731 . 9 1 1 A 71 71 VAL H H 71 8.530 9.209 -0.679 1
1 732 . 9 1 1 A 71 71 VAL HA H 71 4.510 4.875 -0.365 1
1 733 . 9 1 1 A 71 71 VAL C C 71 174.700 174.188 0.512 1
1 734 . 9 1 1 A 71 71 VAL CA C 71 60.900 60.210 0.690 1
1 735 . 9 1 1 A 71 71 VAL CB C 71 34.800 34.630 0.170 1
1 738 . 9 1 1 A 71 71 VAL N N 71 121.200 118.231 2.969 1
1 739 . 9 1 1 A 72 72 LYS H H 72 8.210 8.873 -0.663 1
1 740 . 9 1 1 A 72 72 LYS HA H 72 4.800 4.670 0.130 1
1 747 . 9 1 1 A 72 72 LYS C C 72 176.200 175.695 0.505 1
1 748 . 9 1 1 A 72 72 LYS CA C 72 55.700 56.261 -0.561 1
1 749 . 9 1 1 A 72 72 LYS CB C 72 33.700 33.105 0.595 1
1 752 . 9 1 1 A 72 72 LYS N N 72 123.600 126.154 -2.554 1
1 753 . 9 1 1 A 73 73 ILE H H 73 8.890 9.071 -0.181 1
1 754 . 9 1 1 A 73 73 ILE C C 73 174.400 174.293 0.107 1
1 755 . 9 1 1 A 73 73 ILE CA C 73 60.400 60.289 0.111 1
1 756 . 9 1 1 A 73 73 ILE CB C 73 40.800 38.002 2.798 1
1 760 . 9 1 1 A 73 73 ILE N N 73 125.100 126.180 -1.080 1
1 761 . 9 1 1 A 74 74 LYS H H 74 8.420 8.872 -0.452 1
1 762 . 9 1 1 A 74 74 LYS HA H 74 4.800 4.757 0.043 1
1 771 . 9 1 1 A 74 74 LYS C C 74 175.600 175.227 0.373 1
1 772 . 9 1 1 A 74 74 LYS CA C 74 56.200 55.561 0.639 1
1 773 . 9 1 1 A 74 74 LYS CB C 74 34.300 33.556 0.744 1
1 777 . 9 1 1 A 74 74 LYS N N 74 126.400 128.342 -1.942 1
1 778 . 9 1 1 A 75 75 LYS H H 75 9.090 8.829 0.261 1
1 779 . 9 1 1 A 75 75 LYS HA H 75 4.800 4.948 -0.148 1
1 788 . 9 1 1 A 75 75 LYS C C 75 174.900 174.899 0.001 1
1 789 . 9 1 1 A 75 75 LYS CA C 75 53.200 54.327 -1.127 1
1 790 . 9 1 1 A 75 75 LYS CB C 75 34.200 35.869 -1.669 1
1 794 . 9 1 1 A 75 75 LYS N N 75 127.500 126.364 1.136 1
1 795 . 9 1 1 A 76 76 VAL H H 76 8.610 9.152 -0.542 1
1 796 . 9 1 1 A 76 76 VAL HA H 76 5.340 5.202 0.138 1
1 804 . 9 1 1 A 76 76 VAL C C 76 171.400 173.665 -2.265 1
1 805 . 9 1 1 A 76 76 VAL CA C 76 58.000 59.522 -1.522 1
1 806 . 9 1 1 A 76 76 VAL CB C 76 36.400 35.872 0.528 1
1 809 . 9 1 1 A 76 76 VAL N N 76 120.100 121.040 -0.940 1
1 810 . 9 1 1 A 77 77 TYR H H 77 9.110 9.096 0.014 1
1 811 . 9 1 1 A 77 77 TYR HA H 77 6.150 5.662 0.488 1
1 816 . 9 1 1 A 77 77 TYR C C 77 173.600 173.187 0.413 1
1 817 . 9 1 1 A 77 77 TYR CA C 77 56.200 55.776 0.424 1
1 818 . 9 1 1 A 77 77 TYR CB C 77 44.000 40.808 3.192 1
1 821 . 9 1 1 A 77 77 TYR N N 77 121.300 121.623 -0.323 1
1 822 . 9 1 1 A 78 78 PHE H H 78 8.190 8.641 -0.451 1
1 823 . 9 1 1 A 78 78 PHE HA H 78 5.130 5.617 -0.487 1
1 829 . 9 1 1 A 78 78 PHE C C 78 173.600 172.747 0.853 1
1 830 . 9 1 1 A 78 78 PHE CA C 78 55.900 55.012 0.888 1
1 831 . 9 1 1 A 78 78 PHE CB C 78 42.500 42.808 -0.308 1
1 835 . 9 1 1 A 78 78 PHE N N 78 112.700 116.894 -4.194 1
1 836 . 9 1 1 A 79 79 GLU H H 79 8.920 8.814 0.106 1
1 837 . 9 1 1 A 79 79 GLU HA H 79 5.390 4.850 0.540 1
1 842 . 9 1 1 A 79 79 GLU C C 79 177.000 176.893 0.107 1
1 843 . 9 1 1 A 79 79 GLU CA C 79 54.900 55.658 -0.758 1
1 844 . 9 1 1 A 79 79 GLU CB C 79 33.600 31.465 2.135 1
1 846 . 9 1 1 A 79 79 GLU N N 79 120.500 119.885 0.615 1
1 847 . 9 1 1 A 80 80 THR H H 80 8.970 9.293 -0.323 1
1 848 . 9 1 1 A 80 80 THR HA H 80 4.700 4.897 -0.197 1
1 854 . 9 1 1 A 80 80 THR C C 80 177.000 176.363 0.637 1
1 855 . 9 1 1 A 80 80 THR CA C 80 61.300 60.590 0.710 1
1 856 . 9 1 1 A 80 80 THR CB C 80 70.500 71.619 -1.119 1
1 858 . 9 1 1 A 80 80 THR N N 80 113.200 116.783 -3.583 1
1 859 . 9 1 1 A 81 81 LEU H H 81 8.610 8.915 -0.305 1
1 860 . 9 1 1 A 81 81 LEU HA H 81 4.230 4.115 0.115 1
1 870 . 9 1 1 A 81 81 LEU C C 81 177.400 177.591 -0.191 1
1 871 . 9 1 1 A 81 81 LEU CA C 81 57.700 56.857 0.843 1
1 872 . 9 1 1 A 81 81 LEU CB C 81 42.400 41.624 0.776 1
1 876 . 9 1 1 A 81 81 LEU N N 81 120.900 122.323 -1.423 1
1 877 . 9 1 1 A 82 82 ASP H H 82 8.850 7.906 0.944 1
1 878 . 9 1 1 A 82 82 ASP HA H 82 4.670 4.739 -0.069 1
1 881 . 9 1 1 A 82 82 ASP C C 82 174.100 175.818 -1.718 1
1 882 . 9 1 1 A 82 82 ASP CA C 82 52.700 53.759 -1.059 1
1 883 . 9 1 1 A 82 82 ASP CB C 82 37.900 40.948 -3.048 1
1 884 . 9 1 1 A 82 82 ASP N N 82 112.300 117.401 -5.101 1
1 885 . 9 1 1 A 83 83 ASN H H 83 7.790 8.120 -0.330 1
1 886 . 9 1 1 A 83 83 ASN HA H 83 4.270 4.308 -0.038 1
1 891 . 9 1 1 A 83 83 ASN C C 83 176.100 173.824 2.276 1
1 892 . 9 1 1 A 83 83 ASN CA C 83 55.300 54.560 0.740 1
1 893 . 9 1 1 A 83 83 ASN CB C 83 36.900 37.887 -0.987 1
1 894 . 9 1 1 A 83 83 ASN N N 83 113.000 116.475 -3.475 1
1 896 . 9 1 1 A 84 84 VAL H H 84 7.660 7.469 0.191 1
1 897 . 9 1 1 A 84 84 VAL HA H 84 4.270 4.197 0.073 1
1 905 . 9 1 1 A 84 84 VAL C C 84 175.800 175.262 0.538 1
1 906 . 9 1 1 A 84 84 VAL CA C 84 61.500 61.620 -0.120 1
1 907 . 9 1 1 A 84 84 VAL CB C 84 33.500 32.954 0.546 1
1 910 . 9 1 1 A 84 84 VAL N N 84 119.700 119.277 0.423 1
1 911 . 9 1 1 A 85 85 ARG H H 85 8.180 9.197 -1.017 1
1 912 . 9 1 1 A 85 85 ARG HA H 85 4.870 4.896 -0.026 1
1 920 . 9 1 1 A 85 85 ARG C C 85 174.000 174.899 -0.899 1
1 921 . 9 1 1 A 85 85 ARG CA C 85 55.700 54.675 1.025 1
1 922 . 9 1 1 A 85 85 ARG CB C 85 32.600 31.896 0.704 1
1 925 . 9 1 1 A 85 85 ARG N N 85 124.800 127.051 -2.251 1
1 927 . 9 1 1 A 86 86 VAL H H 86 8.570 8.269 0.301 1
1 928 . 9 1 1 A 86 86 VAL HA H 86 4.580 4.695 -0.115 1
1 936 . 9 1 1 A 86 86 VAL C C 86 175.700 175.101 0.599 1
1 937 . 9 1 1 A 86 86 VAL CA C 86 61.700 61.820 -0.120 1
1 938 . 9 1 1 A 86 86 VAL CB C 86 30.900 31.045 -0.145 1
1 941 . 9 1 1 A 86 86 VAL N N 86 127.300 124.767 2.533 1
1 942 . 9 1 1 A 87 87 VAL H H 87 8.790 8.859 -0.069 1
1 943 . 9 1 1 A 87 87 VAL HA H 87 5.010 4.751 0.259 1
1 951 . 9 1 1 A 87 87 VAL C C 87 175.500 174.746 0.754 1
1 952 . 9 1 1 A 87 87 VAL CA C 87 61.900 60.854 1.046 1
1 953 . 9 1 1 A 87 87 VAL CB C 87 36.300 32.951 3.349 1
1 956 . 9 1 1 A 87 87 VAL N N 87 125.700 129.020 -3.320 1
1 957 . 9 1 1 A 88 88 THR H H 88 8.350 9.173 -0.823 1
1 958 . 9 1 1 A 88 88 THR HA H 88 4.620 4.606 0.014 1
1 964 . 9 1 1 A 88 88 THR C C 88 173.300 172.545 0.755 1
1 965 . 9 1 1 A 88 88 THR CA C 88 61.700 60.824 0.876 1
1 966 . 9 1 1 A 88 88 THR CB C 88 70.400 72.285 -1.885 1
1 968 . 9 1 1 A 88 88 THR N N 88 117.500 121.248 -3.748 1
1 969 . 9 1 1 A 89 89 ASP H H 89 7.700 8.632 -0.932 1
1 970 . 9 1 1 A 89 89 ASP HA H 89 4.480 4.615 -0.135 1
1 973 . 9 1 1 A 89 89 ASP C C 89 175.900 177.106 -1.206 1
1 974 . 9 1 1 A 89 89 ASP CA C 89 55.900 54.579 1.321 1
1 975 . 9 1 1 A 89 89 ASP CB C 89 43.900 41.783 2.117 1
1 976 . 9 1 1 A 89 89 ASP N N 89 120.800 125.718 -4.918 1
1 977 . 9 1 1 A 90 90 TYR H H 90 8.240 9.008 -0.768 1
1 978 . 9 1 1 A 90 90 TYR HA H 90 3.920 4.184 -0.264 1
1 983 . 9 1 1 A 90 90 TYR C C 90 176.400 177.685 -1.285 1
1 984 . 9 1 1 A 90 90 TYR CA C 90 62.300 61.250 1.050 1
1 985 . 9 1 1 A 90 90 TYR CB C 90 39.500 38.940 0.560 1
1 988 . 9 1 1 A 90 90 TYR N N 90 126.100 128.319 -2.219 1
1 989 . 9 1 1 A 91 91 SER H H 91 9.160 7.829 1.331 1
1 990 . 9 1 1 A 91 91 SER HA H 91 4.000 4.108 -0.108 1
1 993 . 9 1 1 A 91 91 SER C C 91 178.000 177.318 0.682 1
1 994 . 9 1 1 A 91 91 SER CA C 91 62.600 61.440 1.160 1
1 995 . 9 1 1 A 91 91 SER CB C 91 62.200 62.699 -0.499 1
1 996 . 9 1 1 A 91 91 SER N N 91 116.600 114.767 1.833 1
1 997 . 9 1 1 A 92 92 GLU H H 92 8.590 8.072 0.518 1
1 998 . 9 1 1 A 92 92 GLU HA H 92 4.050 4.065 -0.015 1
1 1003 . 9 1 1 A 92 92 GLU C C 92 179.400 178.677 0.723 1
1 1004 . 9 1 1 A 92 92 GLU CA C 92 58.900 59.079 -0.179 1
1 1005 . 9 1 1 A 92 92 GLU CB C 92 30.600 29.366 1.234 1
1 1007 . 9 1 1 A 92 92 GLU N N 92 120.200 122.089 -1.889 1
1 1008 . 9 1 1 A 93 93 PHE H H 93 7.870 8.161 -0.291 1
1 1009 . 9 1 1 A 93 93 PHE HA H 93 4.050 4.149 -0.099 1
1 1015 . 9 1 1 A 93 93 PHE C C 93 176.500 177.728 -1.228 1
1 1016 . 9 1 1 A 93 93 PHE CA C 93 62.200 61.276 0.924 1
1 1017 . 9 1 1 A 93 93 PHE CB C 93 39.700 39.401 0.299 1
1 1021 . 9 1 1 A 93 93 PHE N N 93 120.200 120.999 -0.799 1
1 1022 . 9 1 1 A 94 94 GLN H H 94 8.190 8.227 -0.037 1
1 1023 . 9 1 1 A 94 94 GLN HA H 94 3.390 3.630 -0.240 1
1 1030 . 9 1 1 A 94 94 GLN C C 94 178.600 178.540 0.060 1
1 1031 . 9 1 1 A 94 94 GLN CA C 94 58.800 59.091 -0.291 1
1 1032 . 9 1 1 A 94 94 GLN CB C 94 28.400 28.150 0.250 1
1 1034 . 9 1 1 A 94 94 GLN N N 94 116.800 118.294 -1.494 1
1 1036 . 9 1 1 A 95 95 LYS H H 95 7.060 7.674 -0.614 1
1 1037 . 9 1 1 A 95 95 LYS HA H 95 3.780 4.121 -0.341 1
1 1046 . 9 1 1 A 95 95 LYS C C 95 179.300 179.016 0.284 1
1 1047 . 9 1 1 A 95 95 LYS CA C 95 59.900 58.764 1.136 1
1 1048 . 9 1 1 A 95 95 LYS CB C 95 32.700 31.933 0.767 1
1 1052 . 9 1 1 A 95 95 LYS N N 95 117.500 120.915 -3.415 1
1 1053 . 9 1 1 A 96 96 ILE H H 96 7.240 7.769 -0.529 1
1 1054 . 9 1 1 A 96 96 ILE HA H 96 3.420 3.529 -0.109 1
1 1064 . 9 1 1 A 96 96 ILE C C 96 177.800 178.297 -0.497 1
1 1065 . 9 1 1 A 96 96 ILE CA C 96 64.300 64.994 -0.694 1
1 1066 . 9 1 1 A 96 96 ILE CB C 96 37.400 37.289 0.111 1
1 1070 . 9 1 1 A 96 96 ILE N N 96 120.700 121.148 -0.448 1
1 1071 . 9 1 1 A 97 97 LEU H H 97 7.690 7.980 -0.290 1
1 1072 . 9 1 1 A 97 97 LEU HA H 97 3.580 3.791 -0.211 1
1 1082 . 9 1 1 A 97 97 LEU C C 97 179.900 179.170 0.730 1
1 1083 . 9 1 1 A 97 97 LEU CA C 97 58.100 57.011 1.089 1
1 1084 . 9 1 1 A 97 97 LEU CB C 97 41.500 40.935 0.565 1
1 1088 . 9 1 1 A 97 97 LEU N N 97 120.000 120.123 -0.123 1
1 1089 . 9 1 1 A 98 98 LYS H H 98 7.510 7.876 -0.366 1
1 1090 . 9 1 1 A 98 98 LYS HA H 98 3.950 4.037 -0.087 1
1 1099 . 9 1 1 A 98 98 LYS C C 98 178.700 179.038 -0.338 1
1 1100 . 9 1 1 A 98 98 LYS CA C 98 58.700 59.573 -0.873 1
1 1101 . 9 1 1 A 98 98 LYS CB C 98 32.500 32.180 0.320 1
1 1105 . 9 1 1 A 98 98 LYS N N 98 117.300 120.429 -3.129 1
1 1106 . 9 1 1 A 99 99 LYS H H 99 7.470 7.525 -0.055 1
1 1107 . 9 1 1 A 99 99 LYS HA H 99 4.080 4.000 0.080 1
1 1116 . 9 1 1 A 99 99 LYS C C 99 178.100 179.060 -0.960 1
1 1117 . 9 1 1 A 99 99 LYS CA C 99 58.400 59.935 -1.535 1
1 1118 . 9 1 1 A 99 99 LYS CB C 99 33.000 32.199 0.801 1
1 1122 . 9 1 1 A 99 99 LYS N N 99 119.000 119.833 -0.833 1
1 1123 . 9 1 1 A 100 100 ARG H H 100 8.020 7.340 0.680 1
1 1124 . 9 1 1 A 100 100 ARG HA H 100 4.210 4.284 -0.074 1
1 1131 . 9 1 1 A 100 100 ARG C C 100 177.500 177.097 0.403 1
1 1132 . 9 1 1 A 100 100 ARG CA C 100 56.700 55.904 0.796 1
1 1133 . 9 1 1 A 100 100 ARG CB C 100 30.500 31.075 -0.575 1
1 1136 . 9 1 1 A 100 100 ARG N N 100 117.300 116.321 0.979 1
1 1137 . 9 1 1 A 101 101 GLY H H 101 7.910 7.849 0.061 1
1 1138 . 9 1 1 A 101 101 GLY HA2 H 101 3.980 3.945 0.035 1
1 1139 . 9 1 1 A 101 101 GLY HA3 H 101 4.020 3.957 0.063 1
1 1140 . 9 1 1 A 101 101 GLY C C 101 174.400 174.961 -0.561 1
1 1141 . 9 1 1 A 101 101 GLY CA C 101 46.000 46.578 -0.578 1
1 1142 . 9 1 1 A 101 101 GLY N N 101 108.000 108.431 -0.431 1
1 1143 . 9 1 1 A 102 102 THR H H 102 7.880 7.873 0.007 1
1 1144 . 9 1 1 A 102 102 THR HA H 102 4.360 4.162 0.198 1
1 1149 . 9 1 1 A 102 102 THR C C 102 174.400 174.670 -0.270 1
1 1150 . 9 1 1 A 102 102 THR CA C 102 62.100 63.679 -1.579 1
1 1151 . 9 1 1 A 102 102 THR CB C 102 70.500 69.024 1.476 1
1 1153 . 9 1 1 A 102 102 THR N N 102 113.900 114.704 -0.804 1
1 1154 . 9 1 1 A 103 103 LYS H H 103 8.440 8.918 -0.478 1
1 1155 . 9 1 1 A 103 103 LYS C C 103 176.400 177.738 -1.338 1
1 1156 . 9 1 1 A 103 103 LYS CA C 103 56.600 57.385 -0.785 1
1 1157 . 9 1 1 A 103 103 LYS CB C 103 33.300 31.924 1.376 1
1 1158 . 9 1 1 A 103 103 LYS N N 103 124.000 126.742 -2.742 1
1 1159 . 9 1 1 A 104 104 LEU H H 104 8.180 7.798 0.382 1
1 1160 . 9 1 1 A 104 104 LEU HA H 104 4.270 4.272 -0.002 1
1 1170 . 9 1 1 A 104 104 LEU C C 104 177.100 177.032 0.068 1
1 1171 . 9 1 1 A 104 104 LEU CA C 104 55.500 56.328 -0.828 1
1 1172 . 9 1 1 A 104 104 LEU CB C 104 42.500 42.854 -0.354 1
1 1176 . 9 1 1 A 104 104 LEU N N 104 123.500 118.366 5.134 1
1 1177 . 9 1 1 A 105 105 GLU H H 105 8.270 7.385 0.885 1
1 1178 . 9 1 1 A 105 105 GLU CA C 105 56.700 54.370 2.330 1
1 1179 . 9 1 1 A 105 105 GLU CB C 105 30.800 32.845 -2.045 1
1 13 . 10 1 1 A 2 2 ASN HA H 2 4.980 5.122 -0.142 1
1 18 . 10 1 1 A 2 2 ASN C C 2 176.300 176.333 -0.033 1
1 19 . 10 1 1 A 2 2 ASN CA C 2 52.500 51.870 0.630 1
1 20 . 10 1 1 A 2 2 ASN CB C 2 40.900 41.697 -0.797 1
1 22 . 10 1 1 A 3 3 SER H H 3 9.940 9.455 0.485 1
1 23 . 10 1 1 A 3 3 SER HA H 3 3.720 4.168 -0.448 1
1 26 . 10 1 1 A 3 3 SER C C 3 175.900 176.766 -0.866 1
1 27 . 10 1 1 A 3 3 SER CA C 3 63.300 61.363 1.937 1
1 28 . 10 1 1 A 3 3 SER CB C 3 61.700 62.649 -0.949 1
1 29 . 10 1 1 A 3 3 SER N N 3 118.200 117.172 1.028 1
1 30 . 10 1 1 A 4 4 GLU H H 4 8.450 8.111 0.339 1
1 31 . 10 1 1 A 4 4 GLU HA H 4 4.010 3.965 0.045 1
1 36 . 10 1 1 A 4 4 GLU C C 4 178.800 179.079 -0.279 1
1 37 . 10 1 1 A 4 4 GLU CA C 4 60.300 59.168 1.132 1
1 38 . 10 1 1 A 4 4 GLU CB C 4 29.100 29.626 -0.526 1
1 40 . 10 1 1 A 4 4 GLU N N 4 123.600 122.642 0.958 1
1 41 . 10 1 1 A 5 5 VAL H H 5 7.590 7.929 -0.339 1
1 42 . 10 1 1 A 5 5 VAL HA H 5 3.850 3.675 0.175 1
1 50 . 10 1 1 A 5 5 VAL C C 5 179.100 178.364 0.736 1
1 51 . 10 1 1 A 5 5 VAL CA C 5 65.800 66.433 -0.633 1
1 52 . 10 1 1 A 5 5 VAL CB C 5 32.300 31.479 0.821 1
1 55 . 10 1 1 A 5 5 VAL N N 5 119.300 119.703 -0.403 1
1 56 . 10 1 1 A 6 6 ILE H H 6 7.240 8.250 -1.010 1
1 57 . 10 1 1 A 6 6 ILE HA H 6 3.580 3.546 0.034 1
1 67 . 10 1 1 A 6 6 ILE C C 6 177.000 178.006 -1.006 1
1 68 . 10 1 1 A 6 6 ILE CA C 6 65.300 65.509 -0.209 1
1 69 . 10 1 1 A 6 6 ILE CB C 6 37.900 37.535 0.365 1
1 73 . 10 1 1 A 6 6 ILE N N 6 120.300 120.824 -0.524 1
1 74 . 10 1 1 A 7 7 LYS H H 7 8.050 8.189 -0.139 1
1 75 . 10 1 1 A 7 7 LYS HA H 7 3.570 3.733 -0.163 1
1 84 . 10 1 1 A 7 7 LYS C C 7 178.700 180.096 -1.396 1
1 85 . 10 1 1 A 7 7 LYS CA C 7 61.300 60.568 0.732 1
1 86 . 10 1 1 A 7 7 LYS CB C 7 32.200 32.325 -0.125 1
1 90 . 10 1 1 A 7 7 LYS N N 7 119.200 119.216 -0.016 1
1 91 . 10 1 1 A 8 8 GLU H H 8 8.100 8.119 -0.019 1
1 92 . 10 1 1 A 8 8 GLU HA H 8 4.000 4.113 -0.113 1
1 97 . 10 1 1 A 8 8 GLU C C 8 178.500 179.282 -0.782 1
1 98 . 10 1 1 A 8 8 GLU CA C 8 59.700 59.184 0.516 1
1 99 . 10 1 1 A 8 8 GLU CB C 8 29.600 29.582 0.018 1
1 101 . 10 1 1 A 8 8 GLU N N 8 119.400 120.278 -0.878 1
1 102 . 10 1 1 A 9 9 PHE H H 9 7.720 8.093 -0.373 1
1 103 . 10 1 1 A 9 9 PHE HA H 9 4.160 4.083 0.077 1
1 109 . 10 1 1 A 9 9 PHE C C 9 176.900 177.099 -0.199 1
1 110 . 10 1 1 A 9 9 PHE CA C 9 61.300 61.213 0.087 1
1 111 . 10 1 1 A 9 9 PHE CB C 9 39.400 39.088 0.312 1
1 115 . 10 1 1 A 9 9 PHE N N 9 121.300 122.010 -0.710 1
1 116 . 10 1 1 A 10 10 LEU H H 10 8.060 8.793 -0.733 1
1 117 . 10 1 1 A 10 10 LEU HA H 10 3.660 3.816 -0.156 1
1 127 . 10 1 1 A 10 10 LEU C C 10 179.000 179.237 -0.237 1
1 128 . 10 1 1 A 10 10 LEU CA C 10 58.000 57.904 0.096 1
1 129 . 10 1 1 A 10 10 LEU CB C 10 41.400 41.531 -0.131 1
1 133 . 10 1 1 A 10 10 LEU N N 10 118.000 119.336 -1.336 1
1 134 . 10 1 1 A 11 11 GLU H H 11 7.990 8.724 -0.734 1
1 135 . 10 1 1 A 11 11 GLU HA H 11 4.110 4.059 0.051 1
1 140 . 10 1 1 A 11 11 GLU C C 11 174.200 178.792 -4.592 1
1 141 . 10 1 1 A 11 11 GLU CA C 11 59.200 59.769 -0.569 1
1 142 . 10 1 1 A 11 11 GLU CB C 11 29.300 29.184 0.116 1
1 144 . 10 1 1 A 11 11 GLU N N 11 118.300 118.097 0.203 1
1 145 . 10 1 1 A 12 12 ASP H H 12 8.080 7.770 0.310 1
1 146 . 10 1 1 A 12 12 ASP HA H 12 4.340 4.358 -0.018 1
1 149 . 10 1 1 A 12 12 ASP C C 12 178.900 178.174 0.726 1
1 150 . 10 1 1 A 12 12 ASP CA C 12 57.600 57.365 0.235 1
1 151 . 10 1 1 A 12 12 ASP CB C 12 41.000 40.927 0.073 1
1 152 . 10 1 1 A 12 12 ASP N N 12 121.800 119.486 2.314 1
1 153 . 10 1 1 A 13 13 ILE H H 13 7.610 7.682 -0.072 1
1 154 . 10 1 1 A 13 13 ILE HA H 13 4.240 3.982 0.258 1
1 164 . 10 1 1 A 13 13 ILE C C 13 176.800 176.404 0.396 1
1 165 . 10 1 1 A 13 13 ILE CA C 13 62.100 61.761 0.339 1
1 166 . 10 1 1 A 13 13 ILE CB C 13 38.300 38.999 -0.699 1
1 170 . 10 1 1 A 13 13 ILE N N 13 110.800 111.913 -1.113 1
1 171 . 10 1 1 A 14 14 GLY H H 14 7.640 8.352 -0.712 1
1 172 . 10 1 1 A 14 14 GLY HA2 H 14 3.810 3.970 -0.160 1
1 173 . 10 1 1 A 14 14 GLY HA3 H 14 3.880 3.974 -0.094 1
1 174 . 10 1 1 A 14 14 GLY C C 14 175.200 173.876 1.324 1
1 175 . 10 1 1 A 14 14 GLY CA C 14 46.900 46.189 0.711 1
1 176 . 10 1 1 A 14 14 GLY N N 14 111.800 112.172 -0.372 1
1 177 . 10 1 1 A 15 15 GLU H H 15 7.870 7.699 0.171 1
1 178 . 10 1 1 A 15 15 GLU HA H 15 4.680 5.149 -0.469 1
1 183 . 10 1 1 A 15 15 GLU C C 15 175.100 173.827 1.273 1
1 184 . 10 1 1 A 15 15 GLU CA C 15 54.800 55.115 -0.315 1
1 185 . 10 1 1 A 15 15 GLU CB C 15 32.200 33.216 -1.016 1
1 187 . 10 1 1 A 15 15 GLU N N 15 119.200 120.597 -1.397 1
1 188 . 10 1 1 A 16 16 ASP H H 16 8.220 8.866 -0.646 1
1 189 . 10 1 1 A 16 16 ASP HA H 16 4.680 4.822 -0.142 1
1 192 . 10 1 1 A 16 16 ASP C C 16 174.600 174.582 0.018 1
1 193 . 10 1 1 A 16 16 ASP CA C 16 53.600 52.534 1.066 1
1 194 . 10 1 1 A 16 16 ASP CB C 16 42.900 41.639 1.261 1
1 195 . 10 1 1 A 16 16 ASP N N 16 120.600 128.029 -7.429 1
1 196 . 10 1 1 A 17 17 TYR H H 17 7.540 8.346 -0.806 1
1 197 . 10 1 1 A 17 17 TYR HA H 17 4.910 5.768 -0.858 1
1 202 . 10 1 1 A 17 17 TYR C C 17 173.600 174.476 -0.876 1
1 203 . 10 1 1 A 17 17 TYR CA C 17 56.200 55.034 1.166 1
1 204 . 10 1 1 A 17 17 TYR CB C 17 41.100 41.947 -0.847 1
1 207 . 10 1 1 A 17 17 TYR N N 17 112.700 124.276 -11.576 1
1 208 . 10 1 1 A 18 18 ILE H H 18 7.950 8.876 -0.926 1
1 209 . 10 1 1 A 18 18 ILE HA H 18 4.330 4.570 -0.240 1
1 219 . 10 1 1 A 18 18 ILE C C 18 174.700 174.645 0.055 1
1 220 . 10 1 1 A 18 18 ILE CA C 18 60.300 60.765 -0.465 1
1 221 . 10 1 1 A 18 18 ILE CB C 18 41.000 38.101 2.899 1
1 225 . 10 1 1 A 18 18 ILE N N 18 120.400 121.786 -1.386 1
1 226 . 10 1 1 A 19 19 GLU H H 19 8.760 9.085 -0.325 1
1 227 . 10 1 1 A 19 19 GLU HA H 19 5.200 4.832 0.368 1
1 232 . 10 1 1 A 19 19 GLU C C 19 175.200 175.122 0.078 1
1 233 . 10 1 1 A 19 19 GLU CA C 19 55.500 55.699 -0.199 1
1 234 . 10 1 1 A 19 19 GLU CB C 19 32.400 30.541 1.859 1
1 236 . 10 1 1 A 19 19 GLU N N 19 129.000 128.416 0.584 1
1 237 . 10 1 1 A 20 20 LEU H H 20 8.730 9.073 -0.343 1
1 238 . 10 1 1 A 20 20 LEU HA H 20 4.620 4.884 -0.264 1
1 248 . 10 1 1 A 20 20 LEU C C 20 176.200 175.838 0.362 1
1 249 . 10 1 1 A 20 20 LEU CA C 20 54.100 53.585 0.515 1
1 250 . 10 1 1 A 20 20 LEU CB C 20 44.400 43.221 1.179 1
1 254 . 10 1 1 A 20 20 LEU N N 20 128.400 127.889 0.511 1
1 255 . 10 1 1 A 21 21 GLU H H 21 8.700 8.677 0.023 1
1 256 . 10 1 1 A 21 21 GLU HA H 21 3.870 3.938 -0.068 1
1 261 . 10 1 1 A 21 21 GLU C C 21 176.100 177.143 -1.043 1
1 262 . 10 1 1 A 21 21 GLU CA C 21 58.800 58.292 0.508 1
1 263 . 10 1 1 A 21 21 GLU CB C 21 28.200 29.369 -1.169 1
1 265 . 10 1 1 A 21 21 GLU N N 21 122.600 121.833 0.767 1
1 266 . 10 1 1 A 22 22 ASN H H 22 8.640 8.954 -0.314 1
1 267 . 10 1 1 A 22 22 ASN HA H 22 4.540 4.308 0.232 1
1 272 . 10 1 1 A 22 22 ASN C C 22 173.800 173.946 -0.146 1
1 273 . 10 1 1 A 22 22 ASN CA C 22 54.600 54.961 -0.361 1
1 274 . 10 1 1 A 22 22 ASN CB C 22 38.400 37.164 1.236 1
1 275 . 10 1 1 A 22 22 ASN N N 22 118.000 119.039 -1.039 1
1 277 . 10 1 1 A 23 23 GLU H H 23 7.740 7.850 -0.110 1
1 278 . 10 1 1 A 23 23 GLU HA H 23 5.430 4.979 0.451 1
1 283 . 10 1 1 A 23 23 GLU C C 23 175.400 175.380 0.020 1
1 284 . 10 1 1 A 23 23 GLU CA C 23 54.900 55.010 -0.110 1
1 285 . 10 1 1 A 23 23 GLU CB C 23 34.500 31.807 2.693 1
1 287 . 10 1 1 A 23 23 GLU N N 23 116.400 117.787 -1.387 1
1 288 . 10 1 1 A 24 24 ILE H H 24 9.050 9.017 0.033 1
1 289 . 10 1 1 A 24 24 ILE HA H 24 4.810 4.791 0.019 1
1 299 . 10 1 1 A 24 24 ILE C C 24 174.600 174.658 -0.058 1
1 300 . 10 1 1 A 24 24 ILE CA C 24 60.700 60.256 0.444 1
1 301 . 10 1 1 A 24 24 ILE CB C 24 41.300 39.400 1.900 1
1 305 . 10 1 1 A 24 24 ILE N N 24 122.800 125.441 -2.641 1
1 306 . 10 1 1 A 25 25 HIS H H 25 9.490 9.330 0.160 1
1 307 . 10 1 1 A 25 25 HIS HA H 25 5.090 5.697 -0.607 1
1 312 . 10 1 1 A 25 25 HIS C C 25 176.100 174.939 1.161 1
1 313 . 10 1 1 A 25 25 HIS CA C 25 56.100 54.992 1.108 1
1 314 . 10 1 1 A 25 25 HIS CB C 25 33.100 31.713 1.387 1
1 317 . 10 1 1 A 25 25 HIS N N 25 127.300 126.089 1.211 1
1 318 . 10 1 1 A 26 26 LEU H H 26 8.820 8.704 0.116 1
1 319 . 10 1 1 A 26 26 LEU HA H 26 5.160 5.053 0.107 1
1 329 . 10 1 1 A 26 26 LEU C C 26 178.000 176.241 1.759 1
1 330 . 10 1 1 A 26 26 LEU CA C 26 52.900 53.497 -0.597 1
1 331 . 10 1 1 A 26 26 LEU CB C 26 48.100 45.078 3.022 1
1 335 . 10 1 1 A 26 26 LEU N N 26 121.600 125.122 -3.522 1
1 336 . 10 1 1 A 27 27 LYS H H 27 8.990 9.034 -0.044 1
1 337 . 10 1 1 A 27 27 LYS HA H 27 4.630 4.529 0.101 1
1 345 . 10 1 1 A 27 27 LYS CA C 27 55.700 54.683 1.017 1
1 346 . 10 1 1 A 27 27 LYS CB C 27 31.900 32.134 -0.234 1
1 350 . 10 1 1 A 27 27 LYS N N 27 125.900 121.223 4.677 1
1 351 . 10 1 1 A 28 28 PRO HA H 28 4.500 4.422 0.078 1
1 358 . 10 1 1 A 28 28 PRO C C 28 177.900 178.045 -0.145 1
1 359 . 10 1 1 A 28 28 PRO CA C 28 67.400 65.807 1.593 1
1 360 . 10 1 1 A 28 28 PRO CB C 28 32.100 32.095 0.005 1
1 363 . 10 1 1 A 29 29 GLU H H 29 9.880 8.447 1.433 1
1 364 . 10 1 1 A 29 29 GLU HA H 29 4.140 4.223 -0.083 1
1 369 . 10 1 1 A 29 29 GLU C C 29 178.800 179.345 -0.545 1
1 370 . 10 1 1 A 29 29 GLU CA C 29 60.600 59.687 0.913 1
1 371 . 10 1 1 A 29 29 GLU CB C 29 29.200 29.635 -0.435 1
1 373 . 10 1 1 A 29 29 GLU N N 29 117.100 118.337 -1.237 1
1 374 . 10 1 1 A 30 30 VAL H H 30 7.050 8.115 -1.065 1
1 375 . 10 1 1 A 30 30 VAL HA H 30 3.850 3.972 -0.122 1
1 383 . 10 1 1 A 30 30 VAL C C 30 177.700 178.233 -0.533 1
1 384 . 10 1 1 A 30 30 VAL CA C 30 65.600 65.764 -0.164 1
1 385 . 10 1 1 A 30 30 VAL CB C 30 32.100 31.768 0.332 1
1 388 . 10 1 1 A 30 30 VAL N N 30 120.900 120.284 0.616 1
1 389 . 10 1 1 A 31 31 PHE H H 31 8.980 8.923 0.057 1
1 390 . 10 1 1 A 31 31 PHE HA H 31 3.870 4.258 -0.388 1
1 394 . 10 1 1 A 31 31 PHE C C 31 176.700 177.166 -0.466 1
1 395 . 10 1 1 A 31 31 PHE CA C 31 62.200 61.897 0.303 1
1 396 . 10 1 1 A 31 31 PHE CB C 31 39.300 39.082 0.218 1
1 398 . 10 1 1 A 31 31 PHE N N 31 121.100 120.924 0.176 1
1 399 . 10 1 1 A 32 32 TYR H H 32 8.640 8.484 0.156 1
1 400 . 10 1 1 A 32 32 TYR HA H 32 3.880 4.813 -0.933 1
1 405 . 10 1 1 A 32 32 TYR C C 32 176.000 178.020 -2.020 1
1 406 . 10 1 1 A 32 32 TYR CA C 32 63.300 62.157 1.143 1
1 407 . 10 1 1 A 32 32 TYR CB C 32 39.100 39.036 0.064 1
1 410 . 10 1 1 A 32 32 TYR N N 32 117.400 120.888 -3.488 1
1 411 . 10 1 1 A 33 33 GLU H H 33 7.400 8.086 -0.686 1
1 412 . 10 1 1 A 33 33 GLU HA H 33 4.050 4.032 0.018 1
1 417 . 10 1 1 A 33 33 GLU C C 33 180.200 179.055 1.145 1
1 418 . 10 1 1 A 33 33 GLU CA C 33 59.500 59.047 0.453 1
1 419 . 10 1 1 A 33 33 GLU CB C 33 29.300 29.224 0.076 1
1 421 . 10 1 1 A 33 33 GLU N N 33 116.100 119.277 -3.177 1
1 422 . 10 1 1 A 34 34 VAL H H 34 8.530 7.883 0.647 1
1 423 . 10 1 1 A 34 34 VAL HA H 34 3.350 3.472 -0.122 1
1 431 . 10 1 1 A 34 34 VAL C C 34 175.800 178.098 -2.298 1
1 432 . 10 1 1 A 34 34 VAL CA C 34 66.400 66.124 0.276 1
1 433 . 10 1 1 A 34 34 VAL CB C 34 32.200 31.542 0.658 1
1 436 . 10 1 1 A 34 34 VAL N N 34 120.600 120.070 0.530 1
1 437 . 10 1 1 A 35 35 TRP H H 35 9.100 8.325 0.775 1
1 438 . 10 1 1 A 35 35 TRP HA H 35 3.340 3.722 -0.382 1
1 447 . 10 1 1 A 35 35 TRP C C 35 178.000 178.239 -0.239 1
1 448 . 10 1 1 A 35 35 TRP CA C 35 61.800 59.944 1.856 1
1 449 . 10 1 1 A 35 35 TRP CB C 35 27.900 29.807 -1.907 1
1 455 . 10 1 1 A 35 35 TRP N N 35 121.700 121.446 0.254 1
1 457 . 10 1 1 A 36 36 LYS H H 36 7.970 7.711 0.259 1
1 458 . 10 1 1 A 36 36 LYS HA H 36 3.330 3.592 -0.262 1
1 467 . 10 1 1 A 36 36 LYS C C 36 180.000 178.462 1.538 1
1 468 . 10 1 1 A 36 36 LYS CA C 36 59.000 59.191 -0.191 1
1 469 . 10 1 1 A 36 36 LYS CB C 36 31.800 31.979 -0.179 1
1 473 . 10 1 1 A 36 36 LYS N N 36 116.300 118.466 -2.166 1
1 474 . 10 1 1 A 37 37 TYR H H 37 7.750 8.088 -0.338 1
1 475 . 10 1 1 A 37 37 TYR HA H 37 3.940 3.928 0.012 1
1 480 . 10 1 1 A 37 37 TYR C C 37 177.600 177.777 -0.177 1
1 481 . 10 1 1 A 37 37 TYR CA C 37 61.200 61.142 0.058 1
1 482 . 10 1 1 A 37 37 TYR CB C 37 38.800 38.459 0.341 1
1 485 . 10 1 1 A 37 37 TYR N N 37 122.700 120.994 1.706 1
1 486 . 10 1 1 A 38 38 VAL H H 38 7.660 7.649 0.011 1
1 487 . 10 1 1 A 38 38 VAL HA H 38 3.870 3.814 0.056 1
1 495 . 10 1 1 A 38 38 VAL C C 38 175.600 176.306 -0.706 1
1 496 . 10 1 1 A 38 38 VAL CA C 38 61.100 62.835 -1.735 1
1 497 . 10 1 1 A 38 38 VAL CB C 38 30.700 32.319 -1.619 1
1 500 . 10 1 1 A 38 38 VAL N N 38 108.200 113.468 -5.268 1
1 501 . 10 1 1 A 39 39 GLY H H 39 7.090 7.357 -0.267 1
1 502 . 10 1 1 A 39 39 GLY HA2 H 39 3.320 3.749 -0.429 1
1 503 . 10 1 1 A 39 39 GLY HA3 H 39 3.730 3.786 -0.056 1
1 504 . 10 1 1 A 39 39 GLY C C 39 173.600 174.485 -0.885 1
1 505 . 10 1 1 A 39 39 GLY CA C 39 46.100 44.965 1.135 1
1 506 . 10 1 1 A 39 39 GLY N N 39 107.600 110.563 -2.963 1
1 507 . 10 1 1 A 40 40 GLU H H 40 7.730 7.897 -0.167 1
1 508 . 10 1 1 A 40 40 GLU HA H 40 1.090 2.696 -1.606 1
1 513 . 10 1 1 A 40 40 GLU CA C 40 55.700 56.332 -0.632 1
1 514 . 10 1 1 A 40 40 GLU CB C 40 27.200 27.355 -0.155 1
1 516 . 10 1 1 A 40 40 GLU N N 40 114.400 113.633 0.767 1
1 517 . 10 1 1 A 41 41 PRO HA H 41 4.310 4.613 -0.303 1
1 524 . 10 1 1 A 41 41 PRO CA C 41 62.300 62.205 0.095 1
1 525 . 10 1 1 A 41 41 PRO CB C 41 32.700 32.941 -0.241 1
1 528 . 10 1 1 A 42 42 GLU H H 42 8.110 8.733 -0.623 1
1 529 . 10 1 1 A 42 42 GLU C C 42 175.800 176.501 -0.701 1
1 530 . 10 1 1 A 42 42 GLU CA C 42 57.800 56.897 0.903 1
1 531 . 10 1 1 A 42 42 GLU CB C 42 30.600 30.561 0.039 1
1 533 . 10 1 1 A 42 42 GLU N N 42 119.100 120.992 -1.892 1
1 534 . 10 1 1 A 43 43 LEU H H 43 8.140 8.947 -0.807 1
1 535 . 10 1 1 A 43 43 LEU HA H 43 4.840 5.099 -0.259 1
1 545 . 10 1 1 A 43 43 LEU C C 43 177.300 175.724 1.576 1
1 546 . 10 1 1 A 43 43 LEU CA C 43 53.700 53.420 0.280 1
1 547 . 10 1 1 A 43 43 LEU CB C 43 43.900 43.992 -0.092 1
1 551 . 10 1 1 A 43 43 LEU N N 43 124.700 123.831 0.869 1
1 552 . 10 1 1 A 44 44 LYS H H 44 8.640 8.760 -0.120 1
1 553 . 10 1 1 A 44 44 LYS HA H 44 4.500 4.668 -0.168 1
1 562 . 10 1 1 A 44 44 LYS C C 44 174.500 175.677 -1.177 1
1 563 . 10 1 1 A 44 44 LYS CA C 44 54.700 55.254 -0.554 1
1 564 . 10 1 1 A 44 44 LYS CB C 44 36.200 34.027 2.173 1
1 568 . 10 1 1 A 44 44 LYS N N 44 123.300 123.519 -0.219 1
1 569 . 10 1 1 A 45 45 THR H H 45 7.990 8.716 -0.726 1
1 570 . 10 1 1 A 45 45 THR HA H 45 5.700 5.665 0.035 1
1 575 . 10 1 1 A 45 45 THR C C 45 175.100 173.959 1.141 1
1 576 . 10 1 1 A 45 45 THR CA C 45 59.600 59.248 0.352 1
1 577 . 10 1 1 A 45 45 THR CB C 45 73.400 71.440 1.960 1
1 579 . 10 1 1 A 45 45 THR N N 45 106.900 113.496 -6.596 1
1 580 . 10 1 1 A 46 46 TYR H H 46 8.470 9.170 -0.700 1
1 581 . 10 1 1 A 46 46 TYR HA H 46 4.930 5.877 -0.947 1
1 586 . 10 1 1 A 46 46 TYR C C 46 172.400 173.732 -1.332 1
1 587 . 10 1 1 A 46 46 TYR CA C 46 57.100 55.165 1.935 1
1 588 . 10 1 1 A 46 46 TYR CB C 46 40.200 42.179 -1.979 1
1 591 . 10 1 1 A 46 46 TYR N N 46 117.100 119.275 -2.175 1
1 592 . 10 1 1 A 47 47 VAL H H 47 8.430 9.072 -0.642 1
1 593 . 10 1 1 A 47 47 VAL HA H 47 4.890 4.435 0.455 1
1 601 . 10 1 1 A 47 47 VAL C C 47 175.800 174.702 1.098 1
1 602 . 10 1 1 A 47 47 VAL CA C 47 60.800 62.077 -1.277 1
1 603 . 10 1 1 A 47 47 VAL CB C 47 34.800 32.124 2.676 1
1 606 . 10 1 1 A 47 47 VAL N N 47 119.200 122.141 -2.941 1
1 607 . 10 1 1 A 48 48 ILE H H 48 8.680 8.727 -0.047 1
1 608 . 10 1 1 A 48 48 ILE HA H 48 4.560 5.094 -0.534 1
1 618 . 10 1 1 A 48 48 ILE C C 48 174.500 173.980 0.520 1
1 619 . 10 1 1 A 48 48 ILE CA C 48 59.700 58.718 0.982 1
1 620 . 10 1 1 A 48 48 ILE CB C 48 41.500 40.927 0.573 1
1 624 . 10 1 1 A 48 48 ILE N N 48 124.400 129.186 -4.786 1
1 625 . 10 1 1 A 49 49 GLU H H 49 8.320 8.720 -0.400 1
1 626 . 10 1 1 A 49 49 GLU C C 49 175.500 174.905 0.595 1
1 627 . 10 1 1 A 49 49 GLU CA C 49 55.500 55.476 0.024 1
1 628 . 10 1 1 A 49 49 GLU CB C 49 31.800 29.419 2.381 1
1 630 . 10 1 1 A 49 49 GLU N N 49 123.400 128.069 -4.669 1
1 631 . 10 1 1 A 50 50 ASP H H 50 8.610 8.776 -0.166 1
1 632 . 10 1 1 A 50 50 ASP C C 50 175.100 175.382 -0.282 1
1 633 . 10 1 1 A 50 50 ASP CA C 50 53.100 52.986 0.114 1
1 634 . 10 1 1 A 50 50 ASP CB C 50 44.000 41.696 2.304 1
1 635 . 10 1 1 A 50 50 ASP N N 50 124.300 124.664 -0.364 1
1 636 . 10 1 1 A 51 51 GLU H H 51 8.450 8.653 -0.203 1
1 637 . 10 1 1 A 51 51 GLU C C 51 175.900 176.076 -0.176 1
1 638 . 10 1 1 A 51 51 GLU CA C 51 56.000 56.883 -0.883 1
1 639 . 10 1 1 A 51 51 GLU CB C 51 31.700 30.378 1.322 1
1 640 . 10 1 1 A 51 51 GLU N N 51 121.300 124.871 -3.571 1
1 641 . 10 1 1 A 52 52 ILE H H 52 8.480 8.752 -0.272 1
1 642 . 10 1 1 A 52 52 ILE C C 52 175.400 175.022 0.378 1
1 643 . 10 1 1 A 52 52 ILE CA C 52 60.400 60.291 0.109 1
1 644 . 10 1 1 A 52 52 ILE CB C 52 40.000 37.668 2.332 1
1 645 . 10 1 1 A 52 52 ILE N N 52 122.700 123.211 -0.511 1
1 646 . 10 1 1 A 53 53 VAL H H 53 8.140 8.963 -0.823 1
1 647 . 10 1 1 A 53 53 VAL C C 53 175.600 174.992 0.608 1
1 648 . 10 1 1 A 53 53 VAL CA C 53 61.900 61.696 0.204 1
1 649 . 10 1 1 A 53 53 VAL CB C 53 33.200 31.143 2.057 1
1 650 . 10 1 1 A 53 53 VAL N N 53 124.400 128.475 -4.075 1
1 651 . 10 1 1 A 54 54 GLU H H 54 8.540 8.480 0.060 1
1 652 . 10 1 1 A 54 54 GLU CA C 54 55.600 54.367 1.233 1
1 653 . 10 1 1 A 54 54 GLU CB C 54 34.300 30.761 3.539 1
1 654 . 10 1 1 A 54 54 GLU N N 54 125.900 127.479 -1.579 1
1 655 . 10 1 1 A 55 55 PRO C C 55 177.500 176.593 0.907 1
1 656 . 10 1 1 A 55 55 PRO CA C 55 63.400 62.822 0.578 1
1 657 . 10 1 1 A 55 55 PRO CB C 55 32.300 33.122 -0.822 1
1 658 . 10 1 1 A 56 56 GLY H H 56 8.420 8.542 -0.122 1
1 659 . 10 1 1 A 56 56 GLY HA2 H 56 3.830 4.403 -0.573 1
1 660 . 10 1 1 A 56 56 GLY HA3 H 56 4.000 4.407 -0.407 1
1 661 . 10 1 1 A 56 56 GLY C C 56 174.500 174.184 0.316 1
1 662 . 10 1 1 A 56 56 GLY CA C 56 45.400 45.903 -0.503 1
1 663 . 10 1 1 A 56 56 GLY N N 56 109.700 106.623 3.077 1
1 664 . 10 1 1 A 57 57 GLU H H 57 8.180 7.812 0.368 1
1 665 . 10 1 1 A 57 57 GLU C C 57 176.300 174.868 1.432 1
1 666 . 10 1 1 A 57 57 GLU CA C 57 57.500 55.392 2.108 1
1 667 . 10 1 1 A 57 57 GLU CB C 57 30.400 27.631 2.769 1
1 668 . 10 1 1 A 57 57 GLU N N 57 120.900 120.430 0.470 1
1 669 . 10 1 1 A 58 58 TYR H H 58 8.020 8.857 -0.837 1
1 670 . 10 1 1 A 58 58 TYR C C 58 175.100 175.641 -0.541 1
1 671 . 10 1 1 A 58 58 TYR CA C 58 57.400 58.891 -1.491 1
1 672 . 10 1 1 A 58 58 TYR CB C 58 38.900 40.769 -1.869 1
1 673 . 10 1 1 A 58 58 TYR N N 58 118.800 122.486 -3.686 1
1 674 . 10 1 1 A 59 59 ASP H H 59 7.950 7.847 0.103 1
1 675 . 10 1 1 A 59 59 ASP CA C 59 52.700 52.483 0.217 1
1 676 . 10 1 1 A 59 59 ASP CB C 59 41.000 42.340 -1.340 1
1 677 . 10 1 1 A 59 59 ASP N N 59 123.500 115.024 8.476 1
1 678 . 10 1 1 A 61 61 PRO HA H 61 4.510 4.493 0.017 1
1 685 . 10 1 1 A 61 61 PRO C C 61 176.500 176.019 0.481 1
1 686 . 10 1 1 A 61 61 PRO CA C 61 63.700 63.988 -0.288 1
1 687 . 10 1 1 A 61 61 PRO CB C 61 34.200 31.837 2.363 1
1 690 . 10 1 1 A 62 62 GLU H H 62 8.490 7.907 0.583 1
1 691 . 10 1 1 A 62 62 GLU N N 62 124.600 118.835 5.765 1
1 692 . 10 1 1 A 64 64 LYS C C 64 176.300 174.574 1.726 1
1 693 . 10 1 1 A 64 64 LYS CA C 64 57.000 57.460 -0.460 1
1 694 . 10 1 1 A 64 64 LYS CB C 64 33.100 29.712 3.388 1
1 695 . 10 1 1 A 65 65 TYR H H 65 7.960 8.006 -0.046 1
1 696 . 10 1 1 A 65 65 TYR C C 65 176.000 174.651 1.349 1
1 697 . 10 1 1 A 65 65 TYR CA C 65 57.800 57.820 -0.020 1
1 698 . 10 1 1 A 65 65 TYR CB C 65 38.800 39.417 -0.617 1
1 699 . 10 1 1 A 65 65 TYR N N 65 119.300 119.991 -0.691 1
1 700 . 10 1 1 A 66 66 THR H H 66 7.820 8.535 -0.715 1
1 701 . 10 1 1 A 66 66 THR HA H 66 4.280 4.572 -0.292 1
1 706 . 10 1 1 A 66 66 THR C C 66 174.100 174.232 -0.132 1
1 707 . 10 1 1 A 66 66 THR CA C 66 62.100 61.099 1.001 1
1 708 . 10 1 1 A 66 66 THR CB C 66 70.000 71.197 -1.197 1
1 710 . 10 1 1 A 66 66 THR N N 66 113.900 123.940 -10.040 1
1 711 . 10 1 1 A 67 67 ASN H H 67 8.270 8.545 -0.275 1
1 712 . 10 1 1 A 67 67 ASN C C 67 174.100 176.329 -2.229 1
1 713 . 10 1 1 A 67 67 ASN CA C 67 53.400 56.489 -3.089 1
1 714 . 10 1 1 A 67 67 ASN CB C 67 39.300 38.920 0.380 1
1 715 . 10 1 1 A 67 67 ASN N N 67 121.400 124.660 -3.260 1
1 716 . 10 1 1 A 68 68 VAL H H 68 7.660 7.646 0.014 1
1 717 . 10 1 1 A 68 68 VAL C C 68 175.500 174.559 0.941 1
1 718 . 10 1 1 A 68 68 VAL CA C 68 61.800 62.463 -0.663 1
1 719 . 10 1 1 A 68 68 VAL CB C 68 33.700 30.238 3.462 1
1 720 . 10 1 1 A 68 68 VAL N N 68 119.400 119.373 0.027 1
1 721 . 10 1 1 A 69 69 LYS H H 69 8.690 8.456 0.234 1
1 722 . 10 1 1 A 69 69 LYS C C 69 175.200 174.908 0.292 1
1 723 . 10 1 1 A 69 69 LYS CA C 69 55.200 54.921 0.279 1
1 724 . 10 1 1 A 69 69 LYS CB C 69 35.200 33.935 1.265 1
1 725 . 10 1 1 A 69 69 LYS N N 69 126.500 128.713 -2.213 1
1 726 . 10 1 1 A 70 70 LYS H H 70 8.230 8.703 -0.473 1
1 727 . 10 1 1 A 70 70 LYS C C 70 176.400 175.811 0.589 1
1 728 . 10 1 1 A 70 70 LYS CA C 70 55.600 56.111 -0.511 1
1 729 . 10 1 1 A 70 70 LYS CB C 70 33.800 33.141 0.659 1
1 730 . 10 1 1 A 70 70 LYS N N 70 122.700 127.555 -4.855 1
1 731 . 10 1 1 A 71 71 VAL H H 71 8.530 8.983 -0.453 1
1 732 . 10 1 1 A 71 71 VAL HA H 71 4.510 4.443 0.067 1
1 733 . 10 1 1 A 71 71 VAL C C 71 174.700 174.953 -0.253 1
1 734 . 10 1 1 A 71 71 VAL CA C 71 60.900 61.373 -0.473 1
1 735 . 10 1 1 A 71 71 VAL CB C 71 34.800 31.866 2.934 1
1 738 . 10 1 1 A 71 71 VAL N N 71 121.200 125.808 -4.608 1
1 739 . 10 1 1 A 72 72 LYS H H 72 8.210 8.933 -0.723 1
1 740 . 10 1 1 A 72 72 LYS HA H 72 4.800 4.675 0.125 1
1 747 . 10 1 1 A 72 72 LYS C C 72 176.200 175.258 0.942 1
1 748 . 10 1 1 A 72 72 LYS CA C 72 55.700 55.925 -0.225 1
1 749 . 10 1 1 A 72 72 LYS CB C 72 33.700 32.513 1.187 1
1 752 . 10 1 1 A 72 72 LYS N N 72 123.600 127.542 -3.942 1
1 753 . 10 1 1 A 73 73 ILE H H 73 8.890 8.872 0.018 1
1 754 . 10 1 1 A 73 73 ILE C C 73 174.400 174.464 -0.064 1
1 755 . 10 1 1 A 73 73 ILE CA C 73 60.400 59.941 0.459 1
1 756 . 10 1 1 A 73 73 ILE CB C 73 40.800 38.283 2.517 1
1 760 . 10 1 1 A 73 73 ILE N N 73 125.100 126.118 -1.018 1
1 761 . 10 1 1 A 74 74 LYS H H 74 8.420 8.680 -0.260 1
1 762 . 10 1 1 A 74 74 LYS HA H 74 4.800 4.585 0.215 1
1 771 . 10 1 1 A 74 74 LYS C C 74 175.600 174.893 0.707 1
1 772 . 10 1 1 A 74 74 LYS CA C 74 56.200 55.475 0.725 1
1 773 . 10 1 1 A 74 74 LYS CB C 74 34.300 33.274 1.026 1
1 777 . 10 1 1 A 74 74 LYS N N 74 126.400 128.225 -1.825 1
1 778 . 10 1 1 A 75 75 LYS H H 75 9.090 8.572 0.518 1
1 779 . 10 1 1 A 75 75 LYS HA H 75 4.800 4.900 -0.100 1
1 788 . 10 1 1 A 75 75 LYS C C 75 174.900 175.168 -0.268 1
1 789 . 10 1 1 A 75 75 LYS CA C 75 53.200 54.496 -1.296 1
1 790 . 10 1 1 A 75 75 LYS CB C 75 34.200 34.528 -0.328 1
1 794 . 10 1 1 A 75 75 LYS N N 75 127.500 127.368 0.132 1
1 795 . 10 1 1 A 76 76 VAL H H 76 8.610 8.361 0.249 1
1 796 . 10 1 1 A 76 76 VAL HA H 76 5.340 5.150 0.190 1
1 804 . 10 1 1 A 76 76 VAL C C 76 171.400 174.046 -2.646 1
1 805 . 10 1 1 A 76 76 VAL CA C 76 58.000 59.621 -1.621 1
1 806 . 10 1 1 A 76 76 VAL CB C 76 36.400 35.338 1.062 1
1 809 . 10 1 1 A 76 76 VAL N N 76 120.100 120.856 -0.756 1
1 810 . 10 1 1 A 77 77 TYR H H 77 9.110 9.155 -0.045 1
1 811 . 10 1 1 A 77 77 TYR HA H 77 6.150 5.995 0.155 1
1 816 . 10 1 1 A 77 77 TYR C C 77 173.600 172.968 0.632 1
1 817 . 10 1 1 A 77 77 TYR CA C 77 56.200 55.858 0.342 1
1 818 . 10 1 1 A 77 77 TYR CB C 77 44.000 41.391 2.609 1
1 821 . 10 1 1 A 77 77 TYR N N 77 121.300 122.053 -0.753 1
1 822 . 10 1 1 A 78 78 PHE H H 78 8.190 8.708 -0.518 1
1 823 . 10 1 1 A 78 78 PHE HA H 78 5.130 5.870 -0.740 1
1 829 . 10 1 1 A 78 78 PHE C C 78 173.600 173.424 0.176 1
1 830 . 10 1 1 A 78 78 PHE CA C 78 55.900 55.344 0.556 1
1 831 . 10 1 1 A 78 78 PHE CB C 78 42.500 42.923 -0.423 1
1 835 . 10 1 1 A 78 78 PHE N N 78 112.700 117.606 -4.906 1
1 836 . 10 1 1 A 79 79 GLU H H 79 8.920 9.040 -0.120 1
1 837 . 10 1 1 A 79 79 GLU HA H 79 5.390 5.062 0.328 1
1 842 . 10 1 1 A 79 79 GLU C C 79 177.000 176.786 0.214 1
1 843 . 10 1 1 A 79 79 GLU CA C 79 54.900 55.262 -0.362 1
1 844 . 10 1 1 A 79 79 GLU CB C 79 33.600 31.919 1.681 1
1 846 . 10 1 1 A 79 79 GLU N N 79 120.500 119.950 0.550 1
1 847 . 10 1 1 A 80 80 THR H H 80 8.970 9.111 -0.141 1
1 848 . 10 1 1 A 80 80 THR HA H 80 4.700 4.859 -0.159 1
1 854 . 10 1 1 A 80 80 THR C C 80 177.000 175.522 1.478 1
1 855 . 10 1 1 A 80 80 THR CA C 80 61.300 60.425 0.875 1
1 856 . 10 1 1 A 80 80 THR CB C 80 70.500 71.999 -1.499 1
1 858 . 10 1 1 A 80 80 THR N N 80 113.200 115.435 -2.235 1
1 859 . 10 1 1 A 81 81 LEU H H 81 8.610 8.931 -0.321 1
1 860 . 10 1 1 A 81 81 LEU HA H 81 4.230 4.160 0.070 1
1 870 . 10 1 1 A 81 81 LEU C C 81 177.400 178.869 -1.469 1
1 871 . 10 1 1 A 81 81 LEU CA C 81 57.700 58.071 -0.371 1
1 872 . 10 1 1 A 81 81 LEU CB C 81 42.400 41.680 0.720 1
1 876 . 10 1 1 A 81 81 LEU N N 81 120.900 123.171 -2.271 1
1 877 . 10 1 1 A 82 82 ASP H H 82 8.850 7.440 1.410 1
1 878 . 10 1 1 A 82 82 ASP HA H 82 4.670 4.728 -0.058 1
1 881 . 10 1 1 A 82 82 ASP C C 82 174.100 175.159 -1.059 1
1 882 . 10 1 1 A 82 82 ASP CA C 82 52.700 53.947 -1.247 1
1 883 . 10 1 1 A 82 82 ASP CB C 82 37.900 40.909 -3.009 1
1 884 . 10 1 1 A 82 82 ASP N N 82 112.300 117.482 -5.182 1
1 885 . 10 1 1 A 83 83 ASN H H 83 7.790 7.992 -0.202 1
1 886 . 10 1 1 A 83 83 ASN HA H 83 4.270 4.437 -0.167 1
1 891 . 10 1 1 A 83 83 ASN C C 83 176.100 174.582 1.518 1
1 892 . 10 1 1 A 83 83 ASN CA C 83 55.300 54.649 0.651 1
1 893 . 10 1 1 A 83 83 ASN CB C 83 36.900 37.055 -0.155 1
1 894 . 10 1 1 A 83 83 ASN N N 83 113.000 114.755 -1.755 1
1 896 . 10 1 1 A 84 84 VAL H H 84 7.660 7.765 -0.105 1
1 897 . 10 1 1 A 84 84 VAL HA H 84 4.270 4.005 0.265 1
1 905 . 10 1 1 A 84 84 VAL C C 84 175.800 175.502 0.298 1
1 906 . 10 1 1 A 84 84 VAL CA C 84 61.500 62.847 -1.347 1
1 907 . 10 1 1 A 84 84 VAL CB C 84 33.500 31.768 1.732 1
1 910 . 10 1 1 A 84 84 VAL N N 84 119.700 120.069 -0.369 1
1 911 . 10 1 1 A 85 85 ARG H H 85 8.180 8.637 -0.457 1
1 912 . 10 1 1 A 85 85 ARG HA H 85 4.870 5.031 -0.161 1
1 920 . 10 1 1 A 85 85 ARG C C 85 174.000 175.161 -1.161 1
1 921 . 10 1 1 A 85 85 ARG CA C 85 55.700 54.913 0.787 1
1 922 . 10 1 1 A 85 85 ARG CB C 85 32.600 31.754 0.846 1
1 925 . 10 1 1 A 85 85 ARG N N 85 124.800 125.028 -0.228 1
1 927 . 10 1 1 A 86 86 VAL H H 86 8.570 8.812 -0.242 1
1 928 . 10 1 1 A 86 86 VAL HA H 86 4.580 4.684 -0.104 1
1 936 . 10 1 1 A 86 86 VAL C C 86 175.700 175.254 0.446 1
1 937 . 10 1 1 A 86 86 VAL CA C 86 61.700 61.825 -0.125 1
1 938 . 10 1 1 A 86 86 VAL CB C 86 30.900 31.504 -0.604 1
1 941 . 10 1 1 A 86 86 VAL N N 86 127.300 124.408 2.892 1
1 942 . 10 1 1 A 87 87 VAL H H 87 8.790 8.960 -0.170 1
1 943 . 10 1 1 A 87 87 VAL HA H 87 5.010 4.994 0.016 1
1 951 . 10 1 1 A 87 87 VAL C C 87 175.500 174.946 0.554 1
1 952 . 10 1 1 A 87 87 VAL CA C 87 61.900 60.908 0.992 1
1 953 . 10 1 1 A 87 87 VAL CB C 87 36.300 32.963 3.337 1
1 956 . 10 1 1 A 87 87 VAL N N 87 125.700 129.059 -3.359 1
1 957 . 10 1 1 A 88 88 THR H H 88 8.350 8.774 -0.424 1
1 958 . 10 1 1 A 88 88 THR HA H 88 4.620 4.676 -0.056 1
1 964 . 10 1 1 A 88 88 THR C C 88 173.300 171.520 1.780 1
1 965 . 10 1 1 A 88 88 THR CA C 88 61.700 59.599 2.101 1
1 966 . 10 1 1 A 88 88 THR CB C 88 70.400 70.224 0.176 1
1 968 . 10 1 1 A 88 88 THR N N 88 117.500 119.266 -1.766 1
1 969 . 10 1 1 A 89 89 ASP H H 89 7.700 8.589 -0.889 1
1 970 . 10 1 1 A 89 89 ASP HA H 89 4.480 4.828 -0.348 1
1 973 . 10 1 1 A 89 89 ASP C C 89 175.900 176.314 -0.414 1
1 974 . 10 1 1 A 89 89 ASP CA C 89 55.900 53.107 2.793 1
1 975 . 10 1 1 A 89 89 ASP CB C 89 43.900 41.111 2.789 1
1 976 . 10 1 1 A 89 89 ASP N N 89 120.800 123.367 -2.567 1
1 977 . 10 1 1 A 90 90 TYR H H 90 8.240 8.986 -0.746 1
1 978 . 10 1 1 A 90 90 TYR HA H 90 3.920 4.091 -0.171 1
1 983 . 10 1 1 A 90 90 TYR C C 90 176.400 177.057 -0.657 1
1 984 . 10 1 1 A 90 90 TYR CA C 90 62.300 62.309 -0.009 1
1 985 . 10 1 1 A 90 90 TYR CB C 90 39.500 38.722 0.778 1
1 988 . 10 1 1 A 90 90 TYR N N 90 126.100 128.089 -1.989 1
1 989 . 10 1 1 A 91 91 SER H H 91 9.160 8.225 0.935 1
1 990 . 10 1 1 A 91 91 SER HA H 91 4.000 4.014 -0.014 1
1 993 . 10 1 1 A 91 91 SER C C 91 178.000 176.564 1.436 1
1 994 . 10 1 1 A 91 91 SER CA C 91 62.600 61.884 0.716 1
1 995 . 10 1 1 A 91 91 SER CB C 91 62.200 62.701 -0.501 1
1 996 . 10 1 1 A 91 91 SER N N 91 116.600 116.712 -0.112 1
1 997 . 10 1 1 A 92 92 GLU H H 92 8.590 8.586 0.004 1
1 998 . 10 1 1 A 92 92 GLU HA H 92 4.050 4.184 -0.134 1
1 1003 . 10 1 1 A 92 92 GLU C C 92 179.400 178.467 0.933 1
1 1004 . 10 1 1 A 92 92 GLU CA C 92 58.900 58.364 0.536 1
1 1005 . 10 1 1 A 92 92 GLU CB C 92 30.600 29.393 1.207 1
1 1007 . 10 1 1 A 92 92 GLU N N 92 120.200 121.263 -1.063 1
1 1008 . 10 1 1 A 93 93 PHE H H 93 7.870 7.865 0.005 1
1 1009 . 10 1 1 A 93 93 PHE HA H 93 4.050 4.126 -0.076 1
1 1015 . 10 1 1 A 93 93 PHE C C 93 176.500 177.682 -1.182 1
1 1016 . 10 1 1 A 93 93 PHE CA C 93 62.200 61.217 0.983 1
1 1017 . 10 1 1 A 93 93 PHE CB C 93 39.700 39.313 0.387 1
1 1021 . 10 1 1 A 93 93 PHE N N 93 120.200 122.339 -2.139 1
1 1022 . 10 1 1 A 94 94 GLN H H 94 8.190 8.130 0.060 1
1 1023 . 10 1 1 A 94 94 GLN HA H 94 3.390 3.580 -0.190 1
1 1030 . 10 1 1 A 94 94 GLN C C 94 178.600 178.517 0.083 1
1 1031 . 10 1 1 A 94 94 GLN CA C 94 58.800 58.801 -0.001 1
1 1032 . 10 1 1 A 94 94 GLN CB C 94 28.400 27.932 0.468 1
1 1034 . 10 1 1 A 94 94 GLN N N 94 116.800 118.066 -1.266 1
1 1036 . 10 1 1 A 95 95 LYS H H 95 7.060 7.387 -0.327 1
1 1037 . 10 1 1 A 95 95 LYS HA H 95 3.780 3.993 -0.213 1
1 1046 . 10 1 1 A 95 95 LYS C C 95 179.300 179.050 0.250 1
1 1047 . 10 1 1 A 95 95 LYS CA C 95 59.900 58.282 1.618 1
1 1048 . 10 1 1 A 95 95 LYS CB C 95 32.700 31.776 0.924 1
1 1052 . 10 1 1 A 95 95 LYS N N 95 117.500 119.498 -1.998 1
1 1053 . 10 1 1 A 96 96 ILE H H 96 7.240 7.758 -0.518 1
1 1054 . 10 1 1 A 96 96 ILE HA H 96 3.420 3.519 -0.099 1
1 1064 . 10 1 1 A 96 96 ILE C C 96 177.800 178.133 -0.333 1
1 1065 . 10 1 1 A 96 96 ILE CA C 96 64.300 65.008 -0.708 1
1 1066 . 10 1 1 A 96 96 ILE CB C 96 37.400 37.261 0.139 1
1 1070 . 10 1 1 A 96 96 ILE N N 96 120.700 120.520 0.180 1
1 1071 . 10 1 1 A 97 97 LEU H H 97 7.690 7.772 -0.082 1
1 1072 . 10 1 1 A 97 97 LEU HA H 97 3.580 3.779 -0.199 1
1 1082 . 10 1 1 A 97 97 LEU C C 97 179.900 179.132 0.768 1
1 1083 . 10 1 1 A 97 97 LEU CA C 97 58.100 57.747 0.353 1
1 1084 . 10 1 1 A 97 97 LEU CB C 97 41.500 40.974 0.526 1
1 1088 . 10 1 1 A 97 97 LEU N N 97 120.000 119.844 0.156 1
1 1089 . 10 1 1 A 98 98 LYS H H 98 7.510 8.172 -0.662 1
1 1090 . 10 1 1 A 98 98 LYS HA H 98 3.950 3.939 0.011 1
1 1099 . 10 1 1 A 98 98 LYS C C 98 178.700 179.071 -0.371 1
1 1100 . 10 1 1 A 98 98 LYS CA C 98 58.700 60.060 -1.360 1
1 1101 . 10 1 1 A 98 98 LYS CB C 98 32.500 32.006 0.494 1
1 1105 . 10 1 1 A 98 98 LYS N N 98 117.300 118.381 -1.081 1
1 1106 . 10 1 1 A 99 99 LYS H H 99 7.470 8.158 -0.688 1
1 1107 . 10 1 1 A 99 99 LYS HA H 99 4.080 3.971 0.109 1
1 1116 . 10 1 1 A 99 99 LYS C C 99 178.100 178.748 -0.648 1
1 1117 . 10 1 1 A 99 99 LYS CA C 99 58.400 59.633 -1.233 1
1 1118 . 10 1 1 A 99 99 LYS CB C 99 33.000 32.379 0.621 1
1 1122 . 10 1 1 A 99 99 LYS N N 99 119.000 120.802 -1.802 1
1 1123 . 10 1 1 A 100 100 ARG H H 100 8.020 7.885 0.135 1
1 1124 . 10 1 1 A 100 100 ARG HA H 100 4.210 4.281 -0.071 1
1 1131 . 10 1 1 A 100 100 ARG C C 100 177.500 176.398 1.102 1
1 1132 . 10 1 1 A 100 100 ARG CA C 100 56.700 58.045 -1.345 1
1 1133 . 10 1 1 A 100 100 ARG CB C 100 30.500 30.996 -0.496 1
1 1136 . 10 1 1 A 100 100 ARG N N 100 117.300 119.142 -1.842 1
1 1137 . 10 1 1 A 101 101 GLY H H 101 7.910 7.899 0.011 1
1 1138 . 10 1 1 A 101 101 GLY HA2 H 101 3.980 3.997 -0.017 1
1 1139 . 10 1 1 A 101 101 GLY HA3 H 101 4.020 4.007 0.013 1
1 1140 . 10 1 1 A 101 101 GLY C C 101 174.400 175.072 -0.672 1
1 1141 . 10 1 1 A 101 101 GLY CA C 101 46.000 46.411 -0.411 1
1 1142 . 10 1 1 A 101 101 GLY N N 101 108.000 107.073 0.927 1
1 1143 . 10 1 1 A 102 102 THR H H 102 7.880 8.336 -0.456 1
1 1144 . 10 1 1 A 102 102 THR HA H 102 4.360 4.204 0.156 1
1 1149 . 10 1 1 A 102 102 THR C C 102 174.400 174.543 -0.143 1
1 1150 . 10 1 1 A 102 102 THR CA C 102 62.100 64.557 -2.457 1
1 1151 . 10 1 1 A 102 102 THR CB C 102 70.500 69.323 1.177 1
1 1153 . 10 1 1 A 102 102 THR N N 102 113.900 111.341 2.559 1
1 1154 . 10 1 1 A 103 103 LYS H H 103 8.440 7.766 0.674 1
1 1155 . 10 1 1 A 103 103 LYS C C 103 176.400 174.960 1.440 1
1 1156 . 10 1 1 A 103 103 LYS CA C 103 56.600 55.117 1.483 1
1 1157 . 10 1 1 A 103 103 LYS CB C 103 33.300 33.559 -0.259 1
1 1158 . 10 1 1 A 103 103 LYS N N 103 124.000 119.000 5.000 1
1 1159 . 10 1 1 A 104 104 LEU H H 104 8.180 8.664 -0.484 1
1 1160 . 10 1 1 A 104 104 LEU HA H 104 4.270 4.383 -0.113 1
1 1170 . 10 1 1 A 104 104 LEU C C 104 177.100 176.877 0.223 1
1 1171 . 10 1 1 A 104 104 LEU CA C 104 55.500 53.666 1.834 1
1 1172 . 10 1 1 A 104 104 LEU CB C 104 42.500 42.498 0.002 1
1 1176 . 10 1 1 A 104 104 LEU N N 104 123.500 125.805 -2.305 1
1 1177 . 10 1 1 A 105 105 GLU H H 105 8.270 8.584 -0.314 1
1 1178 . 10 1 1 A 105 105 GLU CA C 105 56.700 55.127 1.573 1
1 1179 . 10 1 1 A 105 105 GLU CB C 105 30.800 31.720 -0.920 1
1 13 . 11 1 1 A 2 2 ASN HA H 2 4.980 5.186 -0.206 1
1 18 . 11 1 1 A 2 2 ASN C C 2 176.300 175.402 0.898 1
1 19 . 11 1 1 A 2 2 ASN CA C 2 52.500 51.410 1.090 1
1 20 . 11 1 1 A 2 2 ASN CB C 2 40.900 41.870 -0.970 1
1 22 . 11 1 1 A 3 3 SER H H 3 9.940 9.581 0.359 1
1 23 . 11 1 1 A 3 3 SER HA H 3 3.720 4.072 -0.352 1
1 26 . 11 1 1 A 3 3 SER C C 3 175.900 176.345 -0.445 1
1 27 . 11 1 1 A 3 3 SER CA C 3 63.300 61.784 1.516 1
1 28 . 11 1 1 A 3 3 SER CB C 3 61.700 63.187 -1.487 1
1 29 . 11 1 1 A 3 3 SER N N 3 118.200 116.416 1.784 1
1 30 . 11 1 1 A 4 4 GLU H H 4 8.450 8.169 0.281 1
1 31 . 11 1 1 A 4 4 GLU HA H 4 4.010 4.016 -0.006 1
1 36 . 11 1 1 A 4 4 GLU C C 4 178.800 178.997 -0.197 1
1 37 . 11 1 1 A 4 4 GLU CA C 4 60.300 59.125 1.175 1
1 38 . 11 1 1 A 4 4 GLU CB C 4 29.100 29.612 -0.512 1
1 40 . 11 1 1 A 4 4 GLU N N 4 123.600 122.169 1.431 1
1 41 . 11 1 1 A 5 5 VAL H H 5 7.590 7.930 -0.340 1
1 42 . 11 1 1 A 5 5 VAL HA H 5 3.850 3.680 0.170 1
1 50 . 11 1 1 A 5 5 VAL C C 5 179.100 178.378 0.722 1
1 51 . 11 1 1 A 5 5 VAL CA C 5 65.800 66.577 -0.777 1
1 52 . 11 1 1 A 5 5 VAL CB C 5 32.300 31.401 0.899 1
1 55 . 11 1 1 A 5 5 VAL N N 5 119.300 119.737 -0.437 1
1 56 . 11 1 1 A 6 6 ILE H H 6 7.240 8.384 -1.144 1
1 57 . 11 1 1 A 6 6 ILE HA H 6 3.580 3.628 -0.048 1
1 67 . 11 1 1 A 6 6 ILE C C 6 177.000 177.963 -0.963 1
1 68 . 11 1 1 A 6 6 ILE CA C 6 65.300 65.651 -0.351 1
1 69 . 11 1 1 A 6 6 ILE CB C 6 37.900 37.877 0.023 1
1 73 . 11 1 1 A 6 6 ILE N N 6 120.300 120.709 -0.409 1
1 74 . 11 1 1 A 7 7 LYS H H 7 8.050 7.885 0.165 1
1 75 . 11 1 1 A 7 7 LYS HA H 7 3.570 3.372 0.198 1
1 84 . 11 1 1 A 7 7 LYS C C 7 178.700 179.839 -1.139 1
1 85 . 11 1 1 A 7 7 LYS CA C 7 61.300 60.433 0.867 1
1 86 . 11 1 1 A 7 7 LYS CB C 7 32.200 32.221 -0.021 1
1 90 . 11 1 1 A 7 7 LYS N N 7 119.200 118.910 0.290 1
1 91 . 11 1 1 A 8 8 GLU H H 8 8.100 7.863 0.237 1
1 92 . 11 1 1 A 8 8 GLU HA H 8 4.000 4.081 -0.081 1
1 97 . 11 1 1 A 8 8 GLU C C 8 178.500 179.143 -0.643 1
1 98 . 11 1 1 A 8 8 GLU CA C 8 59.700 59.467 0.233 1
1 99 . 11 1 1 A 8 8 GLU CB C 8 29.600 29.681 -0.081 1
1 101 . 11 1 1 A 8 8 GLU N N 8 119.400 120.094 -0.694 1
1 102 . 11 1 1 A 9 9 PHE H H 9 7.720 8.412 -0.692 1
1 103 . 11 1 1 A 9 9 PHE HA H 9 4.160 4.028 0.132 1
1 109 . 11 1 1 A 9 9 PHE C C 9 176.900 177.075 -0.175 1
1 110 . 11 1 1 A 9 9 PHE CA C 9 61.300 61.288 0.012 1
1 111 . 11 1 1 A 9 9 PHE CB C 9 39.400 38.921 0.479 1
1 115 . 11 1 1 A 9 9 PHE N N 9 121.300 121.884 -0.584 1
1 116 . 11 1 1 A 10 10 LEU H H 10 8.060 8.615 -0.555 1
1 117 . 11 1 1 A 10 10 LEU HA H 10 3.660 3.722 -0.062 1
1 127 . 11 1 1 A 10 10 LEU C C 10 179.000 179.134 -0.134 1
1 128 . 11 1 1 A 10 10 LEU CA C 10 58.000 57.873 0.127 1
1 129 . 11 1 1 A 10 10 LEU CB C 10 41.400 41.439 -0.039 1
1 133 . 11 1 1 A 10 10 LEU N N 10 118.000 119.214 -1.214 1
1 134 . 11 1 1 A 11 11 GLU H H 11 7.990 8.034 -0.044 1
1 135 . 11 1 1 A 11 11 GLU HA H 11 4.110 4.014 0.096 1
1 140 . 11 1 1 A 11 11 GLU C C 11 174.200 178.933 -4.733 1
1 141 . 11 1 1 A 11 11 GLU CA C 11 59.200 59.798 -0.598 1
1 142 . 11 1 1 A 11 11 GLU CB C 11 29.300 29.123 0.177 1
1 144 . 11 1 1 A 11 11 GLU N N 11 118.300 118.433 -0.133 1
1 145 . 11 1 1 A 12 12 ASP H H 12 8.080 8.549 -0.469 1
1 146 . 11 1 1 A 12 12 ASP HA H 12 4.340 4.374 -0.034 1
1 149 . 11 1 1 A 12 12 ASP C C 12 178.900 178.346 0.554 1
1 150 . 11 1 1 A 12 12 ASP CA C 12 57.600 57.080 0.520 1
1 151 . 11 1 1 A 12 12 ASP CB C 12 41.000 40.649 0.351 1
1 152 . 11 1 1 A 12 12 ASP N N 12 121.800 119.425 2.375 1
1 153 . 11 1 1 A 13 13 ILE H H 13 7.610 7.416 0.194 1
1 154 . 11 1 1 A 13 13 ILE HA H 13 4.240 3.787 0.453 1
1 164 . 11 1 1 A 13 13 ILE C C 13 176.800 176.282 0.518 1
1 165 . 11 1 1 A 13 13 ILE CA C 13 62.100 62.817 -0.717 1
1 166 . 11 1 1 A 13 13 ILE CB C 13 38.300 38.372 -0.072 1
1 170 . 11 1 1 A 13 13 ILE N N 13 110.800 116.500 -5.700 1
1 171 . 11 1 1 A 14 14 GLY H H 14 7.640 8.144 -0.504 1
1 172 . 11 1 1 A 14 14 GLY HA2 H 14 3.810 3.993 -0.183 1
1 173 . 11 1 1 A 14 14 GLY HA3 H 14 3.880 4.001 -0.121 1
1 174 . 11 1 1 A 14 14 GLY C C 14 175.200 174.207 0.993 1
1 175 . 11 1 1 A 14 14 GLY CA C 14 46.900 45.227 1.673 1
1 176 . 11 1 1 A 14 14 GLY N N 14 111.800 108.459 3.341 1
1 177 . 11 1 1 A 15 15 GLU H H 15 7.870 8.297 -0.427 1
1 178 . 11 1 1 A 15 15 GLU HA H 15 4.680 4.722 -0.042 1
1 183 . 11 1 1 A 15 15 GLU C C 15 175.100 174.772 0.328 1
1 184 . 11 1 1 A 15 15 GLU CA C 15 54.800 55.288 -0.488 1
1 185 . 11 1 1 A 15 15 GLU CB C 15 32.200 32.071 0.129 1
1 187 . 11 1 1 A 15 15 GLU N N 15 119.200 119.281 -0.081 1
1 188 . 11 1 1 A 16 16 ASP H H 16 8.220 8.757 -0.537 1
1 189 . 11 1 1 A 16 16 ASP HA H 16 4.680 5.590 -0.910 1
1 192 . 11 1 1 A 16 16 ASP C C 16 174.600 173.980 0.620 1
1 193 . 11 1 1 A 16 16 ASP CA C 16 53.600 52.698 0.902 1
1 194 . 11 1 1 A 16 16 ASP CB C 16 42.900 45.093 -2.193 1
1 195 . 11 1 1 A 16 16 ASP N N 16 120.600 120.901 -0.301 1
1 196 . 11 1 1 A 17 17 TYR H H 17 7.540 8.793 -1.253 1
1 197 . 11 1 1 A 17 17 TYR HA H 17 4.910 5.231 -0.321 1
1 202 . 11 1 1 A 17 17 TYR C C 17 173.600 172.471 1.129 1
1 203 . 11 1 1 A 17 17 TYR CA C 17 56.200 56.656 -0.456 1
1 204 . 11 1 1 A 17 17 TYR CB C 17 41.100 41.137 -0.037 1
1 207 . 11 1 1 A 17 17 TYR N N 17 112.700 117.072 -4.372 1
1 208 . 11 1 1 A 18 18 ILE H H 18 7.950 9.140 -1.190 1
1 209 . 11 1 1 A 18 18 ILE HA H 18 4.330 4.556 -0.226 1
1 219 . 11 1 1 A 18 18 ILE C C 18 174.700 174.612 0.088 1
1 220 . 11 1 1 A 18 18 ILE CA C 18 60.300 60.628 -0.328 1
1 221 . 11 1 1 A 18 18 ILE CB C 18 41.000 37.994 3.006 1
1 225 . 11 1 1 A 18 18 ILE N N 18 120.400 122.276 -1.876 1
1 226 . 11 1 1 A 19 19 GLU H H 19 8.760 8.856 -0.096 1
1 227 . 11 1 1 A 19 19 GLU HA H 19 5.200 4.923 0.277 1
1 232 . 11 1 1 A 19 19 GLU C C 19 175.200 175.341 -0.141 1
1 233 . 11 1 1 A 19 19 GLU CA C 19 55.500 55.684 -0.184 1
1 234 . 11 1 1 A 19 19 GLU CB C 19 32.400 30.996 1.404 1
1 236 . 11 1 1 A 19 19 GLU N N 19 129.000 128.520 0.480 1
1 237 . 11 1 1 A 20 20 LEU H H 20 8.730 9.328 -0.598 1
1 238 . 11 1 1 A 20 20 LEU HA H 20 4.620 4.726 -0.106 1
1 248 . 11 1 1 A 20 20 LEU C C 20 176.200 176.456 -0.256 1
1 249 . 11 1 1 A 20 20 LEU CA C 20 54.100 53.270 0.830 1
1 250 . 11 1 1 A 20 20 LEU CB C 20 44.400 43.970 0.430 1
1 254 . 11 1 1 A 20 20 LEU N N 20 128.400 127.424 0.976 1
1 255 . 11 1 1 A 21 21 GLU H H 21 8.700 8.616 0.084 1
1 256 . 11 1 1 A 21 21 GLU HA H 21 3.870 3.993 -0.123 1
1 261 . 11 1 1 A 21 21 GLU C C 21 176.100 176.886 -0.786 1
1 262 . 11 1 1 A 21 21 GLU CA C 21 58.800 56.941 1.859 1
1 263 . 11 1 1 A 21 21 GLU CB C 21 28.200 29.221 -1.021 1
1 265 . 11 1 1 A 21 21 GLU N N 21 122.600 120.026 2.574 1
1 266 . 11 1 1 A 22 22 ASN H H 22 8.640 8.961 -0.321 1
1 267 . 11 1 1 A 22 22 ASN HA H 22 4.540 4.329 0.211 1
1 272 . 11 1 1 A 22 22 ASN C C 22 173.800 174.014 -0.214 1
1 273 . 11 1 1 A 22 22 ASN CA C 22 54.600 54.671 -0.071 1
1 274 . 11 1 1 A 22 22 ASN CB C 22 38.400 37.157 1.243 1
1 275 . 11 1 1 A 22 22 ASN N N 22 118.000 120.331 -2.331 1
1 277 . 11 1 1 A 23 23 GLU H H 23 7.740 7.350 0.390 1
1 278 . 11 1 1 A 23 23 GLU HA H 23 5.430 5.136 0.294 1
1 283 . 11 1 1 A 23 23 GLU C C 23 175.400 175.159 0.241 1
1 284 . 11 1 1 A 23 23 GLU CA C 23 54.900 54.834 0.066 1
1 285 . 11 1 1 A 23 23 GLU CB C 23 34.500 32.327 2.173 1
1 287 . 11 1 1 A 23 23 GLU N N 23 116.400 117.526 -1.126 1
1 288 . 11 1 1 A 24 24 ILE H H 24 9.050 9.465 -0.415 1
1 289 . 11 1 1 A 24 24 ILE HA H 24 4.810 4.604 0.206 1
1 299 . 11 1 1 A 24 24 ILE C C 24 174.600 175.149 -0.549 1
1 300 . 11 1 1 A 24 24 ILE CA C 24 60.700 60.477 0.223 1
1 301 . 11 1 1 A 24 24 ILE CB C 24 41.300 39.080 2.220 1
1 305 . 11 1 1 A 24 24 ILE N N 24 122.800 124.960 -2.160 1
1 306 . 11 1 1 A 25 25 HIS H H 25 9.490 9.624 -0.134 1
1 307 . 11 1 1 A 25 25 HIS HA H 25 5.090 5.231 -0.141 1
1 312 . 11 1 1 A 25 25 HIS C C 25 176.100 174.425 1.675 1
1 313 . 11 1 1 A 25 25 HIS CA C 25 56.100 55.567 0.533 1
1 314 . 11 1 1 A 25 25 HIS CB C 25 33.100 30.535 2.565 1
1 317 . 11 1 1 A 25 25 HIS N N 25 127.300 126.751 0.549 1
1 318 . 11 1 1 A 26 26 LEU H H 26 8.820 8.817 0.003 1
1 319 . 11 1 1 A 26 26 LEU HA H 26 5.160 4.976 0.184 1
1 329 . 11 1 1 A 26 26 LEU C C 26 178.000 177.214 0.786 1
1 330 . 11 1 1 A 26 26 LEU CA C 26 52.900 53.798 -0.898 1
1 331 . 11 1 1 A 26 26 LEU CB C 26 48.100 43.635 4.465 1
1 335 . 11 1 1 A 26 26 LEU N N 26 121.600 125.457 -3.857 1
1 336 . 11 1 1 A 27 27 LYS H H 27 8.990 8.969 0.021 1
1 337 . 11 1 1 A 27 27 LYS HA H 27 4.630 4.511 0.119 1
1 345 . 11 1 1 A 27 27 LYS CA C 27 55.700 54.698 1.002 1
1 346 . 11 1 1 A 27 27 LYS CB C 27 31.900 32.483 -0.583 1
1 350 . 11 1 1 A 27 27 LYS N N 27 125.900 122.401 3.499 1
1 351 . 11 1 1 A 28 28 PRO HA H 28 4.500 4.425 0.075 1
1 358 . 11 1 1 A 28 28 PRO C C 28 177.900 179.106 -1.206 1
1 359 . 11 1 1 A 28 28 PRO CA C 28 67.400 66.026 1.374 1
1 360 . 11 1 1 A 28 28 PRO CB C 28 32.100 31.835 0.265 1
1 363 . 11 1 1 A 29 29 GLU H H 29 9.880 8.511 1.369 1
1 364 . 11 1 1 A 29 29 GLU HA H 29 4.140 4.182 -0.042 1
1 369 . 11 1 1 A 29 29 GLU C C 29 178.800 179.252 -0.452 1
1 370 . 11 1 1 A 29 29 GLU CA C 29 60.600 59.175 1.425 1
1 371 . 11 1 1 A 29 29 GLU CB C 29 29.200 29.216 -0.016 1
1 373 . 11 1 1 A 29 29 GLU N N 29 117.100 117.813 -0.713 1
1 374 . 11 1 1 A 30 30 VAL H H 30 7.050 7.557 -0.507 1
1 375 . 11 1 1 A 30 30 VAL HA H 30 3.850 3.845 0.005 1
1 383 . 11 1 1 A 30 30 VAL C C 30 177.700 178.361 -0.661 1
1 384 . 11 1 1 A 30 30 VAL CA C 30 65.600 65.956 -0.356 1
1 385 . 11 1 1 A 30 30 VAL CB C 30 32.100 31.840 0.260 1
1 388 . 11 1 1 A 30 30 VAL N N 30 120.900 121.228 -0.328 1
1 389 . 11 1 1 A 31 31 PHE H H 31 8.980 8.722 0.258 1
1 390 . 11 1 1 A 31 31 PHE HA H 31 3.870 4.313 -0.443 1
1 394 . 11 1 1 A 31 31 PHE C C 31 176.700 177.298 -0.598 1
1 395 . 11 1 1 A 31 31 PHE CA C 31 62.200 61.978 0.222 1
1 396 . 11 1 1 A 31 31 PHE CB C 31 39.300 39.149 0.151 1
1 398 . 11 1 1 A 31 31 PHE N N 31 121.100 120.941 0.159 1
1 399 . 11 1 1 A 32 32 TYR H H 32 8.640 8.633 0.007 1
1 400 . 11 1 1 A 32 32 TYR HA H 32 3.880 4.601 -0.721 1
1 405 . 11 1 1 A 32 32 TYR C C 32 176.000 178.187 -2.187 1
1 406 . 11 1 1 A 32 32 TYR CA C 32 63.300 62.030 1.270 1
1 407 . 11 1 1 A 32 32 TYR CB C 32 39.100 39.007 0.093 1
1 410 . 11 1 1 A 32 32 TYR N N 32 117.400 120.785 -3.385 1
1 411 . 11 1 1 A 33 33 GLU H H 33 7.400 8.111 -0.711 1
1 412 . 11 1 1 A 33 33 GLU HA H 33 4.050 4.342 -0.292 1
1 417 . 11 1 1 A 33 33 GLU C C 33 180.200 179.122 1.078 1
1 418 . 11 1 1 A 33 33 GLU CA C 33 59.500 59.226 0.274 1
1 419 . 11 1 1 A 33 33 GLU CB C 33 29.300 29.177 0.123 1
1 421 . 11 1 1 A 33 33 GLU N N 33 116.100 118.876 -2.776 1
1 422 . 11 1 1 A 34 34 VAL H H 34 8.530 7.946 0.584 1
1 423 . 11 1 1 A 34 34 VAL HA H 34 3.350 3.718 -0.368 1
1 431 . 11 1 1 A 34 34 VAL C C 34 175.800 178.286 -2.486 1
1 432 . 11 1 1 A 34 34 VAL CA C 34 66.400 66.277 0.123 1
1 433 . 11 1 1 A 34 34 VAL CB C 34 32.200 31.698 0.502 1
1 436 . 11 1 1 A 34 34 VAL N N 34 120.600 120.155 0.445 1
1 437 . 11 1 1 A 35 35 TRP H H 35 9.100 8.289 0.811 1
1 438 . 11 1 1 A 35 35 TRP HA H 35 3.340 3.785 -0.445 1
1 447 . 11 1 1 A 35 35 TRP C C 35 178.000 177.608 0.392 1
1 448 . 11 1 1 A 35 35 TRP CA C 35 61.800 60.326 1.474 1
1 449 . 11 1 1 A 35 35 TRP CB C 35 27.900 29.520 -1.620 1
1 455 . 11 1 1 A 35 35 TRP N N 35 121.700 121.619 0.081 1
1 457 . 11 1 1 A 36 36 LYS H H 36 7.970 7.686 0.284 1
1 458 . 11 1 1 A 36 36 LYS HA H 36 3.330 3.727 -0.397 1
1 467 . 11 1 1 A 36 36 LYS C C 36 180.000 177.038 2.962 1
1 468 . 11 1 1 A 36 36 LYS CA C 36 59.000 57.417 1.583 1
1 469 . 11 1 1 A 36 36 LYS CB C 36 31.800 31.603 0.197 1
1 473 . 11 1 1 A 36 36 LYS N N 36 116.300 118.227 -1.927 1
1 474 . 11 1 1 A 37 37 TYR H H 37 7.750 7.991 -0.241 1
1 475 . 11 1 1 A 37 37 TYR HA H 37 3.940 4.087 -0.147 1
1 480 . 11 1 1 A 37 37 TYR C C 37 177.600 177.469 0.131 1
1 481 . 11 1 1 A 37 37 TYR CA C 37 61.200 60.841 0.359 1
1 482 . 11 1 1 A 37 37 TYR CB C 37 38.800 38.766 0.034 1
1 485 . 11 1 1 A 37 37 TYR N N 37 122.700 121.338 1.362 1
1 486 . 11 1 1 A 38 38 VAL H H 38 7.660 7.564 0.096 1
1 487 . 11 1 1 A 38 38 VAL HA H 38 3.870 3.780 0.090 1
1 495 . 11 1 1 A 38 38 VAL C C 38 175.600 175.593 0.007 1
1 496 . 11 1 1 A 38 38 VAL CA C 38 61.100 61.146 -0.046 1
1 497 . 11 1 1 A 38 38 VAL CB C 38 30.700 30.922 -0.222 1
1 500 . 11 1 1 A 38 38 VAL N N 38 108.200 112.910 -4.710 1
1 501 . 11 1 1 A 39 39 GLY H H 39 7.090 7.663 -0.573 1
1 502 . 11 1 1 A 39 39 GLY HA2 H 39 3.320 3.704 -0.384 1
1 503 . 11 1 1 A 39 39 GLY HA3 H 39 3.730 3.725 0.005 1
1 504 . 11 1 1 A 39 39 GLY C C 39 173.600 174.445 -0.845 1
1 505 . 11 1 1 A 39 39 GLY CA C 39 46.100 45.267 0.833 1
1 506 . 11 1 1 A 39 39 GLY N N 39 107.600 109.543 -1.943 1
1 507 . 11 1 1 A 40 40 GLU H H 40 7.730 8.042 -0.312 1
1 508 . 11 1 1 A 40 40 GLU HA H 40 1.090 3.355 -2.265 1
1 513 . 11 1 1 A 40 40 GLU CA C 40 55.700 56.745 -1.045 1
1 514 . 11 1 1 A 40 40 GLU CB C 40 27.200 26.797 0.403 1
1 516 . 11 1 1 A 40 40 GLU N N 40 114.400 118.796 -4.396 1
1 517 . 11 1 1 A 41 41 PRO HA H 41 4.310 4.577 -0.267 1
1 524 . 11 1 1 A 41 41 PRO CA C 41 62.300 62.477 -0.177 1
1 525 . 11 1 1 A 41 41 PRO CB C 41 32.700 32.531 0.169 1
1 528 . 11 1 1 A 42 42 GLU H H 42 8.110 8.572 -0.462 1
1 529 . 11 1 1 A 42 42 GLU C C 42 175.800 175.947 -0.147 1
1 530 . 11 1 1 A 42 42 GLU CA C 42 57.800 56.655 1.145 1
1 531 . 11 1 1 A 42 42 GLU CB C 42 30.600 30.160 0.440 1
1 533 . 11 1 1 A 42 42 GLU N N 42 119.100 120.874 -1.774 1
1 534 . 11 1 1 A 43 43 LEU H H 43 8.140 8.728 -0.588 1
1 535 . 11 1 1 A 43 43 LEU HA H 43 4.840 4.400 0.440 1
1 545 . 11 1 1 A 43 43 LEU C C 43 177.300 176.231 1.069 1
1 546 . 11 1 1 A 43 43 LEU CA C 43 53.700 54.775 -1.075 1
1 547 . 11 1 1 A 43 43 LEU CB C 43 43.900 41.969 1.931 1
1 551 . 11 1 1 A 43 43 LEU N N 43 124.700 126.937 -2.237 1
1 552 . 11 1 1 A 44 44 LYS H H 44 8.640 8.246 0.394 1
1 553 . 11 1 1 A 44 44 LYS HA H 44 4.500 4.604 -0.104 1
1 562 . 11 1 1 A 44 44 LYS C C 44 174.500 176.027 -1.527 1
1 563 . 11 1 1 A 44 44 LYS CA C 44 54.700 55.085 -0.385 1
1 564 . 11 1 1 A 44 44 LYS CB C 44 36.200 33.373 2.827 1
1 568 . 11 1 1 A 44 44 LYS N N 44 123.300 125.002 -1.702 1
1 569 . 11 1 1 A 45 45 THR H H 45 7.990 8.455 -0.465 1
1 570 . 11 1 1 A 45 45 THR HA H 45 5.700 5.293 0.407 1
1 575 . 11 1 1 A 45 45 THR C C 45 175.100 174.087 1.013 1
1 576 . 11 1 1 A 45 45 THR CA C 45 59.600 59.772 -0.172 1
1 577 . 11 1 1 A 45 45 THR CB C 45 73.400 71.152 2.248 1
1 579 . 11 1 1 A 45 45 THR N N 45 106.900 116.206 -9.306 1
1 580 . 11 1 1 A 46 46 TYR H H 46 8.470 9.148 -0.678 1
1 581 . 11 1 1 A 46 46 TYR HA H 46 4.930 5.692 -0.762 1
1 586 . 11 1 1 A 46 46 TYR C C 46 172.400 173.163 -0.763 1
1 587 . 11 1 1 A 46 46 TYR CA C 46 57.100 55.486 1.614 1
1 588 . 11 1 1 A 46 46 TYR CB C 46 40.200 42.287 -2.087 1
1 591 . 11 1 1 A 46 46 TYR N N 46 117.100 118.772 -1.672 1
1 592 . 11 1 1 A 47 47 VAL H H 47 8.430 9.041 -0.611 1
1 593 . 11 1 1 A 47 47 VAL HA H 47 4.890 4.619 0.271 1
1 601 . 11 1 1 A 47 47 VAL C C 47 175.800 174.188 1.612 1
1 602 . 11 1 1 A 47 47 VAL CA C 47 60.800 62.023 -1.223 1
1 603 . 11 1 1 A 47 47 VAL CB C 47 34.800 32.864 1.936 1
1 606 . 11 1 1 A 47 47 VAL N N 47 119.200 121.420 -2.220 1
1 607 . 11 1 1 A 48 48 ILE H H 48 8.680 9.292 -0.612 1
1 608 . 11 1 1 A 48 48 ILE HA H 48 4.560 4.870 -0.310 1
1 618 . 11 1 1 A 48 48 ILE C C 48 174.500 174.646 -0.146 1
1 619 . 11 1 1 A 48 48 ILE CA C 48 59.700 60.152 -0.452 1
1 620 . 11 1 1 A 48 48 ILE CB C 48 41.500 40.217 1.283 1
1 624 . 11 1 1 A 48 48 ILE N N 48 124.400 129.621 -5.221 1
1 625 . 11 1 1 A 49 49 GLU H H 49 8.320 8.908 -0.588 1
1 626 . 11 1 1 A 49 49 GLU C C 49 175.500 175.241 0.259 1
1 627 . 11 1 1 A 49 49 GLU CA C 49 55.500 55.993 -0.493 1
1 628 . 11 1 1 A 49 49 GLU CB C 49 31.800 30.504 1.296 1
1 630 . 11 1 1 A 49 49 GLU N N 49 123.400 130.748 -7.348 1
1 631 . 11 1 1 A 50 50 ASP H H 50 8.610 8.767 -0.157 1
1 632 . 11 1 1 A 50 50 ASP C C 50 175.100 175.887 -0.787 1
1 633 . 11 1 1 A 50 50 ASP CA C 50 53.100 53.469 -0.369 1
1 634 . 11 1 1 A 50 50 ASP CB C 50 44.000 42.140 1.860 1
1 635 . 11 1 1 A 50 50 ASP N N 50 124.300 128.550 -4.250 1
1 636 . 11 1 1 A 51 51 GLU H H 51 8.450 9.272 -0.822 1
1 637 . 11 1 1 A 51 51 GLU C C 51 175.900 176.279 -0.379 1
1 638 . 11 1 1 A 51 51 GLU CA C 51 56.000 58.490 -2.490 1
1 639 . 11 1 1 A 51 51 GLU CB C 51 31.700 28.334 3.366 1
1 640 . 11 1 1 A 51 51 GLU N N 51 121.300 121.099 0.201 1
1 641 . 11 1 1 A 52 52 ILE H H 52 8.480 8.987 -0.507 1
1 642 . 11 1 1 A 52 52 ILE C C 52 175.400 174.626 0.774 1
1 643 . 11 1 1 A 52 52 ILE CA C 52 60.400 64.137 -3.737 1
1 644 . 11 1 1 A 52 52 ILE CB C 52 40.000 36.269 3.731 1
1 645 . 11 1 1 A 52 52 ILE N N 52 122.700 119.753 2.947 1
1 646 . 11 1 1 A 53 53 VAL H H 53 8.140 7.706 0.434 1
1 647 . 11 1 1 A 53 53 VAL C C 53 175.600 174.307 1.293 1
1 648 . 11 1 1 A 53 53 VAL CA C 53 61.900 58.841 3.059 1
1 649 . 11 1 1 A 53 53 VAL CB C 53 33.200 36.012 -2.812 1
1 650 . 11 1 1 A 53 53 VAL N N 53 124.400 115.826 8.574 1
1 651 . 11 1 1 A 54 54 GLU H H 54 8.540 8.741 -0.201 1
1 652 . 11 1 1 A 54 54 GLU CA C 54 55.600 53.567 2.033 1
1 653 . 11 1 1 A 54 54 GLU CB C 54 34.300 30.170 4.130 1
1 654 . 11 1 1 A 54 54 GLU N N 54 125.900 121.847 4.053 1
1 655 . 11 1 1 A 55 55 PRO C C 55 177.500 177.270 0.230 1
1 656 . 11 1 1 A 55 55 PRO CA C 55 63.400 64.801 -1.401 1
1 657 . 11 1 1 A 55 55 PRO CB C 55 32.300 31.944 0.356 1
1 658 . 11 1 1 A 56 56 GLY H H 56 8.420 7.645 0.775 1
1 659 . 11 1 1 A 56 56 GLY HA2 H 56 3.830 4.044 -0.214 1
1 660 . 11 1 1 A 56 56 GLY HA3 H 56 4.000 4.047 -0.047 1
1 661 . 11 1 1 A 56 56 GLY C C 56 174.500 176.075 -1.575 1
1 662 . 11 1 1 A 56 56 GLY CA C 56 45.400 45.442 -0.042 1
1 663 . 11 1 1 A 56 56 GLY N N 56 109.700 106.259 3.441 1
1 664 . 11 1 1 A 57 57 GLU H H 57 8.180 8.630 -0.450 1
1 665 . 11 1 1 A 57 57 GLU C C 57 176.300 176.582 -0.282 1
1 666 . 11 1 1 A 57 57 GLU CA C 57 57.500 59.103 -1.603 1
1 667 . 11 1 1 A 57 57 GLU CB C 57 30.400 30.073 0.327 1
1 668 . 11 1 1 A 57 57 GLU N N 57 120.900 120.351 0.549 1
1 669 . 11 1 1 A 58 58 TYR H H 58 8.020 7.986 0.034 1
1 670 . 11 1 1 A 58 58 TYR C C 58 175.100 173.385 1.715 1
1 671 . 11 1 1 A 58 58 TYR CA C 58 57.400 56.044 1.356 1
1 672 . 11 1 1 A 58 58 TYR CB C 58 38.900 39.798 -0.898 1
1 673 . 11 1 1 A 58 58 TYR N N 58 118.800 121.000 -2.200 1
1 674 . 11 1 1 A 59 59 ASP H H 59 7.950 8.772 -0.822 1
1 675 . 11 1 1 A 59 59 ASP CA C 59 52.700 50.104 2.596 1
1 676 . 11 1 1 A 59 59 ASP CB C 59 41.000 41.896 -0.896 1
1 677 . 11 1 1 A 59 59 ASP N N 59 123.500 128.110 -4.610 1
1 678 . 11 1 1 A 61 61 PRO HA H 61 4.510 4.358 0.152 1
1 685 . 11 1 1 A 61 61 PRO C C 61 176.500 177.536 -1.036 1
1 686 . 11 1 1 A 61 61 PRO CA C 61 63.700 64.223 -0.523 1
1 687 . 11 1 1 A 61 61 PRO CB C 61 34.200 32.018 2.182 1
1 690 . 11 1 1 A 62 62 GLU H H 62 8.490 7.799 0.691 1
1 691 . 11 1 1 A 62 62 GLU N N 62 124.600 117.805 6.795 1
1 692 . 11 1 1 A 64 64 LYS C C 64 176.300 174.870 1.430 1
1 693 . 11 1 1 A 64 64 LYS CA C 64 57.000 55.252 1.748 1
1 694 . 11 1 1 A 64 64 LYS CB C 64 33.100 33.740 -0.640 1
1 695 . 11 1 1 A 65 65 TYR H H 65 7.960 9.177 -1.217 1
1 696 . 11 1 1 A 65 65 TYR C C 65 176.000 176.103 -0.103 1
1 697 . 11 1 1 A 65 65 TYR CA C 65 57.800 56.939 0.861 1
1 698 . 11 1 1 A 65 65 TYR CB C 65 38.800 40.215 -1.415 1
1 699 . 11 1 1 A 65 65 TYR N N 65 119.300 127.396 -8.096 1
1 700 . 11 1 1 A 66 66 THR H H 66 7.820 8.834 -1.014 1
1 701 . 11 1 1 A 66 66 THR HA H 66 4.280 4.992 -0.712 1
1 706 . 11 1 1 A 66 66 THR C C 66 174.100 173.541 0.559 1
1 707 . 11 1 1 A 66 66 THR CA C 66 62.100 60.237 1.863 1
1 708 . 11 1 1 A 66 66 THR CB C 66 70.000 71.248 -1.248 1
1 710 . 11 1 1 A 66 66 THR N N 66 113.900 115.373 -1.473 1
1 711 . 11 1 1 A 67 67 ASN H H 67 8.270 8.481 -0.211 1
1 712 . 11 1 1 A 67 67 ASN C C 67 174.100 173.974 0.126 1
1 713 . 11 1 1 A 67 67 ASN CA C 67 53.400 52.291 1.109 1
1 714 . 11 1 1 A 67 67 ASN CB C 67 39.300 38.540 0.760 1
1 715 . 11 1 1 A 67 67 ASN N N 67 121.400 120.995 0.405 1
1 716 . 11 1 1 A 68 68 VAL H H 68 7.660 8.639 -0.979 1
1 717 . 11 1 1 A 68 68 VAL C C 68 175.500 175.532 -0.032 1
1 718 . 11 1 1 A 68 68 VAL CA C 68 61.800 61.672 0.128 1
1 719 . 11 1 1 A 68 68 VAL CB C 68 33.700 33.570 0.130 1
1 720 . 11 1 1 A 68 68 VAL N N 68 119.400 126.356 -6.956 1
1 721 . 11 1 1 A 69 69 LYS H H 69 8.690 9.079 -0.389 1
1 722 . 11 1 1 A 69 69 LYS C C 69 175.200 175.428 -0.228 1
1 723 . 11 1 1 A 69 69 LYS CA C 69 55.200 54.965 0.235 1
1 724 . 11 1 1 A 69 69 LYS CB C 69 35.200 34.535 0.665 1
1 725 . 11 1 1 A 69 69 LYS N N 69 126.500 126.521 -0.021 1
1 726 . 11 1 1 A 70 70 LYS H H 70 8.230 8.573 -0.343 1
1 727 . 11 1 1 A 70 70 LYS C C 70 176.400 174.981 1.419 1
1 728 . 11 1 1 A 70 70 LYS CA C 70 55.600 55.114 0.486 1
1 729 . 11 1 1 A 70 70 LYS CB C 70 33.800 34.540 -0.740 1
1 730 . 11 1 1 A 70 70 LYS N N 70 122.700 123.172 -0.472 1
1 731 . 11 1 1 A 71 71 VAL H H 71 8.530 8.903 -0.373 1
1 732 . 11 1 1 A 71 71 VAL HA H 71 4.510 4.917 -0.407 1
1 733 . 11 1 1 A 71 71 VAL C C 71 174.700 173.785 0.915 1
1 734 . 11 1 1 A 71 71 VAL CA C 71 60.900 58.973 1.927 1
1 735 . 11 1 1 A 71 71 VAL CB C 71 34.800 35.955 -1.155 1
1 738 . 11 1 1 A 71 71 VAL N N 71 121.200 121.562 -0.362 1
1 739 . 11 1 1 A 72 72 LYS H H 72 8.210 8.710 -0.500 1
1 740 . 11 1 1 A 72 72 LYS HA H 72 4.800 4.802 -0.002 1
1 747 . 11 1 1 A 72 72 LYS C C 72 176.200 175.140 1.060 1
1 748 . 11 1 1 A 72 72 LYS CA C 72 55.700 55.651 0.049 1
1 749 . 11 1 1 A 72 72 LYS CB C 72 33.700 33.055 0.645 1
1 752 . 11 1 1 A 72 72 LYS N N 72 123.600 122.722 0.878 1
1 753 . 11 1 1 A 73 73 ILE H H 73 8.890 8.571 0.319 1
1 754 . 11 1 1 A 73 73 ILE C C 73 174.400 174.736 -0.336 1
1 755 . 11 1 1 A 73 73 ILE CA C 73 60.400 60.224 0.176 1
1 756 . 11 1 1 A 73 73 ILE CB C 73 40.800 38.815 1.985 1
1 760 . 11 1 1 A 73 73 ILE N N 73 125.100 126.449 -1.349 1
1 761 . 11 1 1 A 74 74 LYS H H 74 8.420 8.928 -0.508 1
1 762 . 11 1 1 A 74 74 LYS HA H 74 4.800 4.933 -0.133 1
1 771 . 11 1 1 A 74 74 LYS C C 74 175.600 174.717 0.883 1
1 772 . 11 1 1 A 74 74 LYS CA C 74 56.200 54.601 1.599 1
1 773 . 11 1 1 A 74 74 LYS CB C 74 34.300 35.467 -1.167 1
1 777 . 11 1 1 A 74 74 LYS N N 74 126.400 128.276 -1.876 1
1 778 . 11 1 1 A 75 75 LYS H H 75 9.090 8.598 0.492 1
1 779 . 11 1 1 A 75 75 LYS HA H 75 4.800 4.961 -0.161 1
1 788 . 11 1 1 A 75 75 LYS C C 75 174.900 174.682 0.218 1
1 789 . 11 1 1 A 75 75 LYS CA C 75 53.200 54.294 -1.094 1
1 790 . 11 1 1 A 75 75 LYS CB C 75 34.200 35.723 -1.523 1
1 794 . 11 1 1 A 75 75 LYS N N 75 127.500 126.116 1.384 1
1 795 . 11 1 1 A 76 76 VAL H H 76 8.610 8.921 -0.311 1
1 796 . 11 1 1 A 76 76 VAL HA H 76 5.340 4.950 0.390 1
1 804 . 11 1 1 A 76 76 VAL C C 76 171.400 173.839 -2.439 1
1 805 . 11 1 1 A 76 76 VAL CA C 76 58.000 59.526 -1.526 1
1 806 . 11 1 1 A 76 76 VAL CB C 76 36.400 35.338 1.062 1
1 809 . 11 1 1 A 76 76 VAL N N 76 120.100 120.851 -0.751 1
1 810 . 11 1 1 A 77 77 TYR H H 77 9.110 9.010 0.100 1
1 811 . 11 1 1 A 77 77 TYR HA H 77 6.150 5.925 0.225 1
1 816 . 11 1 1 A 77 77 TYR C C 77 173.600 173.282 0.318 1
1 817 . 11 1 1 A 77 77 TYR CA C 77 56.200 55.765 0.435 1
1 818 . 11 1 1 A 77 77 TYR CB C 77 44.000 41.102 2.898 1
1 821 . 11 1 1 A 77 77 TYR N N 77 121.300 121.972 -0.672 1
1 822 . 11 1 1 A 78 78 PHE H H 78 8.190 8.764 -0.574 1
1 823 . 11 1 1 A 78 78 PHE HA H 78 5.130 5.635 -0.505 1
1 829 . 11 1 1 A 78 78 PHE C C 78 173.600 172.465 1.135 1
1 830 . 11 1 1 A 78 78 PHE CA C 78 55.900 55.342 0.558 1
1 831 . 11 1 1 A 78 78 PHE CB C 78 42.500 42.741 -0.241 1
1 835 . 11 1 1 A 78 78 PHE N N 78 112.700 116.886 -4.186 1
1 836 . 11 1 1 A 79 79 GLU H H 79 8.920 8.937 -0.017 1
1 837 . 11 1 1 A 79 79 GLU HA H 79 5.390 5.058 0.332 1
1 842 . 11 1 1 A 79 79 GLU C C 79 177.000 176.639 0.361 1
1 843 . 11 1 1 A 79 79 GLU CA C 79 54.900 55.826 -0.926 1
1 844 . 11 1 1 A 79 79 GLU CB C 79 33.600 31.322 2.278 1
1 846 . 11 1 1 A 79 79 GLU N N 79 120.500 120.078 0.422 1
1 847 . 11 1 1 A 80 80 THR H H 80 8.970 8.895 0.075 1
1 848 . 11 1 1 A 80 80 THR HA H 80 4.700 4.802 -0.102 1
1 854 . 11 1 1 A 80 80 THR C C 80 177.000 176.322 0.678 1
1 855 . 11 1 1 A 80 80 THR CA C 80 61.300 60.979 0.321 1
1 856 . 11 1 1 A 80 80 THR CB C 80 70.500 71.247 -0.747 1
1 858 . 11 1 1 A 80 80 THR N N 80 113.200 116.630 -3.430 1
1 859 . 11 1 1 A 81 81 LEU H H 81 8.610 8.918 -0.308 1
1 860 . 11 1 1 A 81 81 LEU HA H 81 4.230 4.005 0.225 1
1 870 . 11 1 1 A 81 81 LEU C C 81 177.400 178.183 -0.783 1
1 871 . 11 1 1 A 81 81 LEU CA C 81 57.700 57.723 -0.023 1
1 872 . 11 1 1 A 81 81 LEU CB C 81 42.400 41.329 1.071 1
1 876 . 11 1 1 A 81 81 LEU N N 81 120.900 122.778 -1.878 1
1 877 . 11 1 1 A 82 82 ASP H H 82 8.850 7.867 0.983 1
1 878 . 11 1 1 A 82 82 ASP HA H 82 4.670 4.737 -0.067 1
1 881 . 11 1 1 A 82 82 ASP C C 82 174.100 175.177 -1.077 1
1 882 . 11 1 1 A 82 82 ASP CA C 82 52.700 53.971 -1.271 1
1 883 . 11 1 1 A 82 82 ASP CB C 82 37.900 40.896 -2.996 1
1 884 . 11 1 1 A 82 82 ASP N N 82 112.300 117.138 -4.838 1
1 885 . 11 1 1 A 83 83 ASN H H 83 7.790 8.212 -0.422 1
1 886 . 11 1 1 A 83 83 ASN HA H 83 4.270 4.441 -0.171 1
1 891 . 11 1 1 A 83 83 ASN C C 83 176.100 174.504 1.596 1
1 892 . 11 1 1 A 83 83 ASN CA C 83 55.300 54.526 0.774 1
1 893 . 11 1 1 A 83 83 ASN CB C 83 36.900 37.099 -0.199 1
1 894 . 11 1 1 A 83 83 ASN N N 83 113.000 114.772 -1.772 1
1 896 . 11 1 1 A 84 84 VAL H H 84 7.660 7.665 -0.005 1
1 897 . 11 1 1 A 84 84 VAL HA H 84 4.270 4.046 0.224 1
1 905 . 11 1 1 A 84 84 VAL C C 84 175.800 175.050 0.750 1
1 906 . 11 1 1 A 84 84 VAL CA C 84 61.500 62.521 -1.021 1
1 907 . 11 1 1 A 84 84 VAL CB C 84 33.500 31.925 1.575 1
1 910 . 11 1 1 A 84 84 VAL N N 84 119.700 119.420 0.280 1
1 911 . 11 1 1 A 85 85 ARG H H 85 8.180 8.685 -0.505 1
1 912 . 11 1 1 A 85 85 ARG HA H 85 4.870 4.666 0.204 1
1 920 . 11 1 1 A 85 85 ARG C C 85 174.000 175.044 -1.044 1
1 921 . 11 1 1 A 85 85 ARG CA C 85 55.700 55.631 0.069 1
1 922 . 11 1 1 A 85 85 ARG CB C 85 32.600 30.674 1.926 1
1 925 . 11 1 1 A 85 85 ARG N N 85 124.800 127.475 -2.675 1
1 927 . 11 1 1 A 86 86 VAL H H 86 8.570 8.357 0.213 1
1 928 . 11 1 1 A 86 86 VAL HA H 86 4.580 4.897 -0.317 1
1 936 . 11 1 1 A 86 86 VAL C C 86 175.700 175.142 0.558 1
1 937 . 11 1 1 A 86 86 VAL CA C 86 61.700 62.016 -0.316 1
1 938 . 11 1 1 A 86 86 VAL CB C 86 30.900 30.753 0.147 1
1 941 . 11 1 1 A 86 86 VAL N N 86 127.300 125.823 1.477 1
1 942 . 11 1 1 A 87 87 VAL H H 87 8.790 8.903 -0.113 1
1 943 . 11 1 1 A 87 87 VAL HA H 87 5.010 4.872 0.138 1
1 951 . 11 1 1 A 87 87 VAL C C 87 175.500 174.734 0.766 1
1 952 . 11 1 1 A 87 87 VAL CA C 87 61.900 60.948 0.952 1
1 953 . 11 1 1 A 87 87 VAL CB C 87 36.300 33.475 2.825 1
1 956 . 11 1 1 A 87 87 VAL N N 87 125.700 128.374 -2.674 1
1 957 . 11 1 1 A 88 88 THR H H 88 8.350 8.950 -0.600 1
1 958 . 11 1 1 A 88 88 THR HA H 88 4.620 4.548 0.072 1
1 964 . 11 1 1 A 88 88 THR C C 88 173.300 172.225 1.075 1
1 965 . 11 1 1 A 88 88 THR CA C 88 61.700 60.644 1.056 1
1 966 . 11 1 1 A 88 88 THR CB C 88 70.400 72.133 -1.733 1
1 968 . 11 1 1 A 88 88 THR N N 88 117.500 121.120 -3.620 1
1 969 . 11 1 1 A 89 89 ASP H H 89 7.700 8.506 -0.806 1
1 970 . 11 1 1 A 89 89 ASP HA H 89 4.480 4.514 -0.034 1
1 973 . 11 1 1 A 89 89 ASP C C 89 175.900 177.051 -1.151 1
1 974 . 11 1 1 A 89 89 ASP CA C 89 55.900 54.549 1.351 1
1 975 . 11 1 1 A 89 89 ASP CB C 89 43.900 41.848 2.052 1
1 976 . 11 1 1 A 89 89 ASP N N 89 120.800 125.832 -5.032 1
1 977 . 11 1 1 A 90 90 TYR H H 90 8.240 8.574 -0.334 1
1 978 . 11 1 1 A 90 90 TYR HA H 90 3.920 4.181 -0.261 1
1 983 . 11 1 1 A 90 90 TYR C C 90 176.400 177.575 -1.175 1
1 984 . 11 1 1 A 90 90 TYR CA C 90 62.300 60.777 1.523 1
1 985 . 11 1 1 A 90 90 TYR CB C 90 39.500 39.060 0.440 1
1 988 . 11 1 1 A 90 90 TYR N N 90 126.100 128.238 -2.138 1
1 989 . 11 1 1 A 91 91 SER H H 91 9.160 8.248 0.912 1
1 990 . 11 1 1 A 91 91 SER HA H 91 4.000 4.031 -0.031 1
1 993 . 11 1 1 A 91 91 SER C C 91 178.000 176.851 1.149 1
1 994 . 11 1 1 A 91 91 SER CA C 91 62.600 61.647 0.953 1
1 995 . 11 1 1 A 91 91 SER CB C 91 62.200 62.934 -0.734 1
1 996 . 11 1 1 A 91 91 SER N N 91 116.600 114.391 2.209 1
1 997 . 11 1 1 A 92 92 GLU H H 92 8.590 8.328 0.262 1
1 998 . 11 1 1 A 92 92 GLU HA H 92 4.050 4.250 -0.200 1
1 1003 . 11 1 1 A 92 92 GLU C C 92 179.400 178.530 0.870 1
1 1004 . 11 1 1 A 92 92 GLU CA C 92 58.900 58.009 0.891 1
1 1005 . 11 1 1 A 92 92 GLU CB C 92 30.600 29.512 1.088 1
1 1007 . 11 1 1 A 92 92 GLU N N 92 120.200 121.504 -1.304 1
1 1008 . 11 1 1 A 93 93 PHE H H 93 7.870 7.861 0.009 1
1 1009 . 11 1 1 A 93 93 PHE HA H 93 4.050 4.130 -0.080 1
1 1015 . 11 1 1 A 93 93 PHE C C 93 176.500 177.684 -1.184 1
1 1016 . 11 1 1 A 93 93 PHE CA C 93 62.200 60.856 1.344 1
1 1017 . 11 1 1 A 93 93 PHE CB C 93 39.700 39.100 0.600 1
1 1021 . 11 1 1 A 93 93 PHE N N 93 120.200 122.799 -2.599 1
1 1022 . 11 1 1 A 94 94 GLN H H 94 8.190 8.500 -0.310 1
1 1023 . 11 1 1 A 94 94 GLN HA H 94 3.390 3.703 -0.313 1
1 1030 . 11 1 1 A 94 94 GLN C C 94 178.600 178.272 0.328 1
1 1031 . 11 1 1 A 94 94 GLN CA C 94 58.800 58.053 0.747 1
1 1032 . 11 1 1 A 94 94 GLN CB C 94 28.400 27.142 1.258 1
1 1034 . 11 1 1 A 94 94 GLN N N 94 116.800 117.132 -0.332 1
1 1036 . 11 1 1 A 95 95 LYS H H 95 7.060 7.708 -0.648 1
1 1037 . 11 1 1 A 95 95 LYS HA H 95 3.780 4.029 -0.249 1
1 1046 . 11 1 1 A 95 95 LYS C C 95 179.300 178.989 0.311 1
1 1047 . 11 1 1 A 95 95 LYS CA C 95 59.900 58.971 0.929 1
1 1048 . 11 1 1 A 95 95 LYS CB C 95 32.700 32.220 0.480 1
1 1052 . 11 1 1 A 95 95 LYS N N 95 117.500 119.642 -2.142 1
1 1053 . 11 1 1 A 96 96 ILE H H 96 7.240 7.469 -0.229 1
1 1054 . 11 1 1 A 96 96 ILE HA H 96 3.420 3.501 -0.081 1
1 1064 . 11 1 1 A 96 96 ILE C C 96 177.800 178.196 -0.396 1
1 1065 . 11 1 1 A 96 96 ILE CA C 96 64.300 64.830 -0.530 1
1 1066 . 11 1 1 A 96 96 ILE CB C 96 37.400 37.079 0.321 1
1 1070 . 11 1 1 A 96 96 ILE N N 96 120.700 119.763 0.937 1
1 1071 . 11 1 1 A 97 97 LEU H H 97 7.690 7.999 -0.309 1
1 1072 . 11 1 1 A 97 97 LEU HA H 97 3.580 3.790 -0.210 1
1 1082 . 11 1 1 A 97 97 LEU C C 97 179.900 179.183 0.717 1
1 1083 . 11 1 1 A 97 97 LEU CA C 97 58.100 57.793 0.307 1
1 1084 . 11 1 1 A 97 97 LEU CB C 97 41.500 41.117 0.383 1
1 1088 . 11 1 1 A 97 97 LEU N N 97 120.000 120.516 -0.516 1
1 1089 . 11 1 1 A 98 98 LYS H H 98 7.510 8.206 -0.696 1
1 1090 . 11 1 1 A 98 98 LYS HA H 98 3.950 3.934 0.016 1
1 1099 . 11 1 1 A 98 98 LYS C C 98 178.700 179.069 -0.369 1
1 1100 . 11 1 1 A 98 98 LYS CA C 98 58.700 60.028 -1.328 1
1 1101 . 11 1 1 A 98 98 LYS CB C 98 32.500 32.021 0.479 1
1 1105 . 11 1 1 A 98 98 LYS N N 98 117.300 117.947 -0.647 1
1 1106 . 11 1 1 A 99 99 LYS H H 99 7.470 7.922 -0.452 1
1 1107 . 11 1 1 A 99 99 LYS HA H 99 4.080 3.912 0.168 1
1 1116 . 11 1 1 A 99 99 LYS C C 99 178.100 178.283 -0.183 1
1 1117 . 11 1 1 A 99 99 LYS CA C 99 58.400 59.726 -1.326 1
1 1118 . 11 1 1 A 99 99 LYS CB C 99 33.000 32.395 0.605 1
1 1122 . 11 1 1 A 99 99 LYS N N 99 119.000 120.590 -1.590 1
1 1123 . 11 1 1 A 100 100 ARG H H 100 8.020 7.906 0.114 1
1 1124 . 11 1 1 A 100 100 ARG HA H 100 4.210 4.351 -0.141 1
1 1131 . 11 1 1 A 100 100 ARG C C 100 177.500 176.480 1.020 1
1 1132 . 11 1 1 A 100 100 ARG CA C 100 56.700 55.477 1.223 1
1 1133 . 11 1 1 A 100 100 ARG CB C 100 30.500 30.507 -0.007 1
1 1136 . 11 1 1 A 100 100 ARG N N 100 117.300 115.744 1.556 1
1 1137 . 11 1 1 A 101 101 GLY H H 101 7.910 7.858 0.052 1
1 1138 . 11 1 1 A 101 101 GLY HA2 H 101 3.980 3.968 0.012 1
1 1139 . 11 1 1 A 101 101 GLY HA3 H 101 4.020 3.974 0.046 1
1 1140 . 11 1 1 A 101 101 GLY C C 101 174.400 174.519 -0.119 1
1 1141 . 11 1 1 A 101 101 GLY CA C 101 46.000 46.426 -0.426 1
1 1142 . 11 1 1 A 101 101 GLY N N 101 108.000 108.408 -0.408 1
1 1143 . 11 1 1 A 102 102 THR H H 102 7.880 7.859 0.021 1
1 1144 . 11 1 1 A 102 102 THR HA H 102 4.360 4.995 -0.635 1
1 1149 . 11 1 1 A 102 102 THR C C 102 174.400 173.267 1.133 1
1 1150 . 11 1 1 A 102 102 THR CA C 102 62.100 61.435 0.665 1
1 1151 . 11 1 1 A 102 102 THR CB C 102 70.500 71.504 -1.004 1
1 1153 . 11 1 1 A 102 102 THR N N 102 113.900 114.856 -0.956 1
1 1154 . 11 1 1 A 103 103 LYS H H 103 8.440 8.560 -0.120 1
1 1155 . 11 1 1 A 103 103 LYS C C 103 176.400 176.894 -0.494 1
1 1156 . 11 1 1 A 103 103 LYS CA C 103 56.600 54.290 2.310 1
1 1157 . 11 1 1 A 103 103 LYS CB C 103 33.300 35.288 -1.988 1
1 1158 . 11 1 1 A 103 103 LYS N N 103 124.000 123.478 0.522 1
1 1159 . 11 1 1 A 104 104 LEU H H 104 8.180 8.891 -0.711 1
1 1160 . 11 1 1 A 104 104 LEU HA H 104 4.270 4.240 0.030 1
1 1170 . 11 1 1 A 104 104 LEU C C 104 177.100 178.732 -1.632 1
1 1171 . 11 1 1 A 104 104 LEU CA C 104 55.500 57.747 -2.247 1
1 1172 . 11 1 1 A 104 104 LEU CB C 104 42.500 41.932 0.568 1
1 1176 . 11 1 1 A 104 104 LEU N N 104 123.500 125.889 -2.389 1
1 1177 . 11 1 1 A 105 105 GLU H H 105 8.270 8.153 0.117 1
1 1178 . 11 1 1 A 105 105 GLU CA C 105 56.700 58.898 -2.198 1
1 1179 . 11 1 1 A 105 105 GLU CB C 105 30.800 30.002 0.798 1
1 13 . 12 1 1 A 2 2 ASN HA H 2 4.980 4.946 0.034 1
1 18 . 12 1 1 A 2 2 ASN C C 2 176.300 176.814 -0.514 1
1 19 . 12 1 1 A 2 2 ASN CA C 2 52.500 53.013 -0.513 1
1 20 . 12 1 1 A 2 2 ASN CB C 2 40.900 39.272 1.628 1
1 22 . 12 1 1 A 3 3 SER H H 3 9.940 9.482 0.458 1
1 23 . 12 1 1 A 3 3 SER HA H 3 3.720 4.077 -0.357 1
1 26 . 12 1 1 A 3 3 SER C C 3 175.900 176.792 -0.892 1
1 27 . 12 1 1 A 3 3 SER CA C 3 63.300 61.660 1.640 1
1 28 . 12 1 1 A 3 3 SER CB C 3 61.700 62.386 -0.686 1
1 29 . 12 1 1 A 3 3 SER N N 3 118.200 118.081 0.119 1
1 30 . 12 1 1 A 4 4 GLU H H 4 8.450 8.209 0.241 1
1 31 . 12 1 1 A 4 4 GLU HA H 4 4.010 4.016 -0.006 1
1 36 . 12 1 1 A 4 4 GLU C C 4 178.800 179.094 -0.294 1
1 37 . 12 1 1 A 4 4 GLU CA C 4 60.300 59.171 1.129 1
1 38 . 12 1 1 A 4 4 GLU CB C 4 29.100 29.542 -0.442 1
1 40 . 12 1 1 A 4 4 GLU N N 4 123.600 122.689 0.911 1
1 41 . 12 1 1 A 5 5 VAL H H 5 7.590 7.528 0.062 1
1 42 . 12 1 1 A 5 5 VAL HA H 5 3.850 3.662 0.188 1
1 50 . 12 1 1 A 5 5 VAL C C 5 179.100 178.402 0.698 1
1 51 . 12 1 1 A 5 5 VAL CA C 5 65.800 66.225 -0.425 1
1 52 . 12 1 1 A 5 5 VAL CB C 5 32.300 31.499 0.801 1
1 55 . 12 1 1 A 5 5 VAL N N 5 119.300 119.142 0.158 1
1 56 . 12 1 1 A 6 6 ILE H H 6 7.240 8.191 -0.951 1
1 57 . 12 1 1 A 6 6 ILE HA H 6 3.580 3.569 0.011 1
1 67 . 12 1 1 A 6 6 ILE C C 6 177.000 177.803 -0.803 1
1 68 . 12 1 1 A 6 6 ILE CA C 6 65.300 65.479 -0.179 1
1 69 . 12 1 1 A 6 6 ILE CB C 6 37.900 37.564 0.336 1
1 73 . 12 1 1 A 6 6 ILE N N 6 120.300 120.889 -0.589 1
1 74 . 12 1 1 A 7 7 LYS H H 7 8.050 7.952 0.098 1
1 75 . 12 1 1 A 7 7 LYS HA H 7 3.570 3.547 0.023 1
1 84 . 12 1 1 A 7 7 LYS C C 7 178.700 180.051 -1.351 1
1 85 . 12 1 1 A 7 7 LYS CA C 7 61.300 60.354 0.946 1
1 86 . 12 1 1 A 7 7 LYS CB C 7 32.200 32.119 0.081 1
1 90 . 12 1 1 A 7 7 LYS N N 7 119.200 119.188 0.012 1
1 91 . 12 1 1 A 8 8 GLU H H 8 8.100 7.786 0.314 1
1 92 . 12 1 1 A 8 8 GLU HA H 8 4.000 4.047 -0.047 1
1 97 . 12 1 1 A 8 8 GLU C C 8 178.500 179.170 -0.670 1
1 98 . 12 1 1 A 8 8 GLU CA C 8 59.700 59.455 0.245 1
1 99 . 12 1 1 A 8 8 GLU CB C 8 29.600 29.729 -0.129 1
1 101 . 12 1 1 A 8 8 GLU N N 8 119.400 120.140 -0.740 1
1 102 . 12 1 1 A 9 9 PHE H H 9 7.720 7.889 -0.169 1
1 103 . 12 1 1 A 9 9 PHE HA H 9 4.160 4.075 0.085 1
1 109 . 12 1 1 A 9 9 PHE C C 9 176.900 176.910 -0.010 1
1 110 . 12 1 1 A 9 9 PHE CA C 9 61.300 61.217 0.083 1
1 111 . 12 1 1 A 9 9 PHE CB C 9 39.400 39.156 0.244 1
1 115 . 12 1 1 A 9 9 PHE N N 9 121.300 121.757 -0.457 1
1 116 . 12 1 1 A 10 10 LEU H H 10 8.060 8.565 -0.505 1
1 117 . 12 1 1 A 10 10 LEU HA H 10 3.660 3.693 -0.033 1
1 127 . 12 1 1 A 10 10 LEU C C 10 179.000 179.182 -0.182 1
1 128 . 12 1 1 A 10 10 LEU CA C 10 58.000 57.767 0.233 1
1 129 . 12 1 1 A 10 10 LEU CB C 10 41.400 41.092 0.308 1
1 133 . 12 1 1 A 10 10 LEU N N 10 118.000 119.063 -1.063 1
1 134 . 12 1 1 A 11 11 GLU H H 11 7.990 8.499 -0.509 1
1 135 . 12 1 1 A 11 11 GLU HA H 11 4.110 3.958 0.152 1
1 140 . 12 1 1 A 11 11 GLU C C 11 174.200 178.120 -3.920 1
1 141 . 12 1 1 A 11 11 GLU CA C 11 59.200 59.237 -0.037 1
1 142 . 12 1 1 A 11 11 GLU CB C 11 29.300 29.286 0.014 1
1 144 . 12 1 1 A 11 11 GLU N N 11 118.300 120.557 -2.257 1
1 145 . 12 1 1 A 12 12 ASP H H 12 8.080 8.163 -0.083 1
1 146 . 12 1 1 A 12 12 ASP HA H 12 4.340 4.304 0.036 1
1 149 . 12 1 1 A 12 12 ASP C C 12 178.900 178.047 0.853 1
1 150 . 12 1 1 A 12 12 ASP CA C 12 57.600 57.855 -0.255 1
1 151 . 12 1 1 A 12 12 ASP CB C 12 41.000 41.523 -0.523 1
1 152 . 12 1 1 A 12 12 ASP N N 12 121.800 120.162 1.638 1
1 153 . 12 1 1 A 13 13 ILE H H 13 7.610 7.547 0.063 1
1 154 . 12 1 1 A 13 13 ILE HA H 13 4.240 3.968 0.272 1
1 164 . 12 1 1 A 13 13 ILE C C 13 176.800 176.833 -0.033 1
1 165 . 12 1 1 A 13 13 ILE CA C 13 62.100 61.508 0.592 1
1 166 . 12 1 1 A 13 13 ILE CB C 13 38.300 38.577 -0.277 1
1 170 . 12 1 1 A 13 13 ILE N N 13 110.800 112.718 -1.918 1
1 171 . 12 1 1 A 14 14 GLY H H 14 7.640 8.206 -0.566 1
1 172 . 12 1 1 A 14 14 GLY HA2 H 14 3.810 3.904 -0.094 1
1 173 . 12 1 1 A 14 14 GLY HA3 H 14 3.880 3.910 -0.030 1
1 174 . 12 1 1 A 14 14 GLY C C 14 175.200 174.122 1.078 1
1 175 . 12 1 1 A 14 14 GLY CA C 14 46.900 46.299 0.601 1
1 176 . 12 1 1 A 14 14 GLY N N 14 111.800 112.405 -0.605 1
1 177 . 12 1 1 A 15 15 GLU H H 15 7.870 7.951 -0.081 1
1 178 . 12 1 1 A 15 15 GLU HA H 15 4.680 4.847 -0.167 1
1 183 . 12 1 1 A 15 15 GLU C C 15 175.100 175.149 -0.049 1
1 184 . 12 1 1 A 15 15 GLU CA C 15 54.800 54.522 0.278 1
1 185 . 12 1 1 A 15 15 GLU CB C 15 32.200 32.682 -0.482 1
1 187 . 12 1 1 A 15 15 GLU N N 15 119.200 119.194 0.006 1
1 188 . 12 1 1 A 16 16 ASP H H 16 8.220 8.841 -0.621 1
1 189 . 12 1 1 A 16 16 ASP HA H 16 4.680 5.247 -0.567 1
1 192 . 12 1 1 A 16 16 ASP C C 16 174.600 175.402 -0.802 1
1 193 . 12 1 1 A 16 16 ASP CA C 16 53.600 52.970 0.630 1
1 194 . 12 1 1 A 16 16 ASP CB C 16 42.900 42.493 0.407 1
1 195 . 12 1 1 A 16 16 ASP N N 16 120.600 121.891 -1.291 1
1 196 . 12 1 1 A 17 17 TYR H H 17 7.540 9.013 -1.473 1
1 197 . 12 1 1 A 17 17 TYR HA H 17 4.910 5.812 -0.902 1
1 202 . 12 1 1 A 17 17 TYR C C 17 173.600 174.066 -0.466 1
1 203 . 12 1 1 A 17 17 TYR CA C 17 56.200 55.354 0.846 1
1 204 . 12 1 1 A 17 17 TYR CB C 17 41.100 41.563 -0.463 1
1 207 . 12 1 1 A 17 17 TYR N N 17 112.700 119.756 -7.056 1
1 208 . 12 1 1 A 18 18 ILE H H 18 7.950 9.065 -1.115 1
1 209 . 12 1 1 A 18 18 ILE HA H 18 4.330 4.386 -0.056 1
1 219 . 12 1 1 A 18 18 ILE C C 18 174.700 174.645 0.055 1
1 220 . 12 1 1 A 18 18 ILE CA C 18 60.300 61.155 -0.855 1
1 221 . 12 1 1 A 18 18 ILE CB C 18 41.000 37.060 3.940 1
1 225 . 12 1 1 A 18 18 ILE N N 18 120.400 124.226 -3.826 1
1 226 . 12 1 1 A 19 19 GLU H H 19 8.760 8.780 -0.020 1
1 227 . 12 1 1 A 19 19 GLU HA H 19 5.200 4.971 0.229 1
1 232 . 12 1 1 A 19 19 GLU C C 19 175.200 176.032 -0.832 1
1 233 . 12 1 1 A 19 19 GLU CA C 19 55.500 55.713 -0.213 1
1 234 . 12 1 1 A 19 19 GLU CB C 19 32.400 30.680 1.720 1
1 236 . 12 1 1 A 19 19 GLU N N 19 129.000 128.602 0.398 1
1 237 . 12 1 1 A 20 20 LEU H H 20 8.730 9.524 -0.794 1
1 238 . 12 1 1 A 20 20 LEU HA H 20 4.620 4.721 -0.101 1
1 248 . 12 1 1 A 20 20 LEU C C 20 176.200 176.729 -0.529 1
1 249 . 12 1 1 A 20 20 LEU CA C 20 54.100 53.779 0.321 1
1 250 . 12 1 1 A 20 20 LEU CB C 20 44.400 42.402 1.998 1
1 254 . 12 1 1 A 20 20 LEU N N 20 128.400 127.976 0.424 1
1 255 . 12 1 1 A 21 21 GLU H H 21 8.700 8.597 0.103 1
1 256 . 12 1 1 A 21 21 GLU HA H 21 3.870 4.081 -0.211 1
1 261 . 12 1 1 A 21 21 GLU C C 21 176.100 176.862 -0.762 1
1 262 . 12 1 1 A 21 21 GLU CA C 21 58.800 56.479 2.321 1
1 263 . 12 1 1 A 21 21 GLU CB C 21 28.200 28.759 -0.559 1
1 265 . 12 1 1 A 21 21 GLU N N 21 122.600 119.974 2.626 1
1 266 . 12 1 1 A 22 22 ASN H H 22 8.640 8.687 -0.047 1
1 267 . 12 1 1 A 22 22 ASN HA H 22 4.540 4.350 0.190 1
1 272 . 12 1 1 A 22 22 ASN C C 22 173.800 174.020 -0.220 1
1 273 . 12 1 1 A 22 22 ASN CA C 22 54.600 54.698 -0.098 1
1 274 . 12 1 1 A 22 22 ASN CB C 22 38.400 36.931 1.469 1
1 275 . 12 1 1 A 22 22 ASN N N 22 118.000 120.610 -2.610 1
1 277 . 12 1 1 A 23 23 GLU H H 23 7.740 7.719 0.021 1
1 278 . 12 1 1 A 23 23 GLU HA H 23 5.430 5.025 0.405 1
1 283 . 12 1 1 A 23 23 GLU C C 23 175.400 175.371 0.029 1
1 284 . 12 1 1 A 23 23 GLU CA C 23 54.900 54.971 -0.071 1
1 285 . 12 1 1 A 23 23 GLU CB C 23 34.500 31.959 2.541 1
1 287 . 12 1 1 A 23 23 GLU N N 23 116.400 117.519 -1.119 1
1 288 . 12 1 1 A 24 24 ILE H H 24 9.050 8.984 0.066 1
1 289 . 12 1 1 A 24 24 ILE HA H 24 4.810 4.715 0.095 1
1 299 . 12 1 1 A 24 24 ILE C C 24 174.600 175.356 -0.756 1
1 300 . 12 1 1 A 24 24 ILE CA C 24 60.700 60.478 0.222 1
1 301 . 12 1 1 A 24 24 ILE CB C 24 41.300 38.281 3.019 1
1 305 . 12 1 1 A 24 24 ILE N N 24 122.800 126.222 -3.422 1
1 306 . 12 1 1 A 25 25 HIS H H 25 9.490 9.747 -0.257 1
1 307 . 12 1 1 A 25 25 HIS HA H 25 5.090 5.659 -0.569 1
1 312 . 12 1 1 A 25 25 HIS C C 25 176.100 174.681 1.419 1
1 313 . 12 1 1 A 25 25 HIS CA C 25 56.100 55.528 0.572 1
1 314 . 12 1 1 A 25 25 HIS CB C 25 33.100 31.105 1.995 1
1 317 . 12 1 1 A 25 25 HIS N N 25 127.300 126.774 0.526 1
1 318 . 12 1 1 A 26 26 LEU H H 26 8.820 9.049 -0.229 1
1 319 . 12 1 1 A 26 26 LEU HA H 26 5.160 4.990 0.170 1
1 329 . 12 1 1 A 26 26 LEU C C 26 178.000 176.167 1.833 1
1 330 . 12 1 1 A 26 26 LEU CA C 26 52.900 53.268 -0.368 1
1 331 . 12 1 1 A 26 26 LEU CB C 26 48.100 43.717 4.383 1
1 335 . 12 1 1 A 26 26 LEU N N 26 121.600 124.856 -3.256 1
1 336 . 12 1 1 A 27 27 LYS H H 27 8.990 8.910 0.080 1
1 337 . 12 1 1 A 27 27 LYS HA H 27 4.630 4.588 0.042 1
1 345 . 12 1 1 A 27 27 LYS CA C 27 55.700 54.251 1.449 1
1 346 . 12 1 1 A 27 27 LYS CB C 27 31.900 32.188 -0.288 1
1 350 . 12 1 1 A 27 27 LYS N N 27 125.900 120.888 5.012 1
1 351 . 12 1 1 A 28 28 PRO HA H 28 4.500 4.446 0.054 1
1 358 . 12 1 1 A 28 28 PRO C C 28 177.900 179.055 -1.155 1
1 359 . 12 1 1 A 28 28 PRO CA C 28 67.400 65.925 1.475 1
1 360 . 12 1 1 A 28 28 PRO CB C 28 32.100 31.845 0.255 1
1 363 . 12 1 1 A 29 29 GLU H H 29 9.880 8.467 1.413 1
1 364 . 12 1 1 A 29 29 GLU HA H 29 4.140 4.210 -0.070 1
1 369 . 12 1 1 A 29 29 GLU C C 29 178.800 179.548 -0.748 1
1 370 . 12 1 1 A 29 29 GLU CA C 29 60.600 59.558 1.042 1
1 371 . 12 1 1 A 29 29 GLU CB C 29 29.200 29.502 -0.302 1
1 373 . 12 1 1 A 29 29 GLU N N 29 117.100 117.842 -0.742 1
1 374 . 12 1 1 A 30 30 VAL H H 30 7.050 7.744 -0.694 1
1 375 . 12 1 1 A 30 30 VAL HA H 30 3.850 3.861 -0.011 1
1 383 . 12 1 1 A 30 30 VAL C C 30 177.700 178.320 -0.620 1
1 384 . 12 1 1 A 30 30 VAL CA C 30 65.600 65.968 -0.368 1
1 385 . 12 1 1 A 30 30 VAL CB C 30 32.100 31.962 0.138 1
1 388 . 12 1 1 A 30 30 VAL N N 30 120.900 121.339 -0.439 1
1 389 . 12 1 1 A 31 31 PHE H H 31 8.980 8.756 0.224 1
1 390 . 12 1 1 A 31 31 PHE HA H 31 3.870 4.278 -0.408 1
1 394 . 12 1 1 A 31 31 PHE C C 31 176.700 177.229 -0.529 1
1 395 . 12 1 1 A 31 31 PHE CA C 31 62.200 61.987 0.213 1
1 396 . 12 1 1 A 31 31 PHE CB C 31 39.300 39.089 0.211 1
1 398 . 12 1 1 A 31 31 PHE N N 31 121.100 120.789 0.311 1
1 399 . 12 1 1 A 32 32 TYR H H 32 8.640 8.464 0.176 1
1 400 . 12 1 1 A 32 32 TYR HA H 32 3.880 4.497 -0.617 1
1 405 . 12 1 1 A 32 32 TYR C C 32 176.000 178.202 -2.202 1
1 406 . 12 1 1 A 32 32 TYR CA C 32 63.300 61.889 1.411 1
1 407 . 12 1 1 A 32 32 TYR CB C 32 39.100 38.728 0.372 1
1 410 . 12 1 1 A 32 32 TYR N N 32 117.400 120.819 -3.419 1
1 411 . 12 1 1 A 33 33 GLU H H 33 7.400 8.068 -0.668 1
1 412 . 12 1 1 A 33 33 GLU HA H 33 4.050 4.086 -0.036 1
1 417 . 12 1 1 A 33 33 GLU C C 33 180.200 179.557 0.643 1
1 418 . 12 1 1 A 33 33 GLU CA C 33 59.500 59.511 -0.011 1
1 419 . 12 1 1 A 33 33 GLU CB C 33 29.300 29.426 -0.126 1
1 421 . 12 1 1 A 33 33 GLU N N 33 116.100 117.948 -1.848 1
1 422 . 12 1 1 A 34 34 VAL H H 34 8.530 8.094 0.436 1
1 423 . 12 1 1 A 34 34 VAL HA H 34 3.350 3.329 0.021 1
1 431 . 12 1 1 A 34 34 VAL C C 34 175.800 178.091 -2.291 1
1 432 . 12 1 1 A 34 34 VAL CA C 34 66.400 66.136 0.264 1
1 433 . 12 1 1 A 34 34 VAL CB C 34 32.200 31.546 0.654 1
1 436 . 12 1 1 A 34 34 VAL N N 34 120.600 120.141 0.459 1
1 437 . 12 1 1 A 35 35 TRP H H 35 9.100 8.170 0.930 1
1 438 . 12 1 1 A 35 35 TRP HA H 35 3.340 3.710 -0.370 1
1 447 . 12 1 1 A 35 35 TRP C C 35 178.000 177.347 0.653 1
1 448 . 12 1 1 A 35 35 TRP CA C 35 61.800 60.182 1.618 1
1 449 . 12 1 1 A 35 35 TRP CB C 35 27.900 29.463 -1.563 1
1 455 . 12 1 1 A 35 35 TRP N N 35 121.700 121.308 0.392 1
1 457 . 12 1 1 A 36 36 LYS H H 36 7.970 7.751 0.219 1
1 458 . 12 1 1 A 36 36 LYS HA H 36 3.330 3.804 -0.474 1
1 467 . 12 1 1 A 36 36 LYS C C 36 180.000 177.269 2.731 1
1 468 . 12 1 1 A 36 36 LYS CA C 36 59.000 56.332 2.668 1
1 469 . 12 1 1 A 36 36 LYS CB C 36 31.800 31.898 -0.098 1
1 473 . 12 1 1 A 36 36 LYS N N 36 116.300 118.712 -2.412 1
1 474 . 12 1 1 A 37 37 TYR H H 37 7.750 7.819 -0.069 1
1 475 . 12 1 1 A 37 37 TYR HA H 37 3.940 4.020 -0.080 1
1 480 . 12 1 1 A 37 37 TYR C C 37 177.600 177.322 0.278 1
1 481 . 12 1 1 A 37 37 TYR CA C 37 61.200 60.923 0.277 1
1 482 . 12 1 1 A 37 37 TYR CB C 37 38.800 38.035 0.765 1
1 485 . 12 1 1 A 37 37 TYR N N 37 122.700 121.111 1.589 1
1 486 . 12 1 1 A 38 38 VAL H H 38 7.660 7.081 0.579 1
1 487 . 12 1 1 A 38 38 VAL HA H 38 3.870 4.148 -0.278 1
1 495 . 12 1 1 A 38 38 VAL C C 38 175.600 175.506 0.094 1
1 496 . 12 1 1 A 38 38 VAL CA C 38 61.100 61.000 0.100 1
1 497 . 12 1 1 A 38 38 VAL CB C 38 30.700 31.146 -0.446 1
1 500 . 12 1 1 A 38 38 VAL N N 38 108.200 112.660 -4.460 1
1 501 . 12 1 1 A 39 39 GLY H H 39 7.090 7.748 -0.658 1
1 502 . 12 1 1 A 39 39 GLY HA2 H 39 3.320 3.615 -0.295 1
1 503 . 12 1 1 A 39 39 GLY HA3 H 39 3.730 3.681 0.049 1
1 504 . 12 1 1 A 39 39 GLY C C 39 173.600 174.016 -0.416 1
1 505 . 12 1 1 A 39 39 GLY CA C 39 46.100 46.322 -0.222 1
1 506 . 12 1 1 A 39 39 GLY N N 39 107.600 110.532 -2.932 1
1 507 . 12 1 1 A 40 40 GLU H H 40 7.730 7.883 -0.153 1
1 508 . 12 1 1 A 40 40 GLU HA H 40 1.090 2.592 -1.502 1
1 513 . 12 1 1 A 40 40 GLU CA C 40 55.700 56.330 -0.630 1
1 514 . 12 1 1 A 40 40 GLU CB C 40 27.200 27.817 -0.617 1
1 516 . 12 1 1 A 40 40 GLU N N 40 114.400 110.802 3.598 1
1 517 . 12 1 1 A 41 41 PRO HA H 41 4.310 4.482 -0.172 1
1 524 . 12 1 1 A 41 41 PRO CA C 41 62.300 62.301 -0.001 1
1 525 . 12 1 1 A 41 41 PRO CB C 41 32.700 32.481 0.219 1
1 528 . 12 1 1 A 42 42 GLU H H 42 8.110 8.605 -0.495 1
1 529 . 12 1 1 A 42 42 GLU C C 42 175.800 175.954 -0.154 1
1 530 . 12 1 1 A 42 42 GLU CA C 42 57.800 56.633 1.167 1
1 531 . 12 1 1 A 42 42 GLU CB C 42 30.600 30.184 0.416 1
1 533 . 12 1 1 A 42 42 GLU N N 42 119.100 121.414 -2.314 1
1 534 . 12 1 1 A 43 43 LEU H H 43 8.140 9.100 -0.960 1
1 535 . 12 1 1 A 43 43 LEU HA H 43 4.840 5.002 -0.162 1
1 545 . 12 1 1 A 43 43 LEU C C 43 177.300 176.227 1.073 1
1 546 . 12 1 1 A 43 43 LEU CA C 43 53.700 53.544 0.156 1
1 547 . 12 1 1 A 43 43 LEU CB C 43 43.900 43.670 0.230 1
1 551 . 12 1 1 A 43 43 LEU N N 43 124.700 127.093 -2.393 1
1 552 . 12 1 1 A 44 44 LYS H H 44 8.640 8.528 0.112 1
1 553 . 12 1 1 A 44 44 LYS HA H 44 4.500 4.880 -0.380 1
1 562 . 12 1 1 A 44 44 LYS C C 44 174.500 175.784 -1.284 1
1 563 . 12 1 1 A 44 44 LYS CA C 44 54.700 54.741 -0.041 1
1 564 . 12 1 1 A 44 44 LYS CB C 44 36.200 34.963 1.237 1
1 568 . 12 1 1 A 44 44 LYS N N 44 123.300 123.454 -0.154 1
1 569 . 12 1 1 A 45 45 THR H H 45 7.990 8.881 -0.891 1
1 570 . 12 1 1 A 45 45 THR HA H 45 5.700 5.687 0.013 1
1 575 . 12 1 1 A 45 45 THR C C 45 175.100 173.979 1.121 1
1 576 . 12 1 1 A 45 45 THR CA C 45 59.600 59.270 0.330 1
1 577 . 12 1 1 A 45 45 THR CB C 45 73.400 72.056 1.344 1
1 579 . 12 1 1 A 45 45 THR N N 45 106.900 113.258 -6.358 1
1 580 . 12 1 1 A 46 46 TYR H H 46 8.470 9.111 -0.641 1
1 581 . 12 1 1 A 46 46 TYR HA H 46 4.930 5.631 -0.701 1
1 586 . 12 1 1 A 46 46 TYR C C 46 172.400 172.945 -0.545 1
1 587 . 12 1 1 A 46 46 TYR CA C 46 57.100 55.443 1.657 1
1 588 . 12 1 1 A 46 46 TYR CB C 46 40.200 42.054 -1.854 1
1 591 . 12 1 1 A 46 46 TYR N N 46 117.100 118.910 -1.810 1
1 592 . 12 1 1 A 47 47 VAL H H 47 8.430 8.967 -0.537 1
1 593 . 12 1 1 A 47 47 VAL HA H 47 4.890 4.449 0.441 1
1 601 . 12 1 1 A 47 47 VAL C C 47 175.800 173.925 1.875 1
1 602 . 12 1 1 A 47 47 VAL CA C 47 60.800 61.572 -0.772 1
1 603 . 12 1 1 A 47 47 VAL CB C 47 34.800 32.789 2.011 1
1 606 . 12 1 1 A 47 47 VAL N N 47 119.200 120.709 -1.509 1
1 607 . 12 1 1 A 48 48 ILE H H 48 8.680 9.245 -0.565 1
1 608 . 12 1 1 A 48 48 ILE HA H 48 4.560 4.961 -0.401 1
1 618 . 12 1 1 A 48 48 ILE C C 48 174.500 174.292 0.208 1
1 619 . 12 1 1 A 48 48 ILE CA C 48 59.700 59.400 0.300 1
1 620 . 12 1 1 A 48 48 ILE CB C 48 41.500 40.928 0.572 1
1 624 . 12 1 1 A 48 48 ILE N N 48 124.400 129.498 -5.098 1
1 625 . 12 1 1 A 49 49 GLU H H 49 8.320 8.967 -0.647 1
1 626 . 12 1 1 A 49 49 GLU C C 49 175.500 174.918 0.582 1
1 627 . 12 1 1 A 49 49 GLU CA C 49 55.500 56.368 -0.868 1
1 628 . 12 1 1 A 49 49 GLU CB C 49 31.800 30.490 1.310 1
1 630 . 12 1 1 A 49 49 GLU N N 49 123.400 128.637 -5.237 1
1 631 . 12 1 1 A 50 50 ASP H H 50 8.610 9.150 -0.540 1
1 632 . 12 1 1 A 50 50 ASP C C 50 175.100 174.501 0.599 1
1 633 . 12 1 1 A 50 50 ASP CA C 50 53.100 52.891 0.209 1
1 634 . 12 1 1 A 50 50 ASP CB C 50 44.000 41.456 2.544 1
1 635 . 12 1 1 A 50 50 ASP N N 50 124.300 126.629 -2.329 1
1 636 . 12 1 1 A 51 51 GLU H H 51 8.450 8.701 -0.251 1
1 637 . 12 1 1 A 51 51 GLU C C 51 175.900 175.967 -0.067 1
1 638 . 12 1 1 A 51 51 GLU CA C 51 56.000 56.389 -0.389 1
1 639 . 12 1 1 A 51 51 GLU CB C 51 31.700 30.268 1.432 1
1 640 . 12 1 1 A 51 51 GLU N N 51 121.300 126.652 -5.352 1
1 641 . 12 1 1 A 52 52 ILE H H 52 8.480 8.772 -0.292 1
1 642 . 12 1 1 A 52 52 ILE C C 52 175.400 175.443 -0.043 1
1 643 . 12 1 1 A 52 52 ILE CA C 52 60.400 60.143 0.257 1
1 644 . 12 1 1 A 52 52 ILE CB C 52 40.000 36.365 3.635 1
1 645 . 12 1 1 A 52 52 ILE N N 52 122.700 126.323 -3.623 1
1 646 . 12 1 1 A 53 53 VAL H H 53 8.140 8.844 -0.704 1
1 647 . 12 1 1 A 53 53 VAL C C 53 175.600 175.002 0.598 1
1 648 . 12 1 1 A 53 53 VAL CA C 53 61.900 61.566 0.334 1
1 649 . 12 1 1 A 53 53 VAL CB C 53 33.200 33.210 -0.010 1
1 650 . 12 1 1 A 53 53 VAL N N 53 124.400 127.983 -3.583 1
1 651 . 12 1 1 A 54 54 GLU H H 54 8.540 8.901 -0.361 1
1 652 . 12 1 1 A 54 54 GLU CA C 54 55.600 53.580 2.020 1
1 653 . 12 1 1 A 54 54 GLU CB C 54 34.300 32.908 1.392 1
1 654 . 12 1 1 A 54 54 GLU N N 54 125.900 124.517 1.383 1
1 655 . 12 1 1 A 55 55 PRO C C 55 177.500 176.822 0.678 1
1 656 . 12 1 1 A 55 55 PRO CA C 55 63.400 63.596 -0.196 1
1 657 . 12 1 1 A 55 55 PRO CB C 55 32.300 32.509 -0.209 1
1 658 . 12 1 1 A 56 56 GLY H H 56 8.420 8.556 -0.136 1
1 659 . 12 1 1 A 56 56 GLY HA2 H 56 3.830 4.163 -0.333 1
1 660 . 12 1 1 A 56 56 GLY HA3 H 56 4.000 4.202 -0.202 1
1 661 . 12 1 1 A 56 56 GLY C C 56 174.500 175.229 -0.729 1
1 662 . 12 1 1 A 56 56 GLY CA C 56 45.400 45.684 -0.284 1
1 663 . 12 1 1 A 56 56 GLY N N 56 109.700 108.397 1.303 1
1 664 . 12 1 1 A 57 57 GLU H H 57 8.180 7.918 0.262 1
1 665 . 12 1 1 A 57 57 GLU C C 57 176.300 177.861 -1.561 1
1 666 . 12 1 1 A 57 57 GLU CA C 57 57.500 58.511 -1.011 1
1 667 . 12 1 1 A 57 57 GLU CB C 57 30.400 29.183 1.217 1
1 668 . 12 1 1 A 57 57 GLU N N 57 120.900 119.798 1.102 1
1 669 . 12 1 1 A 58 58 TYR H H 58 8.020 7.789 0.231 1
1 670 . 12 1 1 A 58 58 TYR C C 58 175.100 176.142 -1.042 1
1 671 . 12 1 1 A 58 58 TYR CA C 58 57.400 59.555 -2.155 1
1 672 . 12 1 1 A 58 58 TYR CB C 58 38.900 39.200 -0.300 1
1 673 . 12 1 1 A 58 58 TYR N N 58 118.800 116.859 1.941 1
1 674 . 12 1 1 A 59 59 ASP H H 59 7.950 7.783 0.167 1
1 675 . 12 1 1 A 59 59 ASP CA C 59 52.700 50.920 1.780 1
1 676 . 12 1 1 A 59 59 ASP CB C 59 41.000 42.057 -1.057 1
1 677 . 12 1 1 A 59 59 ASP N N 59 123.500 119.572 3.928 1
1 678 . 12 1 1 A 61 61 PRO HA H 61 4.510 4.431 0.079 1
1 685 . 12 1 1 A 61 61 PRO C C 61 176.500 176.715 -0.215 1
1 686 . 12 1 1 A 61 61 PRO CA C 61 63.700 62.816 0.884 1
1 687 . 12 1 1 A 61 61 PRO CB C 61 34.200 31.788 2.412 1
1 690 . 12 1 1 A 62 62 GLU H H 62 8.490 8.528 -0.038 1
1 691 . 12 1 1 A 62 62 GLU N N 62 124.600 121.805 2.795 1
1 692 . 12 1 1 A 64 64 LYS C C 64 176.300 174.801 1.499 1
1 693 . 12 1 1 A 64 64 LYS CA C 64 57.000 55.280 1.720 1
1 694 . 12 1 1 A 64 64 LYS CB C 64 33.100 32.276 0.824 1
1 695 . 12 1 1 A 65 65 TYR H H 65 7.960 8.901 -0.941 1
1 696 . 12 1 1 A 65 65 TYR C C 65 176.000 176.141 -0.141 1
1 697 . 12 1 1 A 65 65 TYR CA C 65 57.800 57.430 0.370 1
1 698 . 12 1 1 A 65 65 TYR CB C 65 38.800 37.835 0.965 1
1 699 . 12 1 1 A 65 65 TYR N N 65 119.300 125.917 -6.617 1
1 700 . 12 1 1 A 66 66 THR H H 66 7.820 8.110 -0.290 1
1 701 . 12 1 1 A 66 66 THR HA H 66 4.280 4.331 -0.051 1
1 706 . 12 1 1 A 66 66 THR C C 66 174.100 175.196 -1.096 1
1 707 . 12 1 1 A 66 66 THR CA C 66 62.100 61.901 0.199 1
1 708 . 12 1 1 A 66 66 THR CB C 66 70.000 68.629 1.371 1
1 710 . 12 1 1 A 66 66 THR N N 66 113.900 115.770 -1.870 1
1 711 . 12 1 1 A 67 67 ASN H H 67 8.270 8.263 0.007 1
1 712 . 12 1 1 A 67 67 ASN C C 67 174.100 175.147 -1.047 1
1 713 . 12 1 1 A 67 67 ASN CA C 67 53.400 55.221 -1.821 1
1 714 . 12 1 1 A 67 67 ASN CB C 67 39.300 39.613 -0.313 1
1 715 . 12 1 1 A 67 67 ASN N N 67 121.400 120.056 1.344 1
1 716 . 12 1 1 A 68 68 VAL H H 68 7.660 7.680 -0.020 1
1 717 . 12 1 1 A 68 68 VAL C C 68 175.500 173.076 2.424 1
1 718 . 12 1 1 A 68 68 VAL CA C 68 61.800 60.155 1.645 1
1 719 . 12 1 1 A 68 68 VAL CB C 68 33.700 34.807 -1.107 1
1 720 . 12 1 1 A 68 68 VAL N N 68 119.400 117.110 2.290 1
1 721 . 12 1 1 A 69 69 LYS H H 69 8.690 8.659 0.031 1
1 722 . 12 1 1 A 69 69 LYS C C 69 175.200 175.157 0.043 1
1 723 . 12 1 1 A 69 69 LYS CA C 69 55.200 54.917 0.283 1
1 724 . 12 1 1 A 69 69 LYS CB C 69 35.200 34.068 1.132 1
1 725 . 12 1 1 A 69 69 LYS N N 69 126.500 130.828 -4.328 1
1 726 . 12 1 1 A 70 70 LYS H H 70 8.230 8.787 -0.557 1
1 727 . 12 1 1 A 70 70 LYS C C 70 176.400 175.465 0.935 1
1 728 . 12 1 1 A 70 70 LYS CA C 70 55.600 55.995 -0.395 1
1 729 . 12 1 1 A 70 70 LYS CB C 70 33.800 33.109 0.691 1
1 730 . 12 1 1 A 70 70 LYS N N 70 122.700 127.568 -4.868 1
1 731 . 12 1 1 A 71 71 VAL H H 71 8.530 8.498 0.032 1
1 732 . 12 1 1 A 71 71 VAL HA H 71 4.510 4.500 0.010 1
1 733 . 12 1 1 A 71 71 VAL C C 71 174.700 175.005 -0.305 1
1 734 . 12 1 1 A 71 71 VAL CA C 71 60.900 61.438 -0.538 1
1 735 . 12 1 1 A 71 71 VAL CB C 71 34.800 31.693 3.107 1
1 738 . 12 1 1 A 71 71 VAL N N 71 121.200 125.920 -4.720 1
1 739 . 12 1 1 A 72 72 LYS H H 72 8.210 8.902 -0.692 1
1 740 . 12 1 1 A 72 72 LYS HA H 72 4.800 4.601 0.199 1
1 747 . 12 1 1 A 72 72 LYS C C 72 176.200 175.323 0.877 1
1 748 . 12 1 1 A 72 72 LYS CA C 72 55.700 55.976 -0.276 1
1 749 . 12 1 1 A 72 72 LYS CB C 72 33.700 32.384 1.316 1
1 752 . 12 1 1 A 72 72 LYS N N 72 123.600 127.564 -3.964 1
1 753 . 12 1 1 A 73 73 ILE H H 73 8.890 8.953 -0.063 1
1 754 . 12 1 1 A 73 73 ILE C C 73 174.400 174.671 -0.271 1
1 755 . 12 1 1 A 73 73 ILE CA C 73 60.400 60.048 0.352 1
1 756 . 12 1 1 A 73 73 ILE CB C 73 40.800 38.257 2.543 1
1 760 . 12 1 1 A 73 73 ILE N N 73 125.100 125.761 -0.661 1
1 761 . 12 1 1 A 74 74 LYS H H 74 8.420 8.772 -0.352 1
1 762 . 12 1 1 A 74 74 LYS HA H 74 4.800 4.717 0.083 1
1 771 . 12 1 1 A 74 74 LYS C C 74 175.600 175.147 0.453 1
1 772 . 12 1 1 A 74 74 LYS CA C 74 56.200 55.537 0.663 1
1 773 . 12 1 1 A 74 74 LYS CB C 74 34.300 33.379 0.921 1
1 777 . 12 1 1 A 74 74 LYS N N 74 126.400 128.592 -2.192 1
1 778 . 12 1 1 A 75 75 LYS H H 75 9.090 8.543 0.547 1
1 779 . 12 1 1 A 75 75 LYS HA H 75 4.800 4.988 -0.188 1
1 788 . 12 1 1 A 75 75 LYS C C 75 174.900 174.691 0.209 1
1 789 . 12 1 1 A 75 75 LYS CA C 75 53.200 54.538 -1.338 1
1 790 . 12 1 1 A 75 75 LYS CB C 75 34.200 36.440 -2.240 1
1 794 . 12 1 1 A 75 75 LYS N N 75 127.500 125.427 2.073 1
1 795 . 12 1 1 A 76 76 VAL H H 76 8.610 8.906 -0.296 1
1 796 . 12 1 1 A 76 76 VAL HA H 76 5.340 5.266 0.074 1
1 804 . 12 1 1 A 76 76 VAL C C 76 171.400 174.014 -2.614 1
1 805 . 12 1 1 A 76 76 VAL CA C 76 58.000 59.632 -1.632 1
1 806 . 12 1 1 A 76 76 VAL CB C 76 36.400 35.486 0.914 1
1 809 . 12 1 1 A 76 76 VAL N N 76 120.100 121.329 -1.229 1
1 810 . 12 1 1 A 77 77 TYR H H 77 9.110 9.326 -0.216 1
1 811 . 12 1 1 A 77 77 TYR HA H 77 6.150 5.744 0.406 1
1 816 . 12 1 1 A 77 77 TYR C C 77 173.600 173.142 0.458 1
1 817 . 12 1 1 A 77 77 TYR CA C 77 56.200 55.888 0.312 1
1 818 . 12 1 1 A 77 77 TYR CB C 77 44.000 41.041 2.959 1
1 821 . 12 1 1 A 77 77 TYR N N 77 121.300 121.986 -0.686 1
1 822 . 12 1 1 A 78 78 PHE H H 78 8.190 8.769 -0.579 1
1 823 . 12 1 1 A 78 78 PHE HA H 78 5.130 5.653 -0.523 1
1 829 . 12 1 1 A 78 78 PHE C C 78 173.600 172.494 1.106 1
1 830 . 12 1 1 A 78 78 PHE CA C 78 55.900 55.301 0.599 1
1 831 . 12 1 1 A 78 78 PHE CB C 78 42.500 42.732 -0.232 1
1 835 . 12 1 1 A 78 78 PHE N N 78 112.700 117.013 -4.313 1
1 836 . 12 1 1 A 79 79 GLU H H 79 8.920 9.135 -0.215 1
1 837 . 12 1 1 A 79 79 GLU HA H 79 5.390 5.159 0.231 1
1 842 . 12 1 1 A 79 79 GLU C C 79 177.000 176.735 0.265 1
1 843 . 12 1 1 A 79 79 GLU CA C 79 54.900 54.930 -0.030 1
1 844 . 12 1 1 A 79 79 GLU CB C 79 33.600 32.437 1.163 1
1 846 . 12 1 1 A 79 79 GLU N N 79 120.500 121.897 -1.397 1
1 847 . 12 1 1 A 80 80 THR H H 80 8.970 9.146 -0.176 1
1 848 . 12 1 1 A 80 80 THR HA H 80 4.700 4.854 -0.154 1
1 854 . 12 1 1 A 80 80 THR C C 80 177.000 175.857 1.143 1
1 855 . 12 1 1 A 80 80 THR CA C 80 61.300 60.738 0.562 1
1 856 . 12 1 1 A 80 80 THR CB C 80 70.500 71.755 -1.255 1
1 858 . 12 1 1 A 80 80 THR N N 80 113.200 117.096 -3.896 1
1 859 . 12 1 1 A 81 81 LEU H H 81 8.610 8.821 -0.211 1
1 860 . 12 1 1 A 81 81 LEU HA H 81 4.230 4.194 0.036 1
1 870 . 12 1 1 A 81 81 LEU C C 81 177.400 177.305 0.095 1
1 871 . 12 1 1 A 81 81 LEU CA C 81 57.700 56.374 1.326 1
1 872 . 12 1 1 A 81 81 LEU CB C 81 42.400 41.590 0.810 1
1 876 . 12 1 1 A 81 81 LEU N N 81 120.900 122.024 -1.124 1
1 877 . 12 1 1 A 82 82 ASP H H 82 8.850 7.518 1.332 1
1 878 . 12 1 1 A 82 82 ASP HA H 82 4.670 4.720 -0.050 1
1 881 . 12 1 1 A 82 82 ASP C C 82 174.100 175.490 -1.390 1
1 882 . 12 1 1 A 82 82 ASP CA C 82 52.700 53.791 -1.091 1
1 883 . 12 1 1 A 82 82 ASP CB C 82 37.900 40.747 -2.847 1
1 884 . 12 1 1 A 82 82 ASP N N 82 112.300 117.323 -5.023 1
1 885 . 12 1 1 A 83 83 ASN H H 83 7.790 7.971 -0.181 1
1 886 . 12 1 1 A 83 83 ASN HA H 83 4.270 4.338 -0.068 1
1 891 . 12 1 1 A 83 83 ASN C C 83 176.100 173.838 2.262 1
1 892 . 12 1 1 A 83 83 ASN CA C 83 55.300 54.502 0.798 1
1 893 . 12 1 1 A 83 83 ASN CB C 83 36.900 37.676 -0.776 1
1 894 . 12 1 1 A 83 83 ASN N N 83 113.000 116.295 -3.295 1
1 896 . 12 1 1 A 84 84 VAL H H 84 7.660 7.484 0.176 1
1 897 . 12 1 1 A 84 84 VAL HA H 84 4.270 4.211 0.059 1
1 905 . 12 1 1 A 84 84 VAL C C 84 175.800 175.152 0.648 1
1 906 . 12 1 1 A 84 84 VAL CA C 84 61.500 62.109 -0.609 1
1 907 . 12 1 1 A 84 84 VAL CB C 84 33.500 32.188 1.312 1
1 910 . 12 1 1 A 84 84 VAL N N 84 119.700 119.116 0.584 1
1 911 . 12 1 1 A 85 85 ARG H H 85 8.180 9.288 -1.108 1
1 912 . 12 1 1 A 85 85 ARG HA H 85 4.870 4.700 0.170 1
1 920 . 12 1 1 A 85 85 ARG C C 85 174.000 174.974 -0.974 1
1 921 . 12 1 1 A 85 85 ARG CA C 85 55.700 55.634 0.066 1
1 922 . 12 1 1 A 85 85 ARG CB C 85 32.600 30.718 1.882 1
1 925 . 12 1 1 A 85 85 ARG N N 85 124.800 127.848 -3.048 1
1 927 . 12 1 1 A 86 86 VAL H H 86 8.570 8.576 -0.006 1
1 928 . 12 1 1 A 86 86 VAL HA H 86 4.580 4.534 0.046 1
1 936 . 12 1 1 A 86 86 VAL C C 86 175.700 175.353 0.347 1
1 937 . 12 1 1 A 86 86 VAL CA C 86 61.700 62.497 -0.797 1
1 938 . 12 1 1 A 86 86 VAL CB C 86 30.900 30.851 0.049 1
1 941 . 12 1 1 A 86 86 VAL N N 86 127.300 125.223 2.077 1
1 942 . 12 1 1 A 87 87 VAL H H 87 8.790 8.892 -0.102 1
1 943 . 12 1 1 A 87 87 VAL HA H 87 5.010 4.811 0.199 1
1 951 . 12 1 1 A 87 87 VAL C C 87 175.500 174.780 0.720 1
1 952 . 12 1 1 A 87 87 VAL CA C 87 61.900 60.962 0.938 1
1 953 . 12 1 1 A 87 87 VAL CB C 87 36.300 32.967 3.333 1
1 956 . 12 1 1 A 87 87 VAL N N 87 125.700 128.499 -2.799 1
1 957 . 12 1 1 A 88 88 THR H H 88 8.350 8.799 -0.449 1
1 958 . 12 1 1 A 88 88 THR HA H 88 4.620 4.559 0.061 1
1 964 . 12 1 1 A 88 88 THR C C 88 173.300 172.445 0.855 1
1 965 . 12 1 1 A 88 88 THR CA C 88 61.700 60.574 1.126 1
1 966 . 12 1 1 A 88 88 THR CB C 88 70.400 72.278 -1.878 1
1 968 . 12 1 1 A 88 88 THR N N 88 117.500 121.158 -3.658 1
1 969 . 12 1 1 A 89 89 ASP H H 89 7.700 8.506 -0.806 1
1 970 . 12 1 1 A 89 89 ASP HA H 89 4.480 4.372 0.108 1
1 973 . 12 1 1 A 89 89 ASP C C 89 175.900 176.771 -0.871 1
1 974 . 12 1 1 A 89 89 ASP CA C 89 55.900 54.614 1.286 1
1 975 . 12 1 1 A 89 89 ASP CB C 89 43.900 42.133 1.767 1
1 976 . 12 1 1 A 89 89 ASP N N 89 120.800 125.554 -4.754 1
1 977 . 12 1 1 A 90 90 TYR H H 90 8.240 8.941 -0.701 1
1 978 . 12 1 1 A 90 90 TYR HA H 90 3.920 4.129 -0.209 1
1 983 . 12 1 1 A 90 90 TYR C C 90 176.400 177.455 -1.055 1
1 984 . 12 1 1 A 90 90 TYR CA C 90 62.300 62.160 0.140 1
1 985 . 12 1 1 A 90 90 TYR CB C 90 39.500 38.589 0.911 1
1 988 . 12 1 1 A 90 90 TYR N N 90 126.100 128.561 -2.461 1
1 989 . 12 1 1 A 91 91 SER H H 91 9.160 8.357 0.803 1
1 990 . 12 1 1 A 91 91 SER HA H 91 4.000 4.143 -0.143 1
1 993 . 12 1 1 A 91 91 SER C C 91 178.000 177.198 0.802 1
1 994 . 12 1 1 A 91 91 SER CA C 91 62.600 61.576 1.024 1
1 995 . 12 1 1 A 91 91 SER CB C 91 62.200 62.587 -0.387 1
1 996 . 12 1 1 A 91 91 SER N N 91 116.600 114.367 2.233 1
1 997 . 12 1 1 A 92 92 GLU H H 92 8.590 8.217 0.373 1
1 998 . 12 1 1 A 92 92 GLU HA H 92 4.050 4.133 -0.083 1
1 1003 . 12 1 1 A 92 92 GLU C C 92 179.400 178.617 0.783 1
1 1004 . 12 1 1 A 92 92 GLU CA C 92 58.900 58.602 0.298 1
1 1005 . 12 1 1 A 92 92 GLU CB C 92 30.600 29.492 1.108 1
1 1007 . 12 1 1 A 92 92 GLU N N 92 120.200 122.442 -2.242 1
1 1008 . 12 1 1 A 93 93 PHE H H 93 7.870 8.010 -0.140 1
1 1009 . 12 1 1 A 93 93 PHE HA H 93 4.050 4.076 -0.026 1
1 1015 . 12 1 1 A 93 93 PHE C C 93 176.500 177.726 -1.226 1
1 1016 . 12 1 1 A 93 93 PHE CA C 93 62.200 60.933 1.267 1
1 1017 . 12 1 1 A 93 93 PHE CB C 93 39.700 39.008 0.692 1
1 1021 . 12 1 1 A 93 93 PHE N N 93 120.200 122.154 -1.954 1
1 1022 . 12 1 1 A 94 94 GLN H H 94 8.190 8.253 -0.063 1
1 1023 . 12 1 1 A 94 94 GLN HA H 94 3.390 3.657 -0.267 1
1 1030 . 12 1 1 A 94 94 GLN C C 94 178.600 178.144 0.456 1
1 1031 . 12 1 1 A 94 94 GLN CA C 94 58.800 58.224 0.576 1
1 1032 . 12 1 1 A 94 94 GLN CB C 94 28.400 27.468 0.932 1
1 1034 . 12 1 1 A 94 94 GLN N N 94 116.800 117.367 -0.567 1
1 1036 . 12 1 1 A 95 95 LYS H H 95 7.060 7.594 -0.534 1
1 1037 . 12 1 1 A 95 95 LYS HA H 95 3.780 4.016 -0.236 1
1 1046 . 12 1 1 A 95 95 LYS C C 95 179.300 179.246 0.054 1
1 1047 . 12 1 1 A 95 95 LYS CA C 95 59.900 59.049 0.851 1
1 1048 . 12 1 1 A 95 95 LYS CB C 95 32.700 32.114 0.586 1
1 1052 . 12 1 1 A 95 95 LYS N N 95 117.500 119.125 -1.625 1
1 1053 . 12 1 1 A 96 96 ILE H H 96 7.240 7.559 -0.319 1
1 1054 . 12 1 1 A 96 96 ILE HA H 96 3.420 3.551 -0.131 1
1 1064 . 12 1 1 A 96 96 ILE C C 96 177.800 178.148 -0.348 1
1 1065 . 12 1 1 A 96 96 ILE CA C 96 64.300 64.891 -0.591 1
1 1066 . 12 1 1 A 96 96 ILE CB C 96 37.400 36.905 0.495 1
1 1070 . 12 1 1 A 96 96 ILE N N 96 120.700 119.693 1.007 1
1 1071 . 12 1 1 A 97 97 LEU H H 97 7.690 7.916 -0.226 1
1 1072 . 12 1 1 A 97 97 LEU HA H 97 3.580 3.682 -0.102 1
1 1082 . 12 1 1 A 97 97 LEU C C 97 179.900 179.172 0.728 1
1 1083 . 12 1 1 A 97 97 LEU CA C 97 58.100 57.692 0.408 1
1 1084 . 12 1 1 A 97 97 LEU CB C 97 41.500 41.242 0.258 1
1 1088 . 12 1 1 A 97 97 LEU N N 97 120.000 121.088 -1.088 1
1 1089 . 12 1 1 A 98 98 LYS H H 98 7.510 7.769 -0.259 1
1 1090 . 12 1 1 A 98 98 LYS HA H 98 3.950 4.004 -0.054 1
1 1099 . 12 1 1 A 98 98 LYS C C 98 178.700 179.248 -0.548 1
1 1100 . 12 1 1 A 98 98 LYS CA C 98 58.700 59.619 -0.919 1
1 1101 . 12 1 1 A 98 98 LYS CB C 98 32.500 32.336 0.164 1
1 1105 . 12 1 1 A 98 98 LYS N N 98 117.300 118.793 -1.493 1
1 1106 . 12 1 1 A 99 99 LYS H H 99 7.470 8.268 -0.798 1
1 1107 . 12 1 1 A 99 99 LYS HA H 99 4.080 3.930 0.150 1
1 1116 . 12 1 1 A 99 99 LYS C C 99 178.100 178.401 -0.301 1
1 1117 . 12 1 1 A 99 99 LYS CA C 99 58.400 59.639 -1.239 1
1 1118 . 12 1 1 A 99 99 LYS CB C 99 33.000 32.364 0.636 1
1 1122 . 12 1 1 A 99 99 LYS N N 99 119.000 120.967 -1.967 1
1 1123 . 12 1 1 A 100 100 ARG H H 100 8.020 7.719 0.301 1
1 1124 . 12 1 1 A 100 100 ARG HA H 100 4.210 4.315 -0.105 1
1 1131 . 12 1 1 A 100 100 ARG C C 100 177.500 176.834 0.666 1
1 1132 . 12 1 1 A 100 100 ARG CA C 100 56.700 55.766 0.934 1
1 1133 . 12 1 1 A 100 100 ARG CB C 100 30.500 30.960 -0.460 1
1 1136 . 12 1 1 A 100 100 ARG N N 100 117.300 115.713 1.587 1
1 1137 . 12 1 1 A 101 101 GLY H H 101 7.910 7.539 0.371 1
1 1138 . 12 1 1 A 101 101 GLY HA2 H 101 3.980 3.938 0.042 1
1 1139 . 12 1 1 A 101 101 GLY HA3 H 101 4.020 3.954 0.066 1
1 1140 . 12 1 1 A 101 101 GLY C C 101 174.400 174.494 -0.094 1
1 1141 . 12 1 1 A 101 101 GLY CA C 101 46.000 46.739 -0.739 1
1 1142 . 12 1 1 A 101 101 GLY N N 101 108.000 108.723 -0.723 1
1 1143 . 12 1 1 A 102 102 THR H H 102 7.880 8.231 -0.351 1
1 1144 . 12 1 1 A 102 102 THR HA H 102 4.360 4.489 -0.129 1
1 1149 . 12 1 1 A 102 102 THR C C 102 174.400 174.718 -0.318 1
1 1150 . 12 1 1 A 102 102 THR CA C 102 62.100 61.728 0.372 1
1 1151 . 12 1 1 A 102 102 THR CB C 102 70.500 68.223 2.277 1
1 1153 . 12 1 1 A 102 102 THR N N 102 113.900 114.514 -0.614 1
1 1154 . 12 1 1 A 103 103 LYS H H 103 8.440 8.763 -0.323 1
1 1155 . 12 1 1 A 103 103 LYS C C 103 176.400 175.995 0.405 1
1 1156 . 12 1 1 A 103 103 LYS CA C 103 56.600 57.152 -0.552 1
1 1157 . 12 1 1 A 103 103 LYS CB C 103 33.300 30.334 2.966 1
1 1158 . 12 1 1 A 103 103 LYS N N 103 124.000 123.440 0.560 1
1 1159 . 12 1 1 A 104 104 LEU H H 104 8.180 8.094 0.086 1
1 1160 . 12 1 1 A 104 104 LEU HA H 104 4.270 4.458 -0.188 1
1 1170 . 12 1 1 A 104 104 LEU C C 104 177.100 177.719 -0.619 1
1 1171 . 12 1 1 A 104 104 LEU CA C 104 55.500 54.559 0.941 1
1 1172 . 12 1 1 A 104 104 LEU CB C 104 42.500 42.192 0.308 1
1 1176 . 12 1 1 A 104 104 LEU N N 104 123.500 120.493 3.007 1
1 1177 . 12 1 1 A 105 105 GLU H H 105 8.270 8.815 -0.545 1
1 1178 . 12 1 1 A 105 105 GLU CA C 105 56.700 58.291 -1.591 1
1 1179 . 12 1 1 A 105 105 GLU CB C 105 30.800 29.177 1.623 1
1 13 . 13 1 1 A 2 2 ASN HA H 2 4.980 4.943 0.037 1
1 18 . 13 1 1 A 2 2 ASN C C 2 176.300 176.833 -0.533 1
1 19 . 13 1 1 A 2 2 ASN CA C 2 52.500 53.045 -0.545 1
1 20 . 13 1 1 A 2 2 ASN CB C 2 40.900 39.300 1.600 1
1 22 . 13 1 1 A 3 3 SER H H 3 9.940 9.870 0.070 1
1 23 . 13 1 1 A 3 3 SER HA H 3 3.720 4.172 -0.452 1
1 26 . 13 1 1 A 3 3 SER C C 3 175.900 176.616 -0.716 1
1 27 . 13 1 1 A 3 3 SER CA C 3 63.300 60.988 2.312 1
1 28 . 13 1 1 A 3 3 SER CB C 3 61.700 62.672 -0.972 1
1 29 . 13 1 1 A 3 3 SER N N 3 118.200 117.840 0.360 1
1 30 . 13 1 1 A 4 4 GLU H H 4 8.450 8.144 0.306 1
1 31 . 13 1 1 A 4 4 GLU HA H 4 4.010 4.063 -0.053 1
1 36 . 13 1 1 A 4 4 GLU C C 4 178.800 179.287 -0.487 1
1 37 . 13 1 1 A 4 4 GLU CA C 4 60.300 59.212 1.088 1
1 38 . 13 1 1 A 4 4 GLU CB C 4 29.100 29.286 -0.186 1
1 40 . 13 1 1 A 4 4 GLU N N 4 123.600 121.713 1.887 1
1 41 . 13 1 1 A 5 5 VAL H H 5 7.590 7.956 -0.366 1
1 42 . 13 1 1 A 5 5 VAL HA H 5 3.850 3.980 -0.130 1
1 50 . 13 1 1 A 5 5 VAL C C 5 179.100 178.362 0.738 1
1 51 . 13 1 1 A 5 5 VAL CA C 5 65.800 66.557 -0.757 1
1 52 . 13 1 1 A 5 5 VAL CB C 5 32.300 31.514 0.786 1
1 55 . 13 1 1 A 5 5 VAL N N 5 119.300 119.113 0.187 1
1 56 . 13 1 1 A 6 6 ILE H H 6 7.240 8.365 -1.125 1
1 57 . 13 1 1 A 6 6 ILE HA H 6 3.580 3.649 -0.069 1
1 67 . 13 1 1 A 6 6 ILE C C 6 177.000 177.893 -0.893 1
1 68 . 13 1 1 A 6 6 ILE CA C 6 65.300 65.500 -0.200 1
1 69 . 13 1 1 A 6 6 ILE CB C 6 37.900 37.622 0.278 1
1 73 . 13 1 1 A 6 6 ILE N N 6 120.300 120.966 -0.666 1
1 74 . 13 1 1 A 7 7 LYS H H 7 8.050 8.085 -0.035 1
1 75 . 13 1 1 A 7 7 LYS HA H 7 3.570 3.640 -0.070 1
1 84 . 13 1 1 A 7 7 LYS C C 7 178.700 179.819 -1.119 1
1 85 . 13 1 1 A 7 7 LYS CA C 7 61.300 60.437 0.863 1
1 86 . 13 1 1 A 7 7 LYS CB C 7 32.200 32.181 0.019 1
1 90 . 13 1 1 A 7 7 LYS N N 7 119.200 119.046 0.154 1
1 91 . 13 1 1 A 8 8 GLU H H 8 8.100 7.886 0.214 1
1 92 . 13 1 1 A 8 8 GLU HA H 8 4.000 4.079 -0.079 1
1 97 . 13 1 1 A 8 8 GLU C C 8 178.500 179.055 -0.555 1
1 98 . 13 1 1 A 8 8 GLU CA C 8 59.700 59.089 0.611 1
1 99 . 13 1 1 A 8 8 GLU CB C 8 29.600 29.677 -0.077 1
1 101 . 13 1 1 A 8 8 GLU N N 8 119.400 120.247 -0.847 1
1 102 . 13 1 1 A 9 9 PHE H H 9 7.720 7.976 -0.256 1
1 103 . 13 1 1 A 9 9 PHE HA H 9 4.160 4.090 0.070 1
1 109 . 13 1 1 A 9 9 PHE C C 9 176.900 176.781 0.119 1
1 110 . 13 1 1 A 9 9 PHE CA C 9 61.300 61.179 0.121 1
1 111 . 13 1 1 A 9 9 PHE CB C 9 39.400 39.183 0.217 1
1 115 . 13 1 1 A 9 9 PHE N N 9 121.300 121.688 -0.388 1
1 116 . 13 1 1 A 10 10 LEU H H 10 8.060 8.797 -0.737 1
1 117 . 13 1 1 A 10 10 LEU HA H 10 3.660 3.846 -0.186 1
1 127 . 13 1 1 A 10 10 LEU C C 10 179.000 179.207 -0.207 1
1 128 . 13 1 1 A 10 10 LEU CA C 10 58.000 57.695 0.305 1
1 129 . 13 1 1 A 10 10 LEU CB C 10 41.400 41.137 0.263 1
1 133 . 13 1 1 A 10 10 LEU N N 10 118.000 119.130 -1.130 1
1 134 . 13 1 1 A 11 11 GLU H H 11 7.990 8.486 -0.496 1
1 135 . 13 1 1 A 11 11 GLU HA H 11 4.110 4.016 0.094 1
1 140 . 13 1 1 A 11 11 GLU C C 11 174.200 178.294 -4.094 1
1 141 . 13 1 1 A 11 11 GLU CA C 11 59.200 59.324 -0.124 1
1 142 . 13 1 1 A 11 11 GLU CB C 11 29.300 29.232 0.068 1
1 144 . 13 1 1 A 11 11 GLU N N 11 118.300 120.909 -2.609 1
1 145 . 13 1 1 A 12 12 ASP H H 12 8.080 7.858 0.222 1
1 146 . 13 1 1 A 12 12 ASP HA H 12 4.340 4.321 0.019 1
1 149 . 13 1 1 A 12 12 ASP C C 12 178.900 178.192 0.708 1
1 150 . 13 1 1 A 12 12 ASP CA C 12 57.600 57.718 -0.118 1
1 151 . 13 1 1 A 12 12 ASP CB C 12 41.000 41.505 -0.505 1
1 152 . 13 1 1 A 12 12 ASP N N 12 121.800 119.974 1.826 1
1 153 . 13 1 1 A 13 13 ILE H H 13 7.610 7.321 0.289 1
1 154 . 13 1 1 A 13 13 ILE HA H 13 4.240 3.978 0.262 1
1 164 . 13 1 1 A 13 13 ILE C C 13 176.800 177.129 -0.329 1
1 165 . 13 1 1 A 13 13 ILE CA C 13 62.100 61.939 0.161 1
1 166 . 13 1 1 A 13 13 ILE CB C 13 38.300 39.061 -0.761 1
1 170 . 13 1 1 A 13 13 ILE N N 13 110.800 113.120 -2.320 1
1 171 . 13 1 1 A 14 14 GLY H H 14 7.640 8.172 -0.532 1
1 172 . 13 1 1 A 14 14 GLY HA2 H 14 3.810 3.941 -0.131 1
1 173 . 13 1 1 A 14 14 GLY HA3 H 14 3.880 3.956 -0.076 1
1 174 . 13 1 1 A 14 14 GLY C C 14 175.200 174.850 0.350 1
1 175 . 13 1 1 A 14 14 GLY CA C 14 46.900 45.632 1.268 1
1 176 . 13 1 1 A 14 14 GLY N N 14 111.800 112.266 -0.466 1
1 177 . 13 1 1 A 15 15 GLU H H 15 7.870 7.876 -0.006 1
1 178 . 13 1 1 A 15 15 GLU HA H 15 4.680 4.431 0.249 1
1 183 . 13 1 1 A 15 15 GLU C C 15 175.100 176.376 -1.276 1
1 184 . 13 1 1 A 15 15 GLU CA C 15 54.800 56.016 -1.216 1
1 185 . 13 1 1 A 15 15 GLU CB C 15 32.200 30.625 1.575 1
1 187 . 13 1 1 A 15 15 GLU N N 15 119.200 120.147 -0.947 1
1 188 . 13 1 1 A 16 16 ASP H H 16 8.220 8.664 -0.444 1
1 189 . 13 1 1 A 16 16 ASP HA H 16 4.680 4.808 -0.128 1
1 192 . 13 1 1 A 16 16 ASP C C 16 174.600 175.725 -1.125 1
1 193 . 13 1 1 A 16 16 ASP CA C 16 53.600 53.992 -0.392 1
1 194 . 13 1 1 A 16 16 ASP CB C 16 42.900 41.204 1.696 1
1 195 . 13 1 1 A 16 16 ASP N N 16 120.600 123.651 -3.051 1
1 196 . 13 1 1 A 17 17 TYR H H 17 7.540 8.904 -1.364 1
1 197 . 13 1 1 A 17 17 TYR HA H 17 4.910 5.800 -0.890 1
1 202 . 13 1 1 A 17 17 TYR C C 17 173.600 174.354 -0.754 1
1 203 . 13 1 1 A 17 17 TYR CA C 17 56.200 55.481 0.719 1
1 204 . 13 1 1 A 17 17 TYR CB C 17 41.100 41.366 -0.266 1
1 207 . 13 1 1 A 17 17 TYR N N 17 112.700 120.563 -7.863 1
1 208 . 13 1 1 A 18 18 ILE H H 18 7.950 9.405 -1.455 1
1 209 . 13 1 1 A 18 18 ILE HA H 18 4.330 4.445 -0.115 1
1 219 . 13 1 1 A 18 18 ILE C C 18 174.700 174.667 0.033 1
1 220 . 13 1 1 A 18 18 ILE CA C 18 60.300 61.122 -0.822 1
1 221 . 13 1 1 A 18 18 ILE CB C 18 41.000 37.123 3.877 1
1 225 . 13 1 1 A 18 18 ILE N N 18 120.400 124.447 -4.047 1
1 226 . 13 1 1 A 19 19 GLU H H 19 8.760 8.794 -0.034 1
1 227 . 13 1 1 A 19 19 GLU HA H 19 5.200 5.067 0.133 1
1 232 . 13 1 1 A 19 19 GLU C C 19 175.200 175.863 -0.663 1
1 233 . 13 1 1 A 19 19 GLU CA C 19 55.500 55.865 -0.365 1
1 234 . 13 1 1 A 19 19 GLU CB C 19 32.400 30.508 1.892 1
1 236 . 13 1 1 A 19 19 GLU N N 19 129.000 128.817 0.183 1
1 237 . 13 1 1 A 20 20 LEU H H 20 8.730 9.451 -0.721 1
1 238 . 13 1 1 A 20 20 LEU HA H 20 4.620 4.788 -0.168 1
1 248 . 13 1 1 A 20 20 LEU C C 20 176.200 175.918 0.282 1
1 249 . 13 1 1 A 20 20 LEU CA C 20 54.100 53.549 0.551 1
1 250 . 13 1 1 A 20 20 LEU CB C 20 44.400 43.079 1.321 1
1 254 . 13 1 1 A 20 20 LEU N N 20 128.400 128.366 0.034 1
1 255 . 13 1 1 A 21 21 GLU H H 21 8.700 8.502 0.198 1
1 256 . 13 1 1 A 21 21 GLU HA H 21 3.870 4.251 -0.381 1
1 261 . 13 1 1 A 21 21 GLU C C 21 176.100 176.995 -0.895 1
1 262 . 13 1 1 A 21 21 GLU CA C 21 58.800 56.628 2.172 1
1 263 . 13 1 1 A 21 21 GLU CB C 21 28.200 29.539 -1.339 1
1 265 . 13 1 1 A 21 21 GLU N N 21 122.600 121.212 1.388 1
1 266 . 13 1 1 A 22 22 ASN H H 22 8.640 8.661 -0.021 1
1 267 . 13 1 1 A 22 22 ASN HA H 22 4.540 4.311 0.229 1
1 272 . 13 1 1 A 22 22 ASN C C 22 173.800 173.939 -0.139 1
1 273 . 13 1 1 A 22 22 ASN CA C 22 54.600 54.645 -0.045 1
1 274 . 13 1 1 A 22 22 ASN CB C 22 38.400 36.944 1.456 1
1 275 . 13 1 1 A 22 22 ASN N N 22 118.000 119.629 -1.629 1
1 277 . 13 1 1 A 23 23 GLU H H 23 7.740 7.411 0.329 1
1 278 . 13 1 1 A 23 23 GLU HA H 23 5.430 4.931 0.499 1
1 283 . 13 1 1 A 23 23 GLU C C 23 175.400 175.344 0.056 1
1 284 . 13 1 1 A 23 23 GLU CA C 23 54.900 55.000 -0.100 1
1 285 . 13 1 1 A 23 23 GLU CB C 23 34.500 31.897 2.603 1
1 287 . 13 1 1 A 23 23 GLU N N 23 116.400 117.483 -1.083 1
1 288 . 13 1 1 A 24 24 ILE H H 24 9.050 9.045 0.005 1
1 289 . 13 1 1 A 24 24 ILE HA H 24 4.810 4.724 0.086 1
1 299 . 13 1 1 A 24 24 ILE C C 24 174.600 175.148 -0.548 1
1 300 . 13 1 1 A 24 24 ILE CA C 24 60.700 60.596 0.104 1
1 301 . 13 1 1 A 24 24 ILE CB C 24 41.300 38.030 3.270 1
1 305 . 13 1 1 A 24 24 ILE N N 24 122.800 126.180 -3.380 1
1 306 . 13 1 1 A 25 25 HIS H H 25 9.490 9.696 -0.206 1
1 307 . 13 1 1 A 25 25 HIS HA H 25 5.090 5.308 -0.218 1
1 312 . 13 1 1 A 25 25 HIS C C 25 176.100 174.522 1.578 1
1 313 . 13 1 1 A 25 25 HIS CA C 25 56.100 55.640 0.460 1
1 314 . 13 1 1 A 25 25 HIS CB C 25 33.100 29.643 3.457 1
1 317 . 13 1 1 A 25 25 HIS N N 25 127.300 127.007 0.293 1
1 318 . 13 1 1 A 26 26 LEU H H 26 8.820 9.016 -0.196 1
1 319 . 13 1 1 A 26 26 LEU HA H 26 5.160 4.885 0.275 1
1 329 . 13 1 1 A 26 26 LEU C C 26 178.000 176.609 1.391 1
1 330 . 13 1 1 A 26 26 LEU CA C 26 52.900 53.691 -0.791 1
1 331 . 13 1 1 A 26 26 LEU CB C 26 48.100 43.082 5.018 1
1 335 . 13 1 1 A 26 26 LEU N N 26 121.600 125.791 -4.191 1
1 336 . 13 1 1 A 27 27 LYS H H 27 8.990 8.952 0.038 1
1 337 . 13 1 1 A 27 27 LYS HA H 27 4.630 4.711 -0.081 1
1 345 . 13 1 1 A 27 27 LYS CA C 27 55.700 53.787 1.913 1
1 346 . 13 1 1 A 27 27 LYS CB C 27 31.900 32.198 -0.298 1
1 350 . 13 1 1 A 27 27 LYS N N 27 125.900 121.267 4.633 1
1 351 . 13 1 1 A 28 28 PRO HA H 28 4.500 4.520 -0.020 1
1 358 . 13 1 1 A 28 28 PRO C C 28 177.900 178.212 -0.312 1
1 359 . 13 1 1 A 28 28 PRO CA C 28 67.400 65.935 1.465 1
1 360 . 13 1 1 A 28 28 PRO CB C 28 32.100 31.853 0.247 1
1 363 . 13 1 1 A 29 29 GLU H H 29 9.880 8.480 1.400 1
1 364 . 13 1 1 A 29 29 GLU HA H 29 4.140 4.249 -0.109 1
1 369 . 13 1 1 A 29 29 GLU C C 29 178.800 179.444 -0.644 1
1 370 . 13 1 1 A 29 29 GLU CA C 29 60.600 59.851 0.749 1
1 371 . 13 1 1 A 29 29 GLU CB C 29 29.200 29.604 -0.404 1
1 373 . 13 1 1 A 29 29 GLU N N 29 117.100 118.387 -1.287 1
1 374 . 13 1 1 A 30 30 VAL H H 30 7.050 7.913 -0.863 1
1 375 . 13 1 1 A 30 30 VAL HA H 30 3.850 3.900 -0.050 1
1 383 . 13 1 1 A 30 30 VAL C C 30 177.700 178.376 -0.676 1
1 384 . 13 1 1 A 30 30 VAL CA C 30 65.600 66.223 -0.623 1
1 385 . 13 1 1 A 30 30 VAL CB C 30 32.100 32.006 0.094 1
1 388 . 13 1 1 A 30 30 VAL N N 30 120.900 120.111 0.789 1
1 389 . 13 1 1 A 31 31 PHE H H 31 8.980 8.934 0.046 1
1 390 . 13 1 1 A 31 31 PHE HA H 31 3.870 4.282 -0.412 1
1 394 . 13 1 1 A 31 31 PHE C C 31 176.700 177.502 -0.802 1
1 395 . 13 1 1 A 31 31 PHE CA C 31 62.200 61.914 0.286 1
1 396 . 13 1 1 A 31 31 PHE CB C 31 39.300 39.167 0.133 1
1 398 . 13 1 1 A 31 31 PHE N N 31 121.100 120.460 0.640 1
1 399 . 13 1 1 A 32 32 TYR H H 32 8.640 8.595 0.045 1
1 400 . 13 1 1 A 32 32 TYR HA H 32 3.880 4.637 -0.757 1
1 405 . 13 1 1 A 32 32 TYR C C 32 176.000 177.712 -1.712 1
1 406 . 13 1 1 A 32 32 TYR CA C 32 63.300 62.150 1.150 1
1 407 . 13 1 1 A 32 32 TYR CB C 32 39.100 38.887 0.213 1
1 410 . 13 1 1 A 32 32 TYR N N 32 117.400 120.647 -3.247 1
1 411 . 13 1 1 A 33 33 GLU H H 33 7.400 8.020 -0.620 1
1 412 . 13 1 1 A 33 33 GLU HA H 33 4.050 4.101 -0.051 1
1 417 . 13 1 1 A 33 33 GLU C C 33 180.200 178.864 1.336 1
1 418 . 13 1 1 A 33 33 GLU CA C 33 59.500 58.011 1.489 1
1 419 . 13 1 1 A 33 33 GLU CB C 33 29.300 30.380 -1.080 1
1 421 . 13 1 1 A 33 33 GLU N N 33 116.100 119.770 -3.670 1
1 422 . 13 1 1 A 34 34 VAL H H 34 8.530 8.232 0.298 1
1 423 . 13 1 1 A 34 34 VAL HA H 34 3.350 3.514 -0.164 1
1 431 . 13 1 1 A 34 34 VAL C C 34 175.800 178.118 -2.318 1
1 432 . 13 1 1 A 34 34 VAL CA C 34 66.400 66.155 0.245 1
1 433 . 13 1 1 A 34 34 VAL CB C 34 32.200 31.516 0.684 1
1 436 . 13 1 1 A 34 34 VAL N N 34 120.600 120.295 0.305 1
1 437 . 13 1 1 A 35 35 TRP H H 35 9.100 8.221 0.879 1
1 438 . 13 1 1 A 35 35 TRP HA H 35 3.340 3.774 -0.434 1
1 447 . 13 1 1 A 35 35 TRP C C 35 178.000 178.091 -0.091 1
1 448 . 13 1 1 A 35 35 TRP CA C 35 61.800 60.251 1.549 1
1 449 . 13 1 1 A 35 35 TRP CB C 35 27.900 29.523 -1.623 1
1 455 . 13 1 1 A 35 35 TRP N N 35 121.700 121.638 0.062 1
1 457 . 13 1 1 A 36 36 LYS H H 36 7.970 7.799 0.171 1
1 458 . 13 1 1 A 36 36 LYS HA H 36 3.330 4.144 -0.814 1
1 467 . 13 1 1 A 36 36 LYS C C 36 180.000 178.272 1.728 1
1 468 . 13 1 1 A 36 36 LYS CA C 36 59.000 58.662 0.338 1
1 469 . 13 1 1 A 36 36 LYS CB C 36 31.800 32.531 -0.731 1
1 473 . 13 1 1 A 36 36 LYS N N 36 116.300 118.661 -2.361 1
1 474 . 13 1 1 A 37 37 TYR H H 37 7.750 7.944 -0.194 1
1 475 . 13 1 1 A 37 37 TYR HA H 37 3.940 3.951 -0.011 1
1 480 . 13 1 1 A 37 37 TYR C C 37 177.600 177.695 -0.095 1
1 481 . 13 1 1 A 37 37 TYR CA C 37 61.200 61.151 0.049 1
1 482 . 13 1 1 A 37 37 TYR CB C 37 38.800 38.509 0.291 1
1 485 . 13 1 1 A 37 37 TYR N N 37 122.700 121.293 1.407 1
1 486 . 13 1 1 A 38 38 VAL H H 38 7.660 7.298 0.362 1
1 487 . 13 1 1 A 38 38 VAL HA H 38 3.870 3.789 0.081 1
1 495 . 13 1 1 A 38 38 VAL C C 38 175.600 175.647 -0.047 1
1 496 . 13 1 1 A 38 38 VAL CA C 38 61.100 61.566 -0.466 1
1 497 . 13 1 1 A 38 38 VAL CB C 38 30.700 31.377 -0.677 1
1 500 . 13 1 1 A 38 38 VAL N N 38 108.200 112.569 -4.369 1
1 501 . 13 1 1 A 39 39 GLY H H 39 7.090 7.612 -0.522 1
1 502 . 13 1 1 A 39 39 GLY HA2 H 39 3.320 3.638 -0.318 1
1 503 . 13 1 1 A 39 39 GLY HA3 H 39 3.730 3.676 0.054 1
1 504 . 13 1 1 A 39 39 GLY C C 39 173.600 174.242 -0.642 1
1 505 . 13 1 1 A 39 39 GLY CA C 39 46.100 45.795 0.305 1
1 506 . 13 1 1 A 39 39 GLY N N 39 107.600 110.263 -2.663 1
1 507 . 13 1 1 A 40 40 GLU H H 40 7.730 7.931 -0.201 1
1 508 . 13 1 1 A 40 40 GLU HA H 40 1.090 2.474 -1.384 1
1 513 . 13 1 1 A 40 40 GLU CA C 40 55.700 56.395 -0.695 1
1 514 . 13 1 1 A 40 40 GLU CB C 40 27.200 27.737 -0.537 1
1 516 . 13 1 1 A 40 40 GLU N N 40 114.400 111.258 3.142 1
1 517 . 13 1 1 A 41 41 PRO HA H 41 4.310 4.490 -0.180 1
1 524 . 13 1 1 A 41 41 PRO CA C 41 62.300 62.190 0.110 1
1 525 . 13 1 1 A 41 41 PRO CB C 41 32.700 32.553 0.147 1
1 528 . 13 1 1 A 42 42 GLU H H 42 8.110 8.585 -0.475 1
1 529 . 13 1 1 A 42 42 GLU C C 42 175.800 176.489 -0.689 1
1 530 . 13 1 1 A 42 42 GLU CA C 42 57.800 57.009 0.791 1
1 531 . 13 1 1 A 42 42 GLU CB C 42 30.600 30.331 0.269 1
1 533 . 13 1 1 A 42 42 GLU N N 42 119.100 121.214 -2.114 1
1 534 . 13 1 1 A 43 43 LEU H H 43 8.140 9.100 -0.960 1
1 535 . 13 1 1 A 43 43 LEU HA H 43 4.840 4.902 -0.062 1
1 545 . 13 1 1 A 43 43 LEU C C 43 177.300 175.294 2.006 1
1 546 . 13 1 1 A 43 43 LEU CA C 43 53.700 53.901 -0.201 1
1 547 . 13 1 1 A 43 43 LEU CB C 43 43.900 42.447 1.453 1
1 551 . 13 1 1 A 43 43 LEU N N 43 124.700 126.472 -1.772 1
1 552 . 13 1 1 A 44 44 LYS H H 44 8.640 8.831 -0.191 1
1 553 . 13 1 1 A 44 44 LYS HA H 44 4.500 4.559 -0.059 1
1 562 . 13 1 1 A 44 44 LYS C C 44 174.500 175.875 -1.375 1
1 563 . 13 1 1 A 44 44 LYS CA C 44 54.700 55.509 -0.809 1
1 564 . 13 1 1 A 44 44 LYS CB C 44 36.200 32.777 3.423 1
1 568 . 13 1 1 A 44 44 LYS N N 44 123.300 124.339 -1.039 1
1 569 . 13 1 1 A 45 45 THR H H 45 7.990 8.418 -0.428 1
1 570 . 13 1 1 A 45 45 THR HA H 45 5.700 5.218 0.482 1
1 575 . 13 1 1 A 45 45 THR C C 45 175.100 173.684 1.416 1
1 576 . 13 1 1 A 45 45 THR CA C 45 59.600 60.873 -1.273 1
1 577 . 13 1 1 A 45 45 THR CB C 45 73.400 69.877 3.523 1
1 579 . 13 1 1 A 45 45 THR N N 45 106.900 116.570 -9.670 1
1 580 . 13 1 1 A 46 46 TYR H H 46 8.470 9.383 -0.913 1
1 581 . 13 1 1 A 46 46 TYR HA H 46 4.930 5.861 -0.931 1
1 586 . 13 1 1 A 46 46 TYR C C 46 172.400 174.229 -1.829 1
1 587 . 13 1 1 A 46 46 TYR CA C 46 57.100 55.061 2.039 1
1 588 . 13 1 1 A 46 46 TYR CB C 46 40.200 42.010 -1.810 1
1 591 . 13 1 1 A 46 46 TYR N N 46 117.100 119.879 -2.779 1
1 592 . 13 1 1 A 47 47 VAL H H 47 8.430 9.045 -0.615 1
1 593 . 13 1 1 A 47 47 VAL HA H 47 4.890 4.649 0.241 1
1 601 . 13 1 1 A 47 47 VAL C C 47 175.800 174.160 1.640 1
1 602 . 13 1 1 A 47 47 VAL CA C 47 60.800 61.587 -0.787 1
1 603 . 13 1 1 A 47 47 VAL CB C 47 34.800 32.895 1.905 1
1 606 . 13 1 1 A 47 47 VAL N N 47 119.200 120.742 -1.542 1
1 607 . 13 1 1 A 48 48 ILE H H 48 8.680 9.143 -0.463 1
1 608 . 13 1 1 A 48 48 ILE HA H 48 4.560 4.934 -0.374 1
1 618 . 13 1 1 A 48 48 ILE C C 48 174.500 173.680 0.820 1
1 619 . 13 1 1 A 48 48 ILE CA C 48 59.700 59.753 -0.053 1
1 620 . 13 1 1 A 48 48 ILE CB C 48 41.500 39.972 1.528 1
1 624 . 13 1 1 A 48 48 ILE N N 48 124.400 129.434 -5.034 1
1 625 . 13 1 1 A 49 49 GLU H H 49 8.320 8.848 -0.528 1
1 626 . 13 1 1 A 49 49 GLU C C 49 175.500 174.987 0.513 1
1 627 . 13 1 1 A 49 49 GLU CA C 49 55.500 55.246 0.254 1
1 628 . 13 1 1 A 49 49 GLU CB C 49 31.800 30.975 0.825 1
1 630 . 13 1 1 A 49 49 GLU N N 49 123.400 128.174 -4.774 1
1 631 . 13 1 1 A 50 50 ASP H H 50 8.610 8.858 -0.248 1
1 632 . 13 1 1 A 50 50 ASP C C 50 175.100 175.073 0.027 1
1 633 . 13 1 1 A 50 50 ASP CA C 50 53.100 52.021 1.079 1
1 634 . 13 1 1 A 50 50 ASP CB C 50 44.000 44.575 -0.575 1
1 635 . 13 1 1 A 50 50 ASP N N 50 124.300 126.038 -1.738 1
1 636 . 13 1 1 A 51 51 GLU H H 51 8.450 8.405 0.045 1
1 637 . 13 1 1 A 51 51 GLU C C 51 175.900 176.503 -0.603 1
1 638 . 13 1 1 A 51 51 GLU CA C 51 56.000 56.613 -0.613 1
1 639 . 13 1 1 A 51 51 GLU CB C 51 31.700 30.438 1.262 1
1 640 . 13 1 1 A 51 51 GLU N N 51 121.300 121.134 0.166 1
1 641 . 13 1 1 A 52 52 ILE H H 52 8.480 8.111 0.369 1
1 642 . 13 1 1 A 52 52 ILE C C 52 175.400 174.820 0.580 1
1 643 . 13 1 1 A 52 52 ILE CA C 52 60.400 61.677 -1.277 1
1 644 . 13 1 1 A 52 52 ILE CB C 52 40.000 38.146 1.854 1
1 645 . 13 1 1 A 52 52 ILE N N 52 122.700 123.077 -0.377 1
1 646 . 13 1 1 A 53 53 VAL H H 53 8.140 8.200 -0.060 1
1 647 . 13 1 1 A 53 53 VAL C C 53 175.600 175.642 -0.042 1
1 648 . 13 1 1 A 53 53 VAL CA C 53 61.900 61.316 0.584 1
1 649 . 13 1 1 A 53 53 VAL CB C 53 33.200 33.032 0.168 1
1 650 . 13 1 1 A 53 53 VAL N N 53 124.400 126.934 -2.534 1
1 651 . 13 1 1 A 54 54 GLU H H 54 8.540 8.531 0.009 1
1 652 . 13 1 1 A 54 54 GLU CA C 54 55.600 54.219 1.381 1
1 653 . 13 1 1 A 54 54 GLU CB C 54 34.300 30.783 3.517 1
1 654 . 13 1 1 A 54 54 GLU N N 54 125.900 122.712 3.188 1
1 655 . 13 1 1 A 55 55 PRO C C 55 177.500 176.941 0.559 1
1 656 . 13 1 1 A 55 55 PRO CA C 55 63.400 63.892 -0.492 1
1 657 . 13 1 1 A 55 55 PRO CB C 55 32.300 32.724 -0.424 1
1 658 . 13 1 1 A 56 56 GLY H H 56 8.420 7.073 1.347 1
1 659 . 13 1 1 A 56 56 GLY HA2 H 56 3.830 4.136 -0.306 1
1 660 . 13 1 1 A 56 56 GLY HA3 H 56 4.000 4.147 -0.147 1
1 661 . 13 1 1 A 56 56 GLY C C 56 174.500 173.847 0.653 1
1 662 . 13 1 1 A 56 56 GLY CA C 56 45.400 45.447 -0.047 1
1 663 . 13 1 1 A 56 56 GLY N N 56 109.700 106.976 2.724 1
1 664 . 13 1 1 A 57 57 GLU H H 57 8.180 8.807 -0.627 1
1 665 . 13 1 1 A 57 57 GLU C C 57 176.300 176.404 -0.104 1
1 666 . 13 1 1 A 57 57 GLU CA C 57 57.500 55.184 2.316 1
1 667 . 13 1 1 A 57 57 GLU CB C 57 30.400 30.308 0.092 1
1 668 . 13 1 1 A 57 57 GLU N N 57 120.900 120.359 0.541 1
1 669 . 13 1 1 A 58 58 TYR H H 58 8.020 8.007 0.013 1
1 670 . 13 1 1 A 58 58 TYR C C 58 175.100 175.270 -0.170 1
1 671 . 13 1 1 A 58 58 TYR CA C 58 57.400 61.512 -4.112 1
1 672 . 13 1 1 A 58 58 TYR CB C 58 38.900 38.986 -0.086 1
1 673 . 13 1 1 A 58 58 TYR N N 58 118.800 124.033 -5.233 1
1 674 . 13 1 1 A 59 59 ASP H H 59 7.950 7.837 0.113 1
1 675 . 13 1 1 A 59 59 ASP CA C 59 52.700 50.397 2.303 1
1 676 . 13 1 1 A 59 59 ASP CB C 59 41.000 41.936 -0.936 1
1 677 . 13 1 1 A 59 59 ASP N N 59 123.500 118.445 5.055 1
1 678 . 13 1 1 A 61 61 PRO HA H 61 4.510 4.701 -0.191 1
1 685 . 13 1 1 A 61 61 PRO C C 61 176.500 176.842 -0.342 1
1 686 . 13 1 1 A 61 61 PRO CA C 61 63.700 62.543 1.157 1
1 687 . 13 1 1 A 61 61 PRO CB C 61 34.200 31.660 2.540 1
1 690 . 13 1 1 A 62 62 GLU H H 62 8.490 8.327 0.163 1
1 691 . 13 1 1 A 62 62 GLU N N 62 124.600 123.897 0.703 1
1 692 . 13 1 1 A 64 64 LYS C C 64 176.300 176.482 -0.182 1
1 693 . 13 1 1 A 64 64 LYS CA C 64 57.000 57.566 -0.566 1
1 694 . 13 1 1 A 64 64 LYS CB C 64 33.100 33.031 0.069 1
1 695 . 13 1 1 A 65 65 TYR H H 65 7.960 7.996 -0.036 1
1 696 . 13 1 1 A 65 65 TYR C C 65 176.000 174.649 1.351 1
1 697 . 13 1 1 A 65 65 TYR CA C 65 57.800 56.224 1.576 1
1 698 . 13 1 1 A 65 65 TYR CB C 65 38.800 36.483 2.317 1
1 699 . 13 1 1 A 65 65 TYR N N 65 119.300 115.100 4.200 1
1 700 . 13 1 1 A 66 66 THR H H 66 7.820 7.878 -0.058 1
1 701 . 13 1 1 A 66 66 THR HA H 66 4.280 4.332 -0.052 1
1 706 . 13 1 1 A 66 66 THR C C 66 174.100 174.041 0.059 1
1 707 . 13 1 1 A 66 66 THR CA C 66 62.100 62.209 -0.109 1
1 708 . 13 1 1 A 66 66 THR CB C 66 70.000 69.510 0.490 1
1 710 . 13 1 1 A 66 66 THR N N 66 113.900 113.212 0.688 1
1 711 . 13 1 1 A 67 67 ASN H H 67 8.270 8.804 -0.534 1
1 712 . 13 1 1 A 67 67 ASN C C 67 174.100 174.002 0.098 1
1 713 . 13 1 1 A 67 67 ASN CA C 67 53.400 53.032 0.368 1
1 714 . 13 1 1 A 67 67 ASN CB C 67 39.300 39.049 0.251 1
1 715 . 13 1 1 A 67 67 ASN N N 67 121.400 124.372 -2.972 1
1 716 . 13 1 1 A 68 68 VAL H H 68 7.660 8.748 -1.088 1
1 717 . 13 1 1 A 68 68 VAL C C 68 175.500 174.874 0.626 1
1 718 . 13 1 1 A 68 68 VAL CA C 68 61.800 62.383 -0.583 1
1 719 . 13 1 1 A 68 68 VAL CB C 68 33.700 32.024 1.676 1
1 720 . 13 1 1 A 68 68 VAL N N 68 119.400 127.405 -8.005 1
1 721 . 13 1 1 A 69 69 LYS H H 69 8.690 8.979 -0.289 1
1 722 . 13 1 1 A 69 69 LYS C C 69 175.200 175.013 0.187 1
1 723 . 13 1 1 A 69 69 LYS CA C 69 55.200 54.543 0.657 1
1 724 . 13 1 1 A 69 69 LYS CB C 69 35.200 35.702 -0.502 1
1 725 . 13 1 1 A 69 69 LYS N N 69 126.500 129.212 -2.712 1
1 726 . 13 1 1 A 70 70 LYS H H 70 8.230 8.825 -0.595 1
1 727 . 13 1 1 A 70 70 LYS C C 70 176.400 175.752 0.648 1
1 728 . 13 1 1 A 70 70 LYS CA C 70 55.600 54.865 0.735 1
1 729 . 13 1 1 A 70 70 LYS CB C 70 33.800 35.661 -1.861 1
1 730 . 13 1 1 A 70 70 LYS N N 70 122.700 125.311 -2.611 1
1 731 . 13 1 1 A 71 71 VAL H H 71 8.530 9.586 -1.056 1
1 732 . 13 1 1 A 71 71 VAL HA H 71 4.510 4.871 -0.361 1
1 733 . 13 1 1 A 71 71 VAL C C 71 174.700 174.384 0.316 1
1 734 . 13 1 1 A 71 71 VAL CA C 71 60.900 60.572 0.328 1
1 735 . 13 1 1 A 71 71 VAL CB C 71 34.800 34.196 0.604 1
1 738 . 13 1 1 A 71 71 VAL N N 71 121.200 118.621 2.579 1
1 739 . 13 1 1 A 72 72 LYS H H 72 8.210 8.828 -0.618 1
1 740 . 13 1 1 A 72 72 LYS HA H 72 4.800 4.655 0.145 1
1 747 . 13 1 1 A 72 72 LYS C C 72 176.200 175.186 1.014 1
1 748 . 13 1 1 A 72 72 LYS CA C 72 55.700 55.753 -0.053 1
1 749 . 13 1 1 A 72 72 LYS CB C 72 33.700 32.289 1.411 1
1 752 . 13 1 1 A 72 72 LYS N N 72 123.600 125.706 -2.106 1
1 753 . 13 1 1 A 73 73 ILE H H 73 8.890 8.912 -0.022 1
1 754 . 13 1 1 A 73 73 ILE C C 73 174.400 174.647 -0.247 1
1 755 . 13 1 1 A 73 73 ILE CA C 73 60.400 60.206 0.194 1
1 756 . 13 1 1 A 73 73 ILE CB C 73 40.800 38.345 2.455 1
1 760 . 13 1 1 A 73 73 ILE N N 73 125.100 126.062 -0.962 1
1 761 . 13 1 1 A 74 74 LYS H H 74 8.420 8.768 -0.348 1
1 762 . 13 1 1 A 74 74 LYS HA H 74 4.800 4.923 -0.123 1
1 771 . 13 1 1 A 74 74 LYS C C 74 175.600 175.027 0.573 1
1 772 . 13 1 1 A 74 74 LYS CA C 74 56.200 54.862 1.338 1
1 773 . 13 1 1 A 74 74 LYS CB C 74 34.300 34.034 0.266 1
1 777 . 13 1 1 A 74 74 LYS N N 74 126.400 128.190 -1.790 1
1 778 . 13 1 1 A 75 75 LYS H H 75 9.090 8.601 0.489 1
1 779 . 13 1 1 A 75 75 LYS HA H 75 4.800 4.950 -0.150 1
1 788 . 13 1 1 A 75 75 LYS C C 75 174.900 174.747 0.153 1
1 789 . 13 1 1 A 75 75 LYS CA C 75 53.200 54.396 -1.196 1
1 790 . 13 1 1 A 75 75 LYS CB C 75 34.200 35.940 -1.740 1
1 794 . 13 1 1 A 75 75 LYS N N 75 127.500 126.111 1.389 1
1 795 . 13 1 1 A 76 76 VAL H H 76 8.610 8.959 -0.349 1
1 796 . 13 1 1 A 76 76 VAL HA H 76 5.340 5.297 0.043 1
1 804 . 13 1 1 A 76 76 VAL C C 76 171.400 173.611 -2.211 1
1 805 . 13 1 1 A 76 76 VAL CA C 76 58.000 59.513 -1.513 1
1 806 . 13 1 1 A 76 76 VAL CB C 76 36.400 35.422 0.978 1
1 809 . 13 1 1 A 76 76 VAL N N 76 120.100 121.077 -0.977 1
1 810 . 13 1 1 A 77 77 TYR H H 77 9.110 8.931 0.179 1
1 811 . 13 1 1 A 77 77 TYR HA H 77 6.150 5.767 0.383 1
1 816 . 13 1 1 A 77 77 TYR C C 77 173.600 172.887 0.713 1
1 817 . 13 1 1 A 77 77 TYR CA C 77 56.200 55.747 0.453 1
1 818 . 13 1 1 A 77 77 TYR CB C 77 44.000 41.308 2.692 1
1 821 . 13 1 1 A 77 77 TYR N N 77 121.300 121.642 -0.342 1
1 822 . 13 1 1 A 78 78 PHE H H 78 8.190 8.623 -0.433 1
1 823 . 13 1 1 A 78 78 PHE HA H 78 5.130 5.743 -0.613 1
1 829 . 13 1 1 A 78 78 PHE C C 78 173.600 173.422 0.178 1
1 830 . 13 1 1 A 78 78 PHE CA C 78 55.900 55.214 0.686 1
1 831 . 13 1 1 A 78 78 PHE CB C 78 42.500 42.578 -0.078 1
1 835 . 13 1 1 A 78 78 PHE N N 78 112.700 117.450 -4.750 1
1 836 . 13 1 1 A 79 79 GLU H H 79 8.920 9.072 -0.152 1
1 837 . 13 1 1 A 79 79 GLU HA H 79 5.390 5.243 0.147 1
1 842 . 13 1 1 A 79 79 GLU C C 79 177.000 176.525 0.475 1
1 843 . 13 1 1 A 79 79 GLU CA C 79 54.900 54.767 0.133 1
1 844 . 13 1 1 A 79 79 GLU CB C 79 33.600 33.065 0.535 1
1 846 . 13 1 1 A 79 79 GLU N N 79 120.500 119.532 0.968 1
1 847 . 13 1 1 A 80 80 THR H H 80 8.970 8.730 0.240 1
1 848 . 13 1 1 A 80 80 THR HA H 80 4.700 5.005 -0.305 1
1 854 . 13 1 1 A 80 80 THR C C 80 177.000 176.195 0.805 1
1 855 . 13 1 1 A 80 80 THR CA C 80 61.300 60.012 1.288 1
1 856 . 13 1 1 A 80 80 THR CB C 80 70.500 71.769 -1.269 1
1 858 . 13 1 1 A 80 80 THR N N 80 113.200 113.613 -0.413 1
1 859 . 13 1 1 A 81 81 LEU H H 81 8.610 8.419 0.191 1
1 860 . 13 1 1 A 81 81 LEU HA H 81 4.230 4.068 0.162 1
1 870 . 13 1 1 A 81 81 LEU C C 81 177.400 177.590 -0.190 1
1 871 . 13 1 1 A 81 81 LEU CA C 81 57.700 57.343 0.357 1
1 872 . 13 1 1 A 81 81 LEU CB C 81 42.400 41.608 0.792 1
1 876 . 13 1 1 A 81 81 LEU N N 81 120.900 121.925 -1.025 1
1 877 . 13 1 1 A 82 82 ASP H H 82 8.850 7.939 0.911 1
1 878 . 13 1 1 A 82 82 ASP HA H 82 4.670 4.758 -0.088 1
1 881 . 13 1 1 A 82 82 ASP C C 82 174.100 175.767 -1.667 1
1 882 . 13 1 1 A 82 82 ASP CA C 82 52.700 53.847 -1.147 1
1 883 . 13 1 1 A 82 82 ASP CB C 82 37.900 40.914 -3.014 1
1 884 . 13 1 1 A 82 82 ASP N N 82 112.300 117.292 -4.992 1
1 885 . 13 1 1 A 83 83 ASN H H 83 7.790 8.076 -0.286 1
1 886 . 13 1 1 A 83 83 ASN HA H 83 4.270 4.329 -0.059 1
1 891 . 13 1 1 A 83 83 ASN C C 83 176.100 174.097 2.003 1
1 892 . 13 1 1 A 83 83 ASN CA C 83 55.300 54.628 0.672 1
1 893 . 13 1 1 A 83 83 ASN CB C 83 36.900 38.194 -1.294 1
1 894 . 13 1 1 A 83 83 ASN N N 83 113.000 116.077 -3.077 1
1 896 . 13 1 1 A 84 84 VAL H H 84 7.660 7.228 0.432 1
1 897 . 13 1 1 A 84 84 VAL HA H 84 4.270 4.283 -0.013 1
1 905 . 13 1 1 A 84 84 VAL C C 84 175.800 174.797 1.003 1
1 906 . 13 1 1 A 84 84 VAL CA C 84 61.500 62.647 -1.147 1
1 907 . 13 1 1 A 84 84 VAL CB C 84 33.500 31.496 2.004 1
1 910 . 13 1 1 A 84 84 VAL N N 84 119.700 121.409 -1.709 1
1 911 . 13 1 1 A 85 85 ARG H H 85 8.180 9.051 -0.871 1
1 912 . 13 1 1 A 85 85 ARG HA H 85 4.870 4.838 0.032 1
1 920 . 13 1 1 A 85 85 ARG C C 85 174.000 175.027 -1.027 1
1 921 . 13 1 1 A 85 85 ARG CA C 85 55.700 55.589 0.111 1
1 922 . 13 1 1 A 85 85 ARG CB C 85 32.600 30.863 1.737 1
1 925 . 13 1 1 A 85 85 ARG N N 85 124.800 127.958 -3.158 1
1 927 . 13 1 1 A 86 86 VAL H H 86 8.570 8.391 0.179 1
1 928 . 13 1 1 A 86 86 VAL HA H 86 4.580 4.762 -0.182 1
1 936 . 13 1 1 A 86 86 VAL C C 86 175.700 175.210 0.490 1
1 937 . 13 1 1 A 86 86 VAL CA C 86 61.700 62.111 -0.411 1
1 938 . 13 1 1 A 86 86 VAL CB C 86 30.900 30.899 0.001 1
1 941 . 13 1 1 A 86 86 VAL N N 86 127.300 125.129 2.171 1
1 942 . 13 1 1 A 87 87 VAL H H 87 8.790 8.873 -0.083 1
1 943 . 13 1 1 A 87 87 VAL HA H 87 5.010 4.842 0.168 1
1 951 . 13 1 1 A 87 87 VAL C C 87 175.500 174.741 0.759 1
1 952 . 13 1 1 A 87 87 VAL CA C 87 61.900 60.960 0.940 1
1 953 . 13 1 1 A 87 87 VAL CB C 87 36.300 32.825 3.475 1
1 956 . 13 1 1 A 87 87 VAL N N 87 125.700 128.587 -2.887 1
1 957 . 13 1 1 A 88 88 THR H H 88 8.350 8.882 -0.532 1
1 958 . 13 1 1 A 88 88 THR HA H 88 4.620 4.535 0.085 1
1 964 . 13 1 1 A 88 88 THR C C 88 173.300 172.452 0.848 1
1 965 . 13 1 1 A 88 88 THR CA C 88 61.700 60.667 1.033 1
1 966 . 13 1 1 A 88 88 THR CB C 88 70.400 71.954 -1.554 1
1 968 . 13 1 1 A 88 88 THR N N 88 117.500 120.461 -2.961 1
1 969 . 13 1 1 A 89 89 ASP H H 89 7.700 8.539 -0.839 1
1 970 . 13 1 1 A 89 89 ASP HA H 89 4.480 4.626 -0.146 1
1 973 . 13 1 1 A 89 89 ASP C C 89 175.900 177.155 -1.255 1
1 974 . 13 1 1 A 89 89 ASP CA C 89 55.900 54.553 1.347 1
1 975 . 13 1 1 A 89 89 ASP CB C 89 43.900 41.978 1.922 1
1 976 . 13 1 1 A 89 89 ASP N N 89 120.800 126.125 -5.325 1
1 977 . 13 1 1 A 90 90 TYR H H 90 8.240 9.051 -0.811 1
1 978 . 13 1 1 A 90 90 TYR HA H 90 3.920 4.190 -0.270 1
1 983 . 13 1 1 A 90 90 TYR C C 90 176.400 177.853 -1.453 1
1 984 . 13 1 1 A 90 90 TYR CA C 90 62.300 60.776 1.524 1
1 985 . 13 1 1 A 90 90 TYR CB C 90 39.500 39.081 0.419 1
1 988 . 13 1 1 A 90 90 TYR N N 90 126.100 128.306 -2.206 1
1 989 . 13 1 1 A 91 91 SER H H 91 9.160 7.977 1.183 1
1 990 . 13 1 1 A 91 91 SER HA H 91 4.000 4.108 -0.108 1
1 993 . 13 1 1 A 91 91 SER C C 91 178.000 177.310 0.690 1
1 994 . 13 1 1 A 91 91 SER CA C 91 62.600 61.376 1.224 1
1 995 . 13 1 1 A 91 91 SER CB C 91 62.200 62.681 -0.481 1
1 996 . 13 1 1 A 91 91 SER N N 91 116.600 114.653 1.947 1
1 997 . 13 1 1 A 92 92 GLU H H 92 8.590 7.933 0.657 1
1 998 . 13 1 1 A 92 92 GLU HA H 92 4.050 4.132 -0.082 1
1 1003 . 13 1 1 A 92 92 GLU C C 92 179.400 178.547 0.853 1
1 1004 . 13 1 1 A 92 92 GLU CA C 92 58.900 58.681 0.219 1
1 1005 . 13 1 1 A 92 92 GLU CB C 92 30.600 29.499 1.101 1
1 1007 . 13 1 1 A 92 92 GLU N N 92 120.200 121.565 -1.365 1
1 1008 . 13 1 1 A 93 93 PHE H H 93 7.870 8.207 -0.337 1
1 1009 . 13 1 1 A 93 93 PHE HA H 93 4.050 4.145 -0.095 1
1 1015 . 13 1 1 A 93 93 PHE C C 93 176.500 178.048 -1.548 1
1 1016 . 13 1 1 A 93 93 PHE CA C 93 62.200 61.089 1.111 1
1 1017 . 13 1 1 A 93 93 PHE CB C 93 39.700 39.114 0.586 1
1 1021 . 13 1 1 A 93 93 PHE N N 93 120.200 122.111 -1.911 1
1 1022 . 13 1 1 A 94 94 GLN H H 94 8.190 8.141 0.049 1
1 1023 . 13 1 1 A 94 94 GLN HA H 94 3.390 3.562 -0.172 1
1 1030 . 13 1 1 A 94 94 GLN C C 94 178.600 178.108 0.492 1
1 1031 . 13 1 1 A 94 94 GLN CA C 94 58.800 58.890 -0.090 1
1 1032 . 13 1 1 A 94 94 GLN CB C 94 28.400 27.956 0.444 1
1 1034 . 13 1 1 A 94 94 GLN N N 94 116.800 118.083 -1.283 1
1 1036 . 13 1 1 A 95 95 LYS H H 95 7.060 7.866 -0.806 1
1 1037 . 13 1 1 A 95 95 LYS HA H 95 3.780 3.945 -0.165 1
1 1046 . 13 1 1 A 95 95 LYS C C 95 179.300 179.255 0.045 1
1 1047 . 13 1 1 A 95 95 LYS CA C 95 59.900 59.170 0.730 1
1 1048 . 13 1 1 A 95 95 LYS CB C 95 32.700 32.114 0.586 1
1 1052 . 13 1 1 A 95 95 LYS N N 95 117.500 120.956 -3.456 1
1 1053 . 13 1 1 A 96 96 ILE H H 96 7.240 7.467 -0.227 1
1 1054 . 13 1 1 A 96 96 ILE HA H 96 3.420 3.532 -0.112 1
1 1064 . 13 1 1 A 96 96 ILE C C 96 177.800 177.720 0.080 1
1 1065 . 13 1 1 A 96 96 ILE CA C 96 64.300 64.614 -0.314 1
1 1066 . 13 1 1 A 96 96 ILE CB C 96 37.400 36.590 0.810 1
1 1070 . 13 1 1 A 96 96 ILE N N 96 120.700 119.347 1.353 1
1 1071 . 13 1 1 A 97 97 LEU H H 97 7.690 7.856 -0.166 1
1 1072 . 13 1 1 A 97 97 LEU HA H 97 3.580 3.718 -0.138 1
1 1082 . 13 1 1 A 97 97 LEU C C 97 179.900 178.521 1.379 1
1 1083 . 13 1 1 A 97 97 LEU CA C 97 58.100 58.414 -0.314 1
1 1084 . 13 1 1 A 97 97 LEU CB C 97 41.500 41.471 0.029 1
1 1088 . 13 1 1 A 97 97 LEU N N 97 120.000 121.787 -1.787 1
1 1089 . 13 1 1 A 98 98 LYS H H 98 7.510 8.343 -0.833 1
1 1090 . 13 1 1 A 98 98 LYS HA H 98 3.950 3.879 0.071 1
1 1099 . 13 1 1 A 98 98 LYS C C 98 178.700 179.105 -0.405 1
1 1100 . 13 1 1 A 98 98 LYS CA C 98 58.700 59.930 -1.230 1
1 1101 . 13 1 1 A 98 98 LYS CB C 98 32.500 32.044 0.456 1
1 1105 . 13 1 1 A 98 98 LYS N N 98 117.300 118.221 -0.921 1
1 1106 . 13 1 1 A 99 99 LYS H H 99 7.470 8.015 -0.545 1
1 1107 . 13 1 1 A 99 99 LYS HA H 99 4.080 3.900 0.180 1
1 1116 . 13 1 1 A 99 99 LYS C C 99 178.100 178.452 -0.352 1
1 1117 . 13 1 1 A 99 99 LYS CA C 99 58.400 59.501 -1.101 1
1 1118 . 13 1 1 A 99 99 LYS CB C 99 33.000 32.394 0.606 1
1 1122 . 13 1 1 A 99 99 LYS N N 99 119.000 120.782 -1.782 1
1 1123 . 13 1 1 A 100 100 ARG H H 100 8.020 7.686 0.334 1
1 1124 . 13 1 1 A 100 100 ARG HA H 100 4.210 4.245 -0.035 1
1 1131 . 13 1 1 A 100 100 ARG C C 100 177.500 176.265 1.235 1
1 1132 . 13 1 1 A 100 100 ARG CA C 100 56.700 57.632 -0.932 1
1 1133 . 13 1 1 A 100 100 ARG CB C 100 30.500 31.196 -0.696 1
1 1136 . 13 1 1 A 100 100 ARG N N 100 117.300 118.428 -1.128 1
1 1137 . 13 1 1 A 101 101 GLY H H 101 7.910 7.650 0.260 1
1 1138 . 13 1 1 A 101 101 GLY HA2 H 101 3.980 3.991 -0.011 1
1 1139 . 13 1 1 A 101 101 GLY HA3 H 101 4.020 4.009 0.011 1
1 1140 . 13 1 1 A 101 101 GLY C C 101 174.400 174.395 0.005 1
1 1141 . 13 1 1 A 101 101 GLY CA C 101 46.000 44.928 1.072 1
1 1142 . 13 1 1 A 101 101 GLY N N 101 108.000 107.882 0.118 1
1 1143 . 13 1 1 A 102 102 THR H H 102 7.880 7.398 0.482 1
1 1144 . 13 1 1 A 102 102 THR HA H 102 4.360 4.253 0.107 1
1 1149 . 13 1 1 A 102 102 THR C C 102 174.400 174.209 0.191 1
1 1150 . 13 1 1 A 102 102 THR CA C 102 62.100 63.251 -1.151 1
1 1151 . 13 1 1 A 102 102 THR CB C 102 70.500 69.676 0.824 1
1 1153 . 13 1 1 A 102 102 THR N N 102 113.900 117.118 -3.218 1
1 1154 . 13 1 1 A 103 103 LYS H H 103 8.440 8.740 -0.300 1
1 1155 . 13 1 1 A 103 103 LYS C C 103 176.400 175.997 0.403 1
1 1156 . 13 1 1 A 103 103 LYS CA C 103 56.600 54.840 1.760 1
1 1157 . 13 1 1 A 103 103 LYS CB C 103 33.300 35.191 -1.891 1
1 1158 . 13 1 1 A 103 103 LYS N N 103 124.000 126.145 -2.145 1
1 1159 . 13 1 1 A 104 104 LEU H H 104 8.180 8.732 -0.552 1
1 1160 . 13 1 1 A 104 104 LEU HA H 104 4.270 4.481 -0.211 1
1 1170 . 13 1 1 A 104 104 LEU C C 104 177.100 177.624 -0.524 1
1 1171 . 13 1 1 A 104 104 LEU CA C 104 55.500 55.085 0.415 1
1 1172 . 13 1 1 A 104 104 LEU CB C 104 42.500 41.685 0.815 1
1 1176 . 13 1 1 A 104 104 LEU N N 104 123.500 125.589 -2.089 1
1 1177 . 13 1 1 A 105 105 GLU H H 105 8.270 9.195 -0.925 1
1 1178 . 13 1 1 A 105 105 GLU CA C 105 56.700 60.248 -3.548 1
1 1179 . 13 1 1 A 105 105 GLU CB C 105 30.800 29.460 1.340 1
1 13 . 14 1 1 A 2 2 ASN HA H 2 4.980 5.139 -0.159 1
1 18 . 14 1 1 A 2 2 ASN C C 2 176.300 176.515 -0.215 1
1 19 . 14 1 1 A 2 2 ASN CA C 2 52.500 51.781 0.719 1
1 20 . 14 1 1 A 2 2 ASN CB C 2 40.900 41.347 -0.447 1
1 22 . 14 1 1 A 3 3 SER H H 3 9.940 9.596 0.344 1
1 23 . 14 1 1 A 3 3 SER HA H 3 3.720 4.172 -0.452 1
1 26 . 14 1 1 A 3 3 SER C C 3 175.900 176.833 -0.933 1
1 27 . 14 1 1 A 3 3 SER CA C 3 63.300 61.585 1.715 1
1 28 . 14 1 1 A 3 3 SER CB C 3 61.700 62.568 -0.868 1
1 29 . 14 1 1 A 3 3 SER N N 3 118.200 117.033 1.167 1
1 30 . 14 1 1 A 4 4 GLU H H 4 8.450 8.137 0.313 1
1 31 . 14 1 1 A 4 4 GLU HA H 4 4.010 4.025 -0.015 1
1 36 . 14 1 1 A 4 4 GLU C C 4 178.800 179.244 -0.444 1
1 37 . 14 1 1 A 4 4 GLU CA C 4 60.300 59.204 1.096 1
1 38 . 14 1 1 A 4 4 GLU CB C 4 29.100 29.617 -0.517 1
1 40 . 14 1 1 A 4 4 GLU N N 4 123.600 122.750 0.850 1
1 41 . 14 1 1 A 5 5 VAL H H 5 7.590 7.952 -0.362 1
1 42 . 14 1 1 A 5 5 VAL HA H 5 3.850 3.654 0.196 1
1 50 . 14 1 1 A 5 5 VAL C C 5 179.100 178.515 0.585 1
1 51 . 14 1 1 A 5 5 VAL CA C 5 65.800 66.388 -0.588 1
1 52 . 14 1 1 A 5 5 VAL CB C 5 32.300 31.547 0.753 1
1 55 . 14 1 1 A 5 5 VAL N N 5 119.300 119.156 0.144 1
1 56 . 14 1 1 A 6 6 ILE H H 6 7.240 8.050 -0.810 1
1 57 . 14 1 1 A 6 6 ILE HA H 6 3.580 3.631 -0.051 1
1 67 . 14 1 1 A 6 6 ILE C C 6 177.000 177.750 -0.750 1
1 68 . 14 1 1 A 6 6 ILE CA C 6 65.300 65.714 -0.414 1
1 69 . 14 1 1 A 6 6 ILE CB C 6 37.900 37.859 0.041 1
1 73 . 14 1 1 A 6 6 ILE N N 6 120.300 120.851 -0.551 1
1 74 . 14 1 1 A 7 7 LYS H H 7 8.050 8.096 -0.046 1
1 75 . 14 1 1 A 7 7 LYS HA H 7 3.570 3.466 0.104 1
1 84 . 14 1 1 A 7 7 LYS C C 7 178.700 179.028 -0.328 1
1 85 . 14 1 1 A 7 7 LYS CA C 7 61.300 60.360 0.940 1
1 86 . 14 1 1 A 7 7 LYS CB C 7 32.200 32.126 0.074 1
1 90 . 14 1 1 A 7 7 LYS N N 7 119.200 118.632 0.568 1
1 91 . 14 1 1 A 8 8 GLU H H 8 8.100 8.112 -0.012 1
1 92 . 14 1 1 A 8 8 GLU HA H 8 4.000 4.053 -0.053 1
1 97 . 14 1 1 A 8 8 GLU C C 8 178.500 179.097 -0.597 1
1 98 . 14 1 1 A 8 8 GLU CA C 8 59.700 59.578 0.122 1
1 99 . 14 1 1 A 8 8 GLU CB C 8 29.600 29.464 0.136 1
1 101 . 14 1 1 A 8 8 GLU N N 8 119.400 120.618 -1.218 1
1 102 . 14 1 1 A 9 9 PHE H H 9 7.720 8.037 -0.317 1
1 103 . 14 1 1 A 9 9 PHE HA H 9 4.160 4.090 0.070 1
1 109 . 14 1 1 A 9 9 PHE C C 9 176.900 176.961 -0.061 1
1 110 . 14 1 1 A 9 9 PHE CA C 9 61.300 61.426 -0.126 1
1 111 . 14 1 1 A 9 9 PHE CB C 9 39.400 39.218 0.182 1
1 115 . 14 1 1 A 9 9 PHE N N 9 121.300 120.020 1.280 1
1 116 . 14 1 1 A 10 10 LEU H H 10 8.060 8.725 -0.665 1
1 117 . 14 1 1 A 10 10 LEU HA H 10 3.660 3.731 -0.071 1
1 127 . 14 1 1 A 10 10 LEU C C 10 179.000 179.343 -0.343 1
1 128 . 14 1 1 A 10 10 LEU CA C 10 58.000 57.784 0.216 1
1 129 . 14 1 1 A 10 10 LEU CB C 10 41.400 41.039 0.361 1
1 133 . 14 1 1 A 10 10 LEU N N 10 118.000 119.051 -1.051 1
1 134 . 14 1 1 A 11 11 GLU H H 11 7.990 8.582 -0.592 1
1 135 . 14 1 1 A 11 11 GLU HA H 11 4.110 4.039 0.071 1
1 140 . 14 1 1 A 11 11 GLU C C 11 174.200 179.356 -5.156 1
1 141 . 14 1 1 A 11 11 GLU CA C 11 59.200 59.777 -0.577 1
1 142 . 14 1 1 A 11 11 GLU CB C 11 29.300 29.150 0.150 1
1 144 . 14 1 1 A 11 11 GLU N N 11 118.300 118.888 -0.588 1
1 145 . 14 1 1 A 12 12 ASP H H 12 8.080 8.179 -0.099 1
1 146 . 14 1 1 A 12 12 ASP HA H 12 4.340 4.392 -0.052 1
1 149 . 14 1 1 A 12 12 ASP C C 12 178.900 177.796 1.104 1
1 150 . 14 1 1 A 12 12 ASP CA C 12 57.600 57.013 0.587 1
1 151 . 14 1 1 A 12 12 ASP CB C 12 41.000 41.216 -0.216 1
1 152 . 14 1 1 A 12 12 ASP N N 12 121.800 119.836 1.964 1
1 153 . 14 1 1 A 13 13 ILE H H 13 7.610 7.613 -0.003 1
1 154 . 14 1 1 A 13 13 ILE HA H 13 4.240 3.984 0.256 1
1 164 . 14 1 1 A 13 13 ILE C C 13 176.800 176.890 -0.090 1
1 165 . 14 1 1 A 13 13 ILE CA C 13 62.100 61.168 0.932 1
1 166 . 14 1 1 A 13 13 ILE CB C 13 38.300 38.252 0.048 1
1 170 . 14 1 1 A 13 13 ILE N N 13 110.800 111.371 -0.571 1
1 171 . 14 1 1 A 14 14 GLY H H 14 7.640 8.058 -0.418 1
1 172 . 14 1 1 A 14 14 GLY HA2 H 14 3.810 3.942 -0.132 1
1 173 . 14 1 1 A 14 14 GLY HA3 H 14 3.880 3.955 -0.075 1
1 174 . 14 1 1 A 14 14 GLY C C 14 175.200 174.222 0.978 1
1 175 . 14 1 1 A 14 14 GLY CA C 14 46.900 46.413 0.487 1
1 176 . 14 1 1 A 14 14 GLY N N 14 111.800 112.862 -1.062 1
1 177 . 14 1 1 A 15 15 GLU H H 15 7.870 7.886 -0.016 1
1 178 . 14 1 1 A 15 15 GLU HA H 15 4.680 4.832 -0.152 1
1 183 . 14 1 1 A 15 15 GLU C C 15 175.100 174.363 0.737 1
1 184 . 14 1 1 A 15 15 GLU CA C 15 54.800 54.805 -0.005 1
1 185 . 14 1 1 A 15 15 GLU CB C 15 32.200 33.406 -1.206 1
1 187 . 14 1 1 A 15 15 GLU N N 15 119.200 119.868 -0.668 1
1 188 . 14 1 1 A 16 16 ASP H H 16 8.220 8.827 -0.607 1
1 189 . 14 1 1 A 16 16 ASP HA H 16 4.680 5.069 -0.389 1
1 192 . 14 1 1 A 16 16 ASP C C 16 174.600 175.020 -0.420 1
1 193 . 14 1 1 A 16 16 ASP CA C 16 53.600 52.964 0.636 1
1 194 . 14 1 1 A 16 16 ASP CB C 16 42.900 42.685 0.215 1
1 195 . 14 1 1 A 16 16 ASP N N 16 120.600 121.543 -0.943 1
1 196 . 14 1 1 A 17 17 TYR H H 17 7.540 8.935 -1.395 1
1 197 . 14 1 1 A 17 17 TYR HA H 17 4.910 5.815 -0.905 1
1 202 . 14 1 1 A 17 17 TYR C C 17 173.600 174.205 -0.605 1
1 203 . 14 1 1 A 17 17 TYR CA C 17 56.200 55.208 0.992 1
1 204 . 14 1 1 A 17 17 TYR CB C 17 41.100 41.765 -0.665 1
1 207 . 14 1 1 A 17 17 TYR N N 17 112.700 123.055 -10.355 1
1 208 . 14 1 1 A 18 18 ILE H H 18 7.950 9.137 -1.187 1
1 209 . 14 1 1 A 18 18 ILE HA H 18 4.330 4.606 -0.276 1
1 219 . 14 1 1 A 18 18 ILE C C 18 174.700 174.646 0.054 1
1 220 . 14 1 1 A 18 18 ILE CA C 18 60.300 60.762 -0.462 1
1 221 . 14 1 1 A 18 18 ILE CB C 18 41.000 37.567 3.433 1
1 225 . 14 1 1 A 18 18 ILE N N 18 120.400 122.448 -2.048 1
1 226 . 14 1 1 A 19 19 GLU H H 19 8.760 8.937 -0.177 1
1 227 . 14 1 1 A 19 19 GLU HA H 19 5.200 5.006 0.194 1
1 232 . 14 1 1 A 19 19 GLU C C 19 175.200 175.277 -0.077 1
1 233 . 14 1 1 A 19 19 GLU CA C 19 55.500 55.688 -0.188 1
1 234 . 14 1 1 A 19 19 GLU CB C 19 32.400 31.263 1.137 1
1 236 . 14 1 1 A 19 19 GLU N N 19 129.000 128.856 0.144 1
1 237 . 14 1 1 A 20 20 LEU H H 20 8.730 9.419 -0.689 1
1 238 . 14 1 1 A 20 20 LEU HA H 20 4.620 4.863 -0.243 1
1 248 . 14 1 1 A 20 20 LEU C C 20 176.200 176.061 0.139 1
1 249 . 14 1 1 A 20 20 LEU CA C 20 54.100 53.378 0.722 1
1 250 . 14 1 1 A 20 20 LEU CB C 20 44.400 44.200 0.200 1
1 254 . 14 1 1 A 20 20 LEU N N 20 128.400 127.010 1.390 1
1 255 . 14 1 1 A 21 21 GLU H H 21 8.700 8.695 0.005 1
1 256 . 14 1 1 A 21 21 GLU HA H 21 3.870 4.271 -0.401 1
1 261 . 14 1 1 A 21 21 GLU C C 21 176.100 176.811 -0.711 1
1 262 . 14 1 1 A 21 21 GLU CA C 21 58.800 56.486 2.314 1
1 263 . 14 1 1 A 21 21 GLU CB C 21 28.200 29.267 -1.067 1
1 265 . 14 1 1 A 21 21 GLU N N 21 122.600 119.821 2.779 1
1 266 . 14 1 1 A 22 22 ASN H H 22 8.640 8.959 -0.319 1
1 267 . 14 1 1 A 22 22 ASN HA H 22 4.540 4.344 0.196 1
1 272 . 14 1 1 A 22 22 ASN C C 22 173.800 173.806 -0.006 1
1 273 . 14 1 1 A 22 22 ASN CA C 22 54.600 54.724 -0.124 1
1 274 . 14 1 1 A 22 22 ASN CB C 22 38.400 37.097 1.303 1
1 275 . 14 1 1 A 22 22 ASN N N 22 118.000 120.249 -2.249 1
1 277 . 14 1 1 A 23 23 GLU H H 23 7.740 7.702 0.038 1
1 278 . 14 1 1 A 23 23 GLU HA H 23 5.430 4.876 0.554 1
1 283 . 14 1 1 A 23 23 GLU C C 23 175.400 175.234 0.166 1
1 284 . 14 1 1 A 23 23 GLU CA C 23 54.900 55.114 -0.214 1
1 285 . 14 1 1 A 23 23 GLU CB C 23 34.500 32.358 2.142 1
1 287 . 14 1 1 A 23 23 GLU N N 23 116.400 117.663 -1.263 1
1 288 . 14 1 1 A 24 24 ILE H H 24 9.050 8.838 0.212 1
1 289 . 14 1 1 A 24 24 ILE HA H 24 4.810 4.901 -0.091 1
1 299 . 14 1 1 A 24 24 ILE C C 24 174.600 175.009 -0.409 1
1 300 . 14 1 1 A 24 24 ILE CA C 24 60.700 60.341 0.359 1
1 301 . 14 1 1 A 24 24 ILE CB C 24 41.300 40.006 1.294 1
1 305 . 14 1 1 A 24 24 ILE N N 24 122.800 123.909 -1.109 1
1 306 . 14 1 1 A 25 25 HIS H H 25 9.490 9.620 -0.130 1
1 307 . 14 1 1 A 25 25 HIS HA H 25 5.090 5.631 -0.541 1
1 312 . 14 1 1 A 25 25 HIS C C 25 176.100 174.873 1.227 1
1 313 . 14 1 1 A 25 25 HIS CA C 25 56.100 54.699 1.401 1
1 314 . 14 1 1 A 25 25 HIS CB C 25 33.100 31.593 1.507 1
1 317 . 14 1 1 A 25 25 HIS N N 25 127.300 125.693 1.607 1
1 318 . 14 1 1 A 26 26 LEU H H 26 8.820 8.773 0.047 1
1 319 . 14 1 1 A 26 26 LEU HA H 26 5.160 5.037 0.123 1
1 329 . 14 1 1 A 26 26 LEU C C 26 178.000 175.898 2.102 1
1 330 . 14 1 1 A 26 26 LEU CA C 26 52.900 53.483 -0.583 1
1 331 . 14 1 1 A 26 26 LEU CB C 26 48.100 44.168 3.932 1
1 335 . 14 1 1 A 26 26 LEU N N 26 121.600 124.854 -3.254 1
1 336 . 14 1 1 A 27 27 LYS H H 27 8.990 8.774 0.216 1
1 337 . 14 1 1 A 27 27 LYS HA H 27 4.630 4.750 -0.120 1
1 345 . 14 1 1 A 27 27 LYS CA C 27 55.700 53.852 1.848 1
1 346 . 14 1 1 A 27 27 LYS CB C 27 31.900 32.646 -0.746 1
1 350 . 14 1 1 A 27 27 LYS N N 27 125.900 120.489 5.411 1
1 351 . 14 1 1 A 28 28 PRO HA H 28 4.500 4.459 0.041 1
1 358 . 14 1 1 A 28 28 PRO C C 28 177.900 179.164 -1.264 1
1 359 . 14 1 1 A 28 28 PRO CA C 28 67.400 65.973 1.427 1
1 360 . 14 1 1 A 28 28 PRO CB C 28 32.100 31.765 0.335 1
1 363 . 14 1 1 A 29 29 GLU H H 29 9.880 8.473 1.407 1
1 364 . 14 1 1 A 29 29 GLU HA H 29 4.140 4.222 -0.082 1
1 369 . 14 1 1 A 29 29 GLU C C 29 178.800 179.862 -1.062 1
1 370 . 14 1 1 A 29 29 GLU CA C 29 60.600 59.606 0.994 1
1 371 . 14 1 1 A 29 29 GLU CB C 29 29.200 29.390 -0.190 1
1 373 . 14 1 1 A 29 29 GLU N N 29 117.100 118.114 -1.014 1
1 374 . 14 1 1 A 30 30 VAL H H 30 7.050 8.328 -1.278 1
1 375 . 14 1 1 A 30 30 VAL HA H 30 3.850 3.769 0.081 1
1 383 . 14 1 1 A 30 30 VAL C C 30 177.700 178.541 -0.841 1
1 384 . 14 1 1 A 30 30 VAL CA C 30 65.600 66.836 -1.236 1
1 385 . 14 1 1 A 30 30 VAL CB C 30 32.100 31.681 0.419 1
1 388 . 14 1 1 A 30 30 VAL N N 30 120.900 121.623 -0.723 1
1 389 . 14 1 1 A 31 31 PHE H H 31 8.980 8.876 0.104 1
1 390 . 14 1 1 A 31 31 PHE HA H 31 3.870 4.308 -0.438 1
1 394 . 14 1 1 A 31 31 PHE C C 31 176.700 177.241 -0.541 1
1 395 . 14 1 1 A 31 31 PHE CA C 31 62.200 62.046 0.154 1
1 396 . 14 1 1 A 31 31 PHE CB C 31 39.300 39.095 0.205 1
1 398 . 14 1 1 A 31 31 PHE N N 31 121.100 120.307 0.793 1
1 399 . 14 1 1 A 32 32 TYR H H 32 8.640 8.515 0.125 1
1 400 . 14 1 1 A 32 32 TYR HA H 32 3.880 4.540 -0.660 1
1 405 . 14 1 1 A 32 32 TYR C C 32 176.000 177.697 -1.697 1
1 406 . 14 1 1 A 32 32 TYR CA C 32 63.300 62.046 1.254 1
1 407 . 14 1 1 A 32 32 TYR CB C 32 39.100 39.016 0.084 1
1 410 . 14 1 1 A 32 32 TYR N N 32 117.400 120.894 -3.494 1
1 411 . 14 1 1 A 33 33 GLU H H 33 7.400 8.213 -0.813 1
1 412 . 14 1 1 A 33 33 GLU HA H 33 4.050 4.086 -0.036 1
1 417 . 14 1 1 A 33 33 GLU C C 33 180.200 178.765 1.435 1
1 418 . 14 1 1 A 33 33 GLU CA C 33 59.500 59.008 0.492 1
1 419 . 14 1 1 A 33 33 GLU CB C 33 29.300 29.675 -0.375 1
1 421 . 14 1 1 A 33 33 GLU N N 33 116.100 119.439 -3.339 1
1 422 . 14 1 1 A 34 34 VAL H H 34 8.530 8.381 0.149 1
1 423 . 14 1 1 A 34 34 VAL HA H 34 3.350 3.472 -0.122 1
1 431 . 14 1 1 A 34 34 VAL C C 34 175.800 178.358 -2.558 1
1 432 . 14 1 1 A 34 34 VAL CA C 34 66.400 66.172 0.228 1
1 433 . 14 1 1 A 34 34 VAL CB C 34 32.200 31.538 0.662 1
1 436 . 14 1 1 A 34 34 VAL N N 34 120.600 119.675 0.925 1
1 437 . 14 1 1 A 35 35 TRP H H 35 9.100 8.182 0.918 1
1 438 . 14 1 1 A 35 35 TRP HA H 35 3.340 3.518 -0.178 1
1 447 . 14 1 1 A 35 35 TRP C C 35 178.000 178.277 -0.277 1
1 448 . 14 1 1 A 35 35 TRP CA C 35 61.800 60.725 1.075 1
1 449 . 14 1 1 A 35 35 TRP CB C 35 27.900 29.299 -1.399 1
1 455 . 14 1 1 A 35 35 TRP N N 35 121.700 121.673 0.027 1
1 457 . 14 1 1 A 36 36 LYS H H 36 7.970 7.655 0.315 1
1 458 . 14 1 1 A 36 36 LYS HA H 36 3.330 3.552 -0.222 1
1 467 . 14 1 1 A 36 36 LYS C C 36 180.000 178.156 1.844 1
1 468 . 14 1 1 A 36 36 LYS CA C 36 59.000 58.713 0.287 1
1 469 . 14 1 1 A 36 36 LYS CB C 36 31.800 32.073 -0.273 1
1 473 . 14 1 1 A 36 36 LYS N N 36 116.300 117.806 -1.506 1
1 474 . 14 1 1 A 37 37 TYR H H 37 7.750 7.983 -0.233 1
1 475 . 14 1 1 A 37 37 TYR HA H 37 3.940 3.900 0.040 1
1 480 . 14 1 1 A 37 37 TYR C C 37 177.600 177.678 -0.078 1
1 481 . 14 1 1 A 37 37 TYR CA C 37 61.200 61.033 0.167 1
1 482 . 14 1 1 A 37 37 TYR CB C 37 38.800 38.434 0.366 1
1 485 . 14 1 1 A 37 37 TYR N N 37 122.700 121.466 1.234 1
1 486 . 14 1 1 A 38 38 VAL H H 38 7.660 7.348 0.312 1
1 487 . 14 1 1 A 38 38 VAL HA H 38 3.870 3.853 0.017 1
1 495 . 14 1 1 A 38 38 VAL C C 38 175.600 175.992 -0.392 1
1 496 . 14 1 1 A 38 38 VAL CA C 38 61.100 61.478 -0.378 1
1 497 . 14 1 1 A 38 38 VAL CB C 38 30.700 31.453 -0.753 1
1 500 . 14 1 1 A 38 38 VAL N N 38 108.200 112.566 -4.366 1
1 501 . 14 1 1 A 39 39 GLY H H 39 7.090 7.376 -0.286 1
1 502 . 14 1 1 A 39 39 GLY HA2 H 39 3.320 3.726 -0.406 1
1 503 . 14 1 1 A 39 39 GLY HA3 H 39 3.730 3.764 -0.034 1
1 504 . 14 1 1 A 39 39 GLY C C 39 173.600 174.510 -0.910 1
1 505 . 14 1 1 A 39 39 GLY CA C 39 46.100 44.840 1.260 1
1 506 . 14 1 1 A 39 39 GLY N N 39 107.600 110.455 -2.855 1
1 507 . 14 1 1 A 40 40 GLU H H 40 7.730 8.094 -0.364 1
1 508 . 14 1 1 A 40 40 GLU HA H 40 1.090 2.822 -1.732 1
1 513 . 14 1 1 A 40 40 GLU CA C 40 55.700 56.342 -0.642 1
1 514 . 14 1 1 A 40 40 GLU CB C 40 27.200 27.447 -0.247 1
1 516 . 14 1 1 A 40 40 GLU N N 40 114.400 112.689 1.711 1
1 517 . 14 1 1 A 41 41 PRO HA H 41 4.310 4.553 -0.243 1
1 524 . 14 1 1 A 41 41 PRO CA C 41 62.300 62.425 -0.125 1
1 525 . 14 1 1 A 41 41 PRO CB C 41 32.700 32.700 0.000 1
1 528 . 14 1 1 A 42 42 GLU H H 42 8.110 8.646 -0.536 1
1 529 . 14 1 1 A 42 42 GLU C C 42 175.800 175.949 -0.149 1
1 530 . 14 1 1 A 42 42 GLU CA C 42 57.800 56.627 1.173 1
1 531 . 14 1 1 A 42 42 GLU CB C 42 30.600 29.968 0.632 1
1 533 . 14 1 1 A 42 42 GLU N N 42 119.100 121.800 -2.700 1
1 534 . 14 1 1 A 43 43 LEU H H 43 8.140 9.064 -0.924 1
1 535 . 14 1 1 A 43 43 LEU HA H 43 4.840 4.803 0.037 1
1 545 . 14 1 1 A 43 43 LEU C C 43 177.300 176.018 1.282 1
1 546 . 14 1 1 A 43 43 LEU CA C 43 53.700 54.175 -0.475 1
1 547 . 14 1 1 A 43 43 LEU CB C 43 43.900 41.361 2.539 1
1 551 . 14 1 1 A 43 43 LEU N N 43 124.700 128.300 -3.600 1
1 552 . 14 1 1 A 44 44 LYS H H 44 8.640 8.303 0.337 1
1 553 . 14 1 1 A 44 44 LYS HA H 44 4.500 4.370 0.130 1
1 562 . 14 1 1 A 44 44 LYS C C 44 174.500 175.990 -1.490 1
1 563 . 14 1 1 A 44 44 LYS CA C 44 54.700 56.080 -1.380 1
1 564 . 14 1 1 A 44 44 LYS CB C 44 36.200 33.064 3.136 1
1 568 . 14 1 1 A 44 44 LYS N N 44 123.300 124.379 -1.079 1
1 569 . 14 1 1 A 45 45 THR H H 45 7.990 8.719 -0.729 1
1 570 . 14 1 1 A 45 45 THR HA H 45 5.700 5.582 0.118 1
1 575 . 14 1 1 A 45 45 THR C C 45 175.100 173.895 1.205 1
1 576 . 14 1 1 A 45 45 THR CA C 45 59.600 59.424 0.176 1
1 577 . 14 1 1 A 45 45 THR CB C 45 73.400 71.428 1.972 1
1 579 . 14 1 1 A 45 45 THR N N 45 106.900 113.436 -6.536 1
1 580 . 14 1 1 A 46 46 TYR H H 46 8.470 9.075 -0.605 1
1 581 . 14 1 1 A 46 46 TYR HA H 46 4.930 5.847 -0.917 1
1 586 . 14 1 1 A 46 46 TYR C C 46 172.400 172.902 -0.502 1
1 587 . 14 1 1 A 46 46 TYR CA C 46 57.100 55.157 1.943 1
1 588 . 14 1 1 A 46 46 TYR CB C 46 40.200 42.227 -2.027 1
1 591 . 14 1 1 A 46 46 TYR N N 46 117.100 119.248 -2.148 1
1 592 . 14 1 1 A 47 47 VAL H H 47 8.430 9.016 -0.586 1
1 593 . 14 1 1 A 47 47 VAL HA H 47 4.890 4.495 0.395 1
1 601 . 14 1 1 A 47 47 VAL C C 47 175.800 174.199 1.601 1
1 602 . 14 1 1 A 47 47 VAL CA C 47 60.800 60.924 -0.124 1
1 603 . 14 1 1 A 47 47 VAL CB C 47 34.800 33.157 1.643 1
1 606 . 14 1 1 A 47 47 VAL N N 47 119.200 122.332 -3.132 1
1 607 . 14 1 1 A 48 48 ILE H H 48 8.680 8.692 -0.012 1
1 608 . 14 1 1 A 48 48 ILE HA H 48 4.560 4.836 -0.276 1
1 618 . 14 1 1 A 48 48 ILE C C 48 174.500 174.978 -0.478 1
1 619 . 14 1 1 A 48 48 ILE CA C 48 59.700 60.231 -0.531 1
1 620 . 14 1 1 A 48 48 ILE CB C 48 41.500 39.845 1.655 1
1 624 . 14 1 1 A 48 48 ILE N N 48 124.400 130.494 -6.094 1
1 625 . 14 1 1 A 49 49 GLU H H 49 8.320 8.893 -0.573 1
1 626 . 14 1 1 A 49 49 GLU C C 49 175.500 174.589 0.911 1
1 627 . 14 1 1 A 49 49 GLU CA C 49 55.500 55.622 -0.122 1
1 628 . 14 1 1 A 49 49 GLU CB C 49 31.800 30.791 1.009 1
1 630 . 14 1 1 A 49 49 GLU N N 49 123.400 130.582 -7.182 1
1 631 . 14 1 1 A 50 50 ASP H H 50 8.610 9.150 -0.540 1
1 632 . 14 1 1 A 50 50 ASP C C 50 175.100 175.138 -0.038 1
1 633 . 14 1 1 A 50 50 ASP CA C 50 53.100 53.796 -0.696 1
1 634 . 14 1 1 A 50 50 ASP CB C 50 44.000 42.060 1.940 1
1 635 . 14 1 1 A 50 50 ASP N N 50 124.300 127.764 -3.464 1
1 636 . 14 1 1 A 51 51 GLU H H 51 8.450 8.858 -0.408 1
1 637 . 14 1 1 A 51 51 GLU C C 51 175.900 174.763 1.137 1
1 638 . 14 1 1 A 51 51 GLU CA C 51 56.000 55.569 0.431 1
1 639 . 14 1 1 A 51 51 GLU CB C 51 31.700 29.838 1.862 1
1 640 . 14 1 1 A 51 51 GLU N N 51 121.300 123.521 -2.221 1
1 641 . 14 1 1 A 52 52 ILE H H 52 8.480 8.872 -0.392 1
1 642 . 14 1 1 A 52 52 ILE C C 52 175.400 174.060 1.340 1
1 643 . 14 1 1 A 52 52 ILE CA C 52 60.400 60.372 0.028 1
1 644 . 14 1 1 A 52 52 ILE CB C 52 40.000 39.215 0.785 1
1 645 . 14 1 1 A 52 52 ILE N N 52 122.700 126.640 -3.940 1
1 646 . 14 1 1 A 53 53 VAL H H 53 8.140 8.944 -0.804 1
1 647 . 14 1 1 A 53 53 VAL C C 53 175.600 175.478 0.122 1
1 648 . 14 1 1 A 53 53 VAL CA C 53 61.900 62.393 -0.493 1
1 649 . 14 1 1 A 53 53 VAL CB C 53 33.200 32.843 0.357 1
1 650 . 14 1 1 A 53 53 VAL N N 53 124.400 131.379 -6.979 1
1 651 . 14 1 1 A 54 54 GLU H H 54 8.540 8.641 -0.101 1
1 652 . 14 1 1 A 54 54 GLU CA C 54 55.600 53.190 2.410 1
1 653 . 14 1 1 A 54 54 GLU CB C 54 34.300 30.111 4.189 1
1 654 . 14 1 1 A 54 54 GLU N N 54 125.900 127.911 -2.011 1
1 655 . 14 1 1 A 55 55 PRO C C 55 177.500 176.815 0.685 1
1 656 . 14 1 1 A 55 55 PRO CA C 55 63.400 63.278 0.122 1
1 657 . 14 1 1 A 55 55 PRO CB C 55 32.300 31.997 0.303 1
1 658 . 14 1 1 A 56 56 GLY H H 56 8.420 8.597 -0.177 1
1 659 . 14 1 1 A 56 56 GLY HA2 H 56 3.830 4.172 -0.342 1
1 660 . 14 1 1 A 56 56 GLY HA3 H 56 4.000 4.190 -0.190 1
1 661 . 14 1 1 A 56 56 GLY C C 56 174.500 174.835 -0.335 1
1 662 . 14 1 1 A 56 56 GLY CA C 56 45.400 45.746 -0.346 1
1 663 . 14 1 1 A 56 56 GLY N N 56 109.700 108.754 0.946 1
1 664 . 14 1 1 A 57 57 GLU H H 57 8.180 7.862 0.318 1
1 665 . 14 1 1 A 57 57 GLU C C 57 176.300 176.809 -0.509 1
1 666 . 14 1 1 A 57 57 GLU CA C 57 57.500 56.541 0.959 1
1 667 . 14 1 1 A 57 57 GLU CB C 57 30.400 29.926 0.474 1
1 668 . 14 1 1 A 57 57 GLU N N 57 120.900 118.504 2.396 1
1 669 . 14 1 1 A 58 58 TYR H H 58 8.020 7.977 0.043 1
1 670 . 14 1 1 A 58 58 TYR C C 58 175.100 174.806 0.294 1
1 671 . 14 1 1 A 58 58 TYR CA C 58 57.400 59.556 -2.156 1
1 672 . 14 1 1 A 58 58 TYR CB C 58 38.900 39.186 -0.286 1
1 673 . 14 1 1 A 58 58 TYR N N 58 118.800 120.691 -1.891 1
1 674 . 14 1 1 A 59 59 ASP H H 59 7.950 7.668 0.282 1
1 675 . 14 1 1 A 59 59 ASP CA C 59 52.700 50.393 2.307 1
1 676 . 14 1 1 A 59 59 ASP CB C 59 41.000 44.286 -3.286 1
1 677 . 14 1 1 A 59 59 ASP N N 59 123.500 118.493 5.007 1
1 678 . 14 1 1 A 61 61 PRO HA H 61 4.510 4.557 -0.047 1
1 685 . 14 1 1 A 61 61 PRO C C 61 176.500 177.877 -1.377 1
1 686 . 14 1 1 A 61 61 PRO CA C 61 63.700 63.014 0.686 1
1 687 . 14 1 1 A 61 61 PRO CB C 61 34.200 31.905 2.295 1
1 690 . 14 1 1 A 62 62 GLU H H 62 8.490 8.994 -0.504 1
1 691 . 14 1 1 A 62 62 GLU N N 62 124.600 121.721 2.879 1
1 692 . 14 1 1 A 64 64 LYS C C 64 176.300 176.225 0.075 1
1 693 . 14 1 1 A 64 64 LYS CA C 64 57.000 59.474 -2.474 1
1 694 . 14 1 1 A 64 64 LYS CB C 64 33.100 32.151 0.949 1
1 695 . 14 1 1 A 65 65 TYR H H 65 7.960 7.936 0.024 1
1 696 . 14 1 1 A 65 65 TYR C C 65 176.000 174.978 1.022 1
1 697 . 14 1 1 A 65 65 TYR CA C 65 57.800 56.880 0.920 1
1 698 . 14 1 1 A 65 65 TYR CB C 65 38.800 39.148 -0.348 1
1 699 . 14 1 1 A 65 65 TYR N N 65 119.300 116.554 2.746 1
1 700 . 14 1 1 A 66 66 THR H H 66 7.820 9.175 -1.355 1
1 701 . 14 1 1 A 66 66 THR HA H 66 4.280 4.796 -0.516 1
1 706 . 14 1 1 A 66 66 THR C C 66 174.100 173.503 0.597 1
1 707 . 14 1 1 A 66 66 THR CA C 66 62.100 61.350 0.750 1
1 708 . 14 1 1 A 66 66 THR CB C 66 70.000 71.582 -1.582 1
1 710 . 14 1 1 A 66 66 THR N N 66 113.900 118.742 -4.842 1
1 711 . 14 1 1 A 67 67 ASN H H 67 8.270 8.793 -0.523 1
1 712 . 14 1 1 A 67 67 ASN C C 67 174.100 176.125 -2.025 1
1 713 . 14 1 1 A 67 67 ASN CA C 67 53.400 53.482 -0.082 1
1 714 . 14 1 1 A 67 67 ASN CB C 67 39.300 39.090 0.210 1
1 715 . 14 1 1 A 67 67 ASN N N 67 121.400 124.800 -3.400 1
1 716 . 14 1 1 A 68 68 VAL H H 68 7.660 8.500 -0.840 1
1 717 . 14 1 1 A 68 68 VAL C C 68 175.500 175.254 0.246 1
1 718 . 14 1 1 A 68 68 VAL CA C 68 61.800 60.583 1.217 1
1 719 . 14 1 1 A 68 68 VAL CB C 68 33.700 33.335 0.365 1
1 720 . 14 1 1 A 68 68 VAL N N 68 119.400 120.218 -0.818 1
1 721 . 14 1 1 A 69 69 LYS H H 69 8.690 8.408 0.282 1
1 722 . 14 1 1 A 69 69 LYS C C 69 175.200 175.236 -0.036 1
1 723 . 14 1 1 A 69 69 LYS CA C 69 55.200 55.609 -0.409 1
1 724 . 14 1 1 A 69 69 LYS CB C 69 35.200 33.026 2.174 1
1 725 . 14 1 1 A 69 69 LYS N N 69 126.500 121.270 5.230 1
1 726 . 14 1 1 A 70 70 LYS H H 70 8.230 8.883 -0.653 1
1 727 . 14 1 1 A 70 70 LYS C C 70 176.400 175.552 0.848 1
1 728 . 14 1 1 A 70 70 LYS CA C 70 55.600 55.709 -0.109 1
1 729 . 14 1 1 A 70 70 LYS CB C 70 33.800 32.621 1.179 1
1 730 . 14 1 1 A 70 70 LYS N N 70 122.700 124.614 -1.914 1
1 731 . 14 1 1 A 71 71 VAL H H 71 8.530 8.798 -0.268 1
1 732 . 14 1 1 A 71 71 VAL HA H 71 4.510 4.864 -0.354 1
1 733 . 14 1 1 A 71 71 VAL C C 71 174.700 174.992 -0.292 1
1 734 . 14 1 1 A 71 71 VAL CA C 71 60.900 60.838 0.062 1
1 735 . 14 1 1 A 71 71 VAL CB C 71 34.800 33.428 1.372 1
1 738 . 14 1 1 A 71 71 VAL N N 71 121.200 119.639 1.561 1
1 739 . 14 1 1 A 72 72 LYS H H 72 8.210 8.751 -0.541 1
1 740 . 14 1 1 A 72 72 LYS HA H 72 4.800 4.594 0.206 1
1 747 . 14 1 1 A 72 72 LYS C C 72 176.200 175.291 0.909 1
1 748 . 14 1 1 A 72 72 LYS CA C 72 55.700 55.812 -0.112 1
1 749 . 14 1 1 A 72 72 LYS CB C 72 33.700 32.585 1.115 1
1 752 . 14 1 1 A 72 72 LYS N N 72 123.600 124.818 -1.218 1
1 753 . 14 1 1 A 73 73 ILE H H 73 8.890 8.963 -0.073 1
1 754 . 14 1 1 A 73 73 ILE C C 73 174.400 174.448 -0.048 1
1 755 . 14 1 1 A 73 73 ILE CA C 73 60.400 60.057 0.343 1
1 756 . 14 1 1 A 73 73 ILE CB C 73 40.800 38.371 2.429 1
1 760 . 14 1 1 A 73 73 ILE N N 73 125.100 125.755 -0.655 1
1 761 . 14 1 1 A 74 74 LYS H H 74 8.420 8.620 -0.200 1
1 762 . 14 1 1 A 74 74 LYS HA H 74 4.800 4.541 0.259 1
1 771 . 14 1 1 A 74 74 LYS C C 74 175.600 175.419 0.181 1
1 772 . 14 1 1 A 74 74 LYS CA C 74 56.200 56.035 0.165 1
1 773 . 14 1 1 A 74 74 LYS CB C 74 34.300 33.049 1.251 1
1 777 . 14 1 1 A 74 74 LYS N N 74 126.400 128.616 -2.216 1
1 778 . 14 1 1 A 75 75 LYS H H 75 9.090 8.856 0.234 1
1 779 . 14 1 1 A 75 75 LYS HA H 75 4.800 4.935 -0.135 1
1 788 . 14 1 1 A 75 75 LYS C C 75 174.900 174.734 0.166 1
1 789 . 14 1 1 A 75 75 LYS CA C 75 53.200 54.324 -1.124 1
1 790 . 14 1 1 A 75 75 LYS CB C 75 34.200 35.783 -1.583 1
1 794 . 14 1 1 A 75 75 LYS N N 75 127.500 125.819 1.681 1
1 795 . 14 1 1 A 76 76 VAL H H 76 8.610 8.774 -0.164 1
1 796 . 14 1 1 A 76 76 VAL HA H 76 5.340 5.063 0.277 1
1 804 . 14 1 1 A 76 76 VAL C C 76 171.400 173.685 -2.285 1
1 805 . 14 1 1 A 76 76 VAL CA C 76 58.000 59.595 -1.595 1
1 806 . 14 1 1 A 76 76 VAL CB C 76 36.400 35.551 0.849 1
1 809 . 14 1 1 A 76 76 VAL N N 76 120.100 121.100 -1.000 1
1 810 . 14 1 1 A 77 77 TYR H H 77 9.110 8.964 0.146 1
1 811 . 14 1 1 A 77 77 TYR HA H 77 6.150 5.907 0.243 1
1 816 . 14 1 1 A 77 77 TYR C C 77 173.600 172.912 0.688 1
1 817 . 14 1 1 A 77 77 TYR CA C 77 56.200 55.832 0.368 1
1 818 . 14 1 1 A 77 77 TYR CB C 77 44.000 41.429 2.571 1
1 821 . 14 1 1 A 77 77 TYR N N 77 121.300 121.716 -0.416 1
1 822 . 14 1 1 A 78 78 PHE H H 78 8.190 8.653 -0.463 1
1 823 . 14 1 1 A 78 78 PHE HA H 78 5.130 5.830 -0.700 1
1 829 . 14 1 1 A 78 78 PHE C C 78 173.600 173.533 0.067 1
1 830 . 14 1 1 A 78 78 PHE CA C 78 55.900 55.302 0.598 1
1 831 . 14 1 1 A 78 78 PHE CB C 78 42.500 42.563 -0.063 1
1 835 . 14 1 1 A 78 78 PHE N N 78 112.700 117.642 -4.942 1
1 836 . 14 1 1 A 79 79 GLU H H 79 8.920 9.154 -0.234 1
1 837 . 14 1 1 A 79 79 GLU HA H 79 5.390 5.210 0.180 1
1 842 . 14 1 1 A 79 79 GLU C C 79 177.000 176.556 0.444 1
1 843 . 14 1 1 A 79 79 GLU CA C 79 54.900 54.928 -0.028 1
1 844 . 14 1 1 A 79 79 GLU CB C 79 33.600 32.647 0.953 1
1 846 . 14 1 1 A 79 79 GLU N N 79 120.500 119.720 0.780 1
1 847 . 14 1 1 A 80 80 THR H H 80 8.970 8.635 0.335 1
1 848 . 14 1 1 A 80 80 THR HA H 80 4.700 5.007 -0.307 1
1 854 . 14 1 1 A 80 80 THR C C 80 177.000 175.925 1.075 1
1 855 . 14 1 1 A 80 80 THR CA C 80 61.300 59.825 1.475 1
1 856 . 14 1 1 A 80 80 THR CB C 80 70.500 72.110 -1.610 1
1 858 . 14 1 1 A 80 80 THR N N 80 113.200 112.427 0.773 1
1 859 . 14 1 1 A 81 81 LEU H H 81 8.610 8.542 0.068 1
1 860 . 14 1 1 A 81 81 LEU HA H 81 4.230 4.170 0.060 1
1 870 . 14 1 1 A 81 81 LEU C C 81 177.400 178.913 -1.513 1
1 871 . 14 1 1 A 81 81 LEU CA C 81 57.700 58.160 -0.460 1
1 872 . 14 1 1 A 81 81 LEU CB C 81 42.400 41.604 0.796 1
1 876 . 14 1 1 A 81 81 LEU N N 81 120.900 123.634 -2.734 1
1 877 . 14 1 1 A 82 82 ASP H H 82 8.850 7.870 0.980 1
1 878 . 14 1 1 A 82 82 ASP HA H 82 4.670 4.737 -0.067 1
1 881 . 14 1 1 A 82 82 ASP C C 82 174.100 175.208 -1.108 1
1 882 . 14 1 1 A 82 82 ASP CA C 82 52.700 53.913 -1.213 1
1 883 . 14 1 1 A 82 82 ASP CB C 82 37.900 40.957 -3.057 1
1 884 . 14 1 1 A 82 82 ASP N N 82 112.300 117.077 -4.777 1
1 885 . 14 1 1 A 83 83 ASN H H 83 7.790 7.900 -0.110 1
1 886 . 14 1 1 A 83 83 ASN HA H 83 4.270 4.432 -0.162 1
1 891 . 14 1 1 A 83 83 ASN C C 83 176.100 174.674 1.426 1
1 892 . 14 1 1 A 83 83 ASN CA C 83 55.300 54.605 0.695 1
1 893 . 14 1 1 A 83 83 ASN CB C 83 36.900 37.183 -0.283 1
1 894 . 14 1 1 A 83 83 ASN N N 83 113.000 114.683 -1.683 1
1 896 . 14 1 1 A 84 84 VAL H H 84 7.660 7.410 0.250 1
1 897 . 14 1 1 A 84 84 VAL HA H 84 4.270 4.023 0.247 1
1 905 . 14 1 1 A 84 84 VAL C C 84 175.800 175.550 0.250 1
1 906 . 14 1 1 A 84 84 VAL CA C 84 61.500 62.846 -1.346 1
1 907 . 14 1 1 A 84 84 VAL CB C 84 33.500 31.828 1.672 1
1 910 . 14 1 1 A 84 84 VAL N N 84 119.700 120.086 -0.386 1
1 911 . 14 1 1 A 85 85 ARG H H 85 8.180 8.565 -0.385 1
1 912 . 14 1 1 A 85 85 ARG HA H 85 4.870 4.844 0.026 1
1 920 . 14 1 1 A 85 85 ARG C C 85 174.000 174.886 -0.886 1
1 921 . 14 1 1 A 85 85 ARG CA C 85 55.700 54.617 1.083 1
1 922 . 14 1 1 A 85 85 ARG CB C 85 32.600 32.485 0.115 1
1 925 . 14 1 1 A 85 85 ARG N N 85 124.800 127.428 -2.628 1
1 927 . 14 1 1 A 86 86 VAL H H 86 8.570 8.602 -0.032 1
1 928 . 14 1 1 A 86 86 VAL HA H 86 4.580 4.680 -0.100 1
1 936 . 14 1 1 A 86 86 VAL C C 86 175.700 175.303 0.397 1
1 937 . 14 1 1 A 86 86 VAL CA C 86 61.700 61.815 -0.115 1
1 938 . 14 1 1 A 86 86 VAL CB C 86 30.900 31.162 -0.262 1
1 941 . 14 1 1 A 86 86 VAL N N 86 127.300 124.069 3.231 1
1 942 . 14 1 1 A 87 87 VAL H H 87 8.790 9.077 -0.287 1
1 943 . 14 1 1 A 87 87 VAL HA H 87 5.010 4.813 0.197 1
1 951 . 14 1 1 A 87 87 VAL C C 87 175.500 174.901 0.599 1
1 952 . 14 1 1 A 87 87 VAL CA C 87 61.900 60.954 0.946 1
1 953 . 14 1 1 A 87 87 VAL CB C 87 36.300 33.137 3.163 1
1 956 . 14 1 1 A 87 87 VAL N N 87 125.700 129.109 -3.409 1
1 957 . 14 1 1 A 88 88 THR H H 88 8.350 8.701 -0.351 1
1 958 . 14 1 1 A 88 88 THR HA H 88 4.620 4.578 0.042 1
1 964 . 14 1 1 A 88 88 THR C C 88 173.300 172.447 0.853 1
1 965 . 14 1 1 A 88 88 THR CA C 88 61.700 60.610 1.090 1
1 966 . 14 1 1 A 88 88 THR CB C 88 70.400 71.915 -1.515 1
1 968 . 14 1 1 A 88 88 THR N N 88 117.500 120.822 -3.322 1
1 969 . 14 1 1 A 89 89 ASP H H 89 7.700 8.512 -0.812 1
1 970 . 14 1 1 A 89 89 ASP HA H 89 4.480 4.497 -0.017 1
1 973 . 14 1 1 A 89 89 ASP C C 89 175.900 177.128 -1.228 1
1 974 . 14 1 1 A 89 89 ASP CA C 89 55.900 54.772 1.128 1
1 975 . 14 1 1 A 89 89 ASP CB C 89 43.900 41.855 2.045 1
1 976 . 14 1 1 A 89 89 ASP N N 89 120.800 126.150 -5.350 1
1 977 . 14 1 1 A 90 90 TYR H H 90 8.240 8.980 -0.740 1
1 978 . 14 1 1 A 90 90 TYR HA H 90 3.920 4.154 -0.234 1
1 983 . 14 1 1 A 90 90 TYR C C 90 176.400 177.657 -1.257 1
1 984 . 14 1 1 A 90 90 TYR CA C 90 62.300 60.694 1.606 1
1 985 . 14 1 1 A 90 90 TYR CB C 90 39.500 39.173 0.327 1
1 988 . 14 1 1 A 90 90 TYR N N 90 126.100 128.416 -2.316 1
1 989 . 14 1 1 A 91 91 SER H H 91 9.160 8.084 1.076 1
1 990 . 14 1 1 A 91 91 SER HA H 91 4.000 4.143 -0.143 1
1 993 . 14 1 1 A 91 91 SER C C 91 178.000 176.902 1.098 1
1 994 . 14 1 1 A 91 91 SER CA C 91 62.600 61.756 0.844 1
1 995 . 14 1 1 A 91 91 SER CB C 91 62.200 62.857 -0.657 1
1 996 . 14 1 1 A 91 91 SER N N 91 116.600 116.091 0.509 1
1 997 . 14 1 1 A 92 92 GLU H H 92 8.590 8.577 0.013 1
1 998 . 14 1 1 A 92 92 GLU HA H 92 4.050 4.151 -0.101 1
1 1003 . 14 1 1 A 92 92 GLU C C 92 179.400 178.593 0.807 1
1 1004 . 14 1 1 A 92 92 GLU CA C 92 58.900 58.617 0.283 1
1 1005 . 14 1 1 A 92 92 GLU CB C 92 30.600 29.417 1.183 1
1 1007 . 14 1 1 A 92 92 GLU N N 92 120.200 121.536 -1.336 1
1 1008 . 14 1 1 A 93 93 PHE H H 93 7.870 7.951 -0.081 1
1 1009 . 14 1 1 A 93 93 PHE HA H 93 4.050 4.125 -0.075 1
1 1015 . 14 1 1 A 93 93 PHE C C 93 176.500 177.793 -1.293 1
1 1016 . 14 1 1 A 93 93 PHE CA C 93 62.200 61.081 1.119 1
1 1017 . 14 1 1 A 93 93 PHE CB C 93 39.700 39.090 0.610 1
1 1021 . 14 1 1 A 93 93 PHE N N 93 120.200 122.339 -2.139 1
1 1022 . 14 1 1 A 94 94 GLN H H 94 8.190 8.076 0.114 1
1 1023 . 14 1 1 A 94 94 GLN HA H 94 3.390 3.558 -0.168 1
1 1030 . 14 1 1 A 94 94 GLN C C 94 178.600 177.874 0.726 1
1 1031 . 14 1 1 A 94 94 GLN CA C 94 58.800 59.140 -0.340 1
1 1032 . 14 1 1 A 94 94 GLN CB C 94 28.400 27.951 0.449 1
1 1034 . 14 1 1 A 94 94 GLN N N 94 116.800 118.588 -1.788 1
1 1036 . 14 1 1 A 95 95 LYS H H 95 7.060 7.872 -0.812 1
1 1037 . 14 1 1 A 95 95 LYS HA H 95 3.780 4.015 -0.235 1
1 1046 . 14 1 1 A 95 95 LYS C C 95 179.300 179.174 0.126 1
1 1047 . 14 1 1 A 95 95 LYS CA C 95 59.900 59.091 0.809 1
1 1048 . 14 1 1 A 95 95 LYS CB C 95 32.700 32.063 0.637 1
1 1052 . 14 1 1 A 95 95 LYS N N 95 117.500 121.296 -3.796 1
1 1053 . 14 1 1 A 96 96 ILE H H 96 7.240 7.723 -0.483 1
1 1054 . 14 1 1 A 96 96 ILE HA H 96 3.420 3.532 -0.112 1
1 1064 . 14 1 1 A 96 96 ILE C C 96 177.800 178.135 -0.335 1
1 1065 . 14 1 1 A 96 96 ILE CA C 96 64.300 64.839 -0.539 1
1 1066 . 14 1 1 A 96 96 ILE CB C 96 37.400 37.131 0.269 1
1 1070 . 14 1 1 A 96 96 ILE N N 96 120.700 119.795 0.905 1
1 1071 . 14 1 1 A 97 97 LEU H H 97 7.690 7.788 -0.098 1
1 1072 . 14 1 1 A 97 97 LEU HA H 97 3.580 3.692 -0.112 1
1 1082 . 14 1 1 A 97 97 LEU C C 97 179.900 179.180 0.720 1
1 1083 . 14 1 1 A 97 97 LEU CA C 97 58.100 57.527 0.573 1
1 1084 . 14 1 1 A 97 97 LEU CB C 97 41.500 40.964 0.536 1
1 1088 . 14 1 1 A 97 97 LEU N N 97 120.000 120.488 -0.488 1
1 1089 . 14 1 1 A 98 98 LYS H H 98 7.510 8.007 -0.497 1
1 1090 . 14 1 1 A 98 98 LYS HA H 98 3.950 3.939 0.011 1
1 1099 . 14 1 1 A 98 98 LYS C C 98 178.700 179.166 -0.466 1
1 1100 . 14 1 1 A 98 98 LYS CA C 98 58.700 59.643 -0.943 1
1 1101 . 14 1 1 A 98 98 LYS CB C 98 32.500 32.217 0.283 1
1 1105 . 14 1 1 A 98 98 LYS N N 98 117.300 118.664 -1.364 1
1 1106 . 14 1 1 A 99 99 LYS H H 99 7.470 8.067 -0.597 1
1 1107 . 14 1 1 A 99 99 LYS HA H 99 4.080 3.944 0.136 1
1 1116 . 14 1 1 A 99 99 LYS C C 99 178.100 178.645 -0.545 1
1 1117 . 14 1 1 A 99 99 LYS CA C 99 58.400 59.588 -1.188 1
1 1118 . 14 1 1 A 99 99 LYS CB C 99 33.000 32.413 0.587 1
1 1122 . 14 1 1 A 99 99 LYS N N 99 119.000 120.884 -1.884 1
1 1123 . 14 1 1 A 100 100 ARG H H 100 8.020 8.094 -0.074 1
1 1124 . 14 1 1 A 100 100 ARG HA H 100 4.210 4.310 -0.100 1
1 1131 . 14 1 1 A 100 100 ARG C C 100 177.500 176.426 1.074 1
1 1132 . 14 1 1 A 100 100 ARG CA C 100 56.700 55.653 1.047 1
1 1133 . 14 1 1 A 100 100 ARG CB C 100 30.500 30.762 -0.262 1
1 1136 . 14 1 1 A 100 100 ARG N N 100 117.300 115.703 1.597 1
1 1137 . 14 1 1 A 101 101 GLY H H 101 7.910 7.609 0.301 1
1 1138 . 14 1 1 A 101 101 GLY HA2 H 101 3.980 3.956 0.024 1
1 1139 . 14 1 1 A 101 101 GLY HA3 H 101 4.020 3.964 0.056 1
1 1140 . 14 1 1 A 101 101 GLY C C 101 174.400 174.938 -0.538 1
1 1141 . 14 1 1 A 101 101 GLY CA C 101 46.000 46.248 -0.248 1
1 1142 . 14 1 1 A 101 101 GLY N N 101 108.000 107.838 0.162 1
1 1143 . 14 1 1 A 102 102 THR H H 102 7.880 7.962 -0.082 1
1 1144 . 14 1 1 A 102 102 THR HA H 102 4.360 4.194 0.166 1
1 1149 . 14 1 1 A 102 102 THR C C 102 174.400 175.144 -0.744 1
1 1150 . 14 1 1 A 102 102 THR CA C 102 62.100 65.543 -3.443 1
1 1151 . 14 1 1 A 102 102 THR CB C 102 70.500 69.113 1.387 1
1 1153 . 14 1 1 A 102 102 THR N N 102 113.900 111.977 1.923 1
1 1154 . 14 1 1 A 103 103 LYS H H 103 8.440 7.155 1.285 1
1 1155 . 14 1 1 A 103 103 LYS C C 103 176.400 174.925 1.475 1
1 1156 . 14 1 1 A 103 103 LYS CA C 103 56.600 55.115 1.485 1
1 1157 . 14 1 1 A 103 103 LYS CB C 103 33.300 33.110 0.190 1
1 1158 . 14 1 1 A 103 103 LYS N N 103 124.000 121.611 2.389 1
1 1159 . 14 1 1 A 104 104 LEU H H 104 8.180 8.726 -0.546 1
1 1160 . 14 1 1 A 104 104 LEU HA H 104 4.270 4.437 -0.167 1
1 1170 . 14 1 1 A 104 104 LEU C C 104 177.100 177.629 -0.529 1
1 1171 . 14 1 1 A 104 104 LEU CA C 104 55.500 54.857 0.643 1
1 1172 . 14 1 1 A 104 104 LEU CB C 104 42.500 42.163 0.337 1
1 1176 . 14 1 1 A 104 104 LEU N N 104 123.500 128.139 -4.639 1
1 1177 . 14 1 1 A 105 105 GLU H H 105 8.270 8.970 -0.700 1
1 1178 . 14 1 1 A 105 105 GLU CA C 105 56.700 57.367 -0.667 1
1 1179 . 14 1 1 A 105 105 GLU CB C 105 30.800 30.870 -0.070 1
1 13 . 15 1 1 A 2 2 ASN HA H 2 4.980 5.141 -0.161 1
1 18 . 15 1 1 A 2 2 ASN C C 2 176.300 176.607 -0.307 1
1 19 . 15 1 1 A 2 2 ASN CA C 2 52.500 51.658 0.842 1
1 20 . 15 1 1 A 2 2 ASN CB C 2 40.900 41.211 -0.311 1
1 22 . 15 1 1 A 3 3 SER H H 3 9.940 8.788 1.152 1
1 23 . 15 1 1 A 3 3 SER HA H 3 3.720 4.113 -0.393 1
1 26 . 15 1 1 A 3 3 SER C C 3 175.900 176.730 -0.830 1
1 27 . 15 1 1 A 3 3 SER CA C 3 63.300 61.730 1.570 1
1 28 . 15 1 1 A 3 3 SER CB C 3 61.700 62.312 -0.612 1
1 29 . 15 1 1 A 3 3 SER N N 3 118.200 116.218 1.982 1
1 30 . 15 1 1 A 4 4 GLU H H 4 8.450 8.098 0.352 1
1 31 . 15 1 1 A 4 4 GLU HA H 4 4.010 4.014 -0.004 1
1 36 . 15 1 1 A 4 4 GLU C C 4 178.800 178.981 -0.181 1
1 37 . 15 1 1 A 4 4 GLU CA C 4 60.300 59.456 0.844 1
1 38 . 15 1 1 A 4 4 GLU CB C 4 29.100 29.785 -0.685 1
1 40 . 15 1 1 A 4 4 GLU N N 4 123.600 122.208 1.392 1
1 41 . 15 1 1 A 5 5 VAL H H 5 7.590 7.973 -0.383 1
1 42 . 15 1 1 A 5 5 VAL HA H 5 3.850 3.707 0.143 1
1 50 . 15 1 1 A 5 5 VAL C C 5 179.100 178.425 0.675 1
1 51 . 15 1 1 A 5 5 VAL CA C 5 65.800 66.477 -0.677 1
1 52 . 15 1 1 A 5 5 VAL CB C 5 32.300 31.456 0.844 1
1 55 . 15 1 1 A 5 5 VAL N N 5 119.300 118.901 0.399 1
1 56 . 15 1 1 A 6 6 ILE H H 6 7.240 7.894 -0.654 1
1 57 . 15 1 1 A 6 6 ILE HA H 6 3.580 3.651 -0.071 1
1 67 . 15 1 1 A 6 6 ILE C C 6 177.000 177.760 -0.760 1
1 68 . 15 1 1 A 6 6 ILE CA C 6 65.300 65.215 0.085 1
1 69 . 15 1 1 A 6 6 ILE CB C 6 37.900 37.327 0.573 1
1 73 . 15 1 1 A 6 6 ILE N N 6 120.300 120.903 -0.603 1
1 74 . 15 1 1 A 7 7 LYS H H 7 8.050 8.215 -0.165 1
1 75 . 15 1 1 A 7 7 LYS HA H 7 3.570 3.641 -0.071 1
1 84 . 15 1 1 A 7 7 LYS C C 7 178.700 179.942 -1.242 1
1 85 . 15 1 1 A 7 7 LYS CA C 7 61.300 60.411 0.889 1
1 86 . 15 1 1 A 7 7 LYS CB C 7 32.200 32.156 0.044 1
1 90 . 15 1 1 A 7 7 LYS N N 7 119.200 119.278 -0.078 1
1 91 . 15 1 1 A 8 8 GLU H H 8 8.100 7.985 0.115 1
1 92 . 15 1 1 A 8 8 GLU HA H 8 4.000 4.064 -0.064 1
1 97 . 15 1 1 A 8 8 GLU C C 8 178.500 179.100 -0.600 1
1 98 . 15 1 1 A 8 8 GLU CA C 8 59.700 58.968 0.732 1
1 99 . 15 1 1 A 8 8 GLU CB C 8 29.600 30.361 -0.761 1
1 101 . 15 1 1 A 8 8 GLU N N 8 119.400 120.018 -0.618 1
1 102 . 15 1 1 A 9 9 PHE H H 9 7.720 8.136 -0.416 1
1 103 . 15 1 1 A 9 9 PHE HA H 9 4.160 4.164 -0.004 1
1 109 . 15 1 1 A 9 9 PHE C C 9 176.900 176.917 -0.017 1
1 110 . 15 1 1 A 9 9 PHE CA C 9 61.300 61.317 -0.017 1
1 111 . 15 1 1 A 9 9 PHE CB C 9 39.400 38.942 0.458 1
1 115 . 15 1 1 A 9 9 PHE N N 9 121.300 121.748 -0.448 1
1 116 . 15 1 1 A 10 10 LEU H H 10 8.060 8.949 -0.889 1
1 117 . 15 1 1 A 10 10 LEU HA H 10 3.660 3.803 -0.143 1
1 127 . 15 1 1 A 10 10 LEU C C 10 179.000 179.488 -0.488 1
1 128 . 15 1 1 A 10 10 LEU CA C 10 58.000 57.936 0.064 1
1 129 . 15 1 1 A 10 10 LEU CB C 10 41.400 41.276 0.124 1
1 133 . 15 1 1 A 10 10 LEU N N 10 118.000 119.221 -1.221 1
1 134 . 15 1 1 A 11 11 GLU H H 11 7.990 8.522 -0.532 1
1 135 . 15 1 1 A 11 11 GLU HA H 11 4.110 4.002 0.108 1
1 140 . 15 1 1 A 11 11 GLU C C 11 174.200 178.002 -3.802 1
1 141 . 15 1 1 A 11 11 GLU CA C 11 59.200 59.380 -0.180 1
1 142 . 15 1 1 A 11 11 GLU CB C 11 29.300 29.263 0.037 1
1 144 . 15 1 1 A 11 11 GLU N N 11 118.300 121.204 -2.904 1
1 145 . 15 1 1 A 12 12 ASP H H 12 8.080 8.133 -0.053 1
1 146 . 15 1 1 A 12 12 ASP HA H 12 4.340 4.348 -0.008 1
1 149 . 15 1 1 A 12 12 ASP C C 12 178.900 177.881 1.019 1
1 150 . 15 1 1 A 12 12 ASP CA C 12 57.600 56.769 0.831 1
1 151 . 15 1 1 A 12 12 ASP CB C 12 41.000 41.044 -0.044 1
1 152 . 15 1 1 A 12 12 ASP N N 12 121.800 120.472 1.328 1
1 153 . 15 1 1 A 13 13 ILE H H 13 7.610 7.500 0.110 1
1 154 . 15 1 1 A 13 13 ILE HA H 13 4.240 4.039 0.201 1
1 164 . 15 1 1 A 13 13 ILE C C 13 176.800 176.593 0.207 1
1 165 . 15 1 1 A 13 13 ILE CA C 13 62.100 60.718 1.382 1
1 166 . 15 1 1 A 13 13 ILE CB C 13 38.300 37.733 0.567 1
1 170 . 15 1 1 A 13 13 ILE N N 13 110.800 111.224 -0.424 1
1 171 . 15 1 1 A 14 14 GLY H H 14 7.640 7.563 0.077 1
1 172 . 15 1 1 A 14 14 GLY HA2 H 14 3.810 3.904 -0.094 1
1 173 . 15 1 1 A 14 14 GLY HA3 H 14 3.880 3.918 -0.038 1
1 174 . 15 1 1 A 14 14 GLY C C 14 175.200 174.268 0.932 1
1 175 . 15 1 1 A 14 14 GLY CA C 14 46.900 46.517 0.383 1
1 176 . 15 1 1 A 14 14 GLY N N 14 111.800 111.758 0.042 1
1 177 . 15 1 1 A 15 15 GLU H H 15 7.870 7.784 0.086 1
1 178 . 15 1 1 A 15 15 GLU HA H 15 4.680 4.751 -0.071 1
1 183 . 15 1 1 A 15 15 GLU C C 15 175.100 175.025 0.075 1
1 184 . 15 1 1 A 15 15 GLU CA C 15 54.800 54.736 0.064 1
1 185 . 15 1 1 A 15 15 GLU CB C 15 32.200 32.570 -0.370 1
1 187 . 15 1 1 A 15 15 GLU N N 15 119.200 119.654 -0.454 1
1 188 . 15 1 1 A 16 16 ASP H H 16 8.220 8.724 -0.504 1
1 189 . 15 1 1 A 16 16 ASP HA H 16 4.680 5.159 -0.479 1
1 192 . 15 1 1 A 16 16 ASP C C 16 174.600 175.532 -0.932 1
1 193 . 15 1 1 A 16 16 ASP CA C 16 53.600 53.787 -0.187 1
1 194 . 15 1 1 A 16 16 ASP CB C 16 42.900 42.354 0.546 1
1 195 . 15 1 1 A 16 16 ASP N N 16 120.600 126.092 -5.492 1
1 196 . 15 1 1 A 17 17 TYR H H 17 7.540 8.866 -1.326 1
1 197 . 15 1 1 A 17 17 TYR HA H 17 4.910 5.654 -0.744 1
1 202 . 15 1 1 A 17 17 TYR C C 17 173.600 173.076 0.524 1
1 203 . 15 1 1 A 17 17 TYR CA C 17 56.200 55.418 0.782 1
1 204 . 15 1 1 A 17 17 TYR CB C 17 41.100 42.106 -1.006 1
1 207 . 15 1 1 A 17 17 TYR N N 17 112.700 120.980 -8.280 1
1 208 . 15 1 1 A 18 18 ILE H H 18 7.950 8.867 -0.917 1
1 209 . 15 1 1 A 18 18 ILE HA H 18 4.330 4.511 -0.181 1
1 219 . 15 1 1 A 18 18 ILE C C 18 174.700 174.720 -0.020 1
1 220 . 15 1 1 A 18 18 ILE CA C 18 60.300 60.994 -0.694 1
1 221 . 15 1 1 A 18 18 ILE CB C 18 41.000 37.370 3.630 1
1 225 . 15 1 1 A 18 18 ILE N N 18 120.400 122.900 -2.500 1
1 226 . 15 1 1 A 19 19 GLU H H 19 8.760 8.888 -0.128 1
1 227 . 15 1 1 A 19 19 GLU HA H 19 5.200 4.985 0.215 1
1 232 . 15 1 1 A 19 19 GLU C C 19 175.200 175.291 -0.091 1
1 233 . 15 1 1 A 19 19 GLU CA C 19 55.500 55.718 -0.218 1
1 234 . 15 1 1 A 19 19 GLU CB C 19 32.400 31.259 1.141 1
1 236 . 15 1 1 A 19 19 GLU N N 19 129.000 128.566 0.434 1
1 237 . 15 1 1 A 20 20 LEU H H 20 8.730 9.325 -0.595 1
1 238 . 15 1 1 A 20 20 LEU HA H 20 4.620 4.869 -0.249 1
1 248 . 15 1 1 A 20 20 LEU C C 20 176.200 176.447 -0.247 1
1 249 . 15 1 1 A 20 20 LEU CA C 20 54.100 53.337 0.763 1
1 250 . 15 1 1 A 20 20 LEU CB C 20 44.400 43.302 1.098 1
1 254 . 15 1 1 A 20 20 LEU N N 20 128.400 127.692 0.708 1
1 255 . 15 1 1 A 21 21 GLU H H 21 8.700 8.682 0.018 1
1 256 . 15 1 1 A 21 21 GLU HA H 21 3.870 3.936 -0.066 1
1 261 . 15 1 1 A 21 21 GLU C C 21 176.100 176.913 -0.813 1
1 262 . 15 1 1 A 21 21 GLU CA C 21 58.800 57.550 1.250 1
1 263 . 15 1 1 A 21 21 GLU CB C 21 28.200 29.281 -1.081 1
1 265 . 15 1 1 A 21 21 GLU N N 21 122.600 120.296 2.304 1
1 266 . 15 1 1 A 22 22 ASN H H 22 8.640 9.001 -0.361 1
1 267 . 15 1 1 A 22 22 ASN HA H 22 4.540 4.306 0.234 1
1 272 . 15 1 1 A 22 22 ASN C C 22 173.800 173.896 -0.096 1
1 273 . 15 1 1 A 22 22 ASN CA C 22 54.600 54.642 -0.042 1
1 274 . 15 1 1 A 22 22 ASN CB C 22 38.400 36.932 1.468 1
1 275 . 15 1 1 A 22 22 ASN N N 22 118.000 120.537 -2.537 1
1 277 . 15 1 1 A 23 23 GLU H H 23 7.740 7.753 -0.013 1
1 278 . 15 1 1 A 23 23 GLU HA H 23 5.430 5.015 0.415 1
1 283 . 15 1 1 A 23 23 GLU C C 23 175.400 175.246 0.154 1
1 284 . 15 1 1 A 23 23 GLU CA C 23 54.900 54.796 0.104 1
1 285 . 15 1 1 A 23 23 GLU CB C 23 34.500 31.803 2.697 1
1 287 . 15 1 1 A 23 23 GLU N N 23 116.400 117.488 -1.088 1
1 288 . 15 1 1 A 24 24 ILE H H 24 9.050 9.230 -0.180 1
1 289 . 15 1 1 A 24 24 ILE HA H 24 4.810 4.677 0.133 1
1 299 . 15 1 1 A 24 24 ILE C C 24 174.600 174.968 -0.368 1
1 300 . 15 1 1 A 24 24 ILE CA C 24 60.700 60.397 0.303 1
1 301 . 15 1 1 A 24 24 ILE CB C 24 41.300 38.188 3.112 1
1 305 . 15 1 1 A 24 24 ILE N N 24 122.800 126.006 -3.206 1
1 306 . 15 1 1 A 25 25 HIS H H 25 9.490 9.471 0.019 1
1 307 . 15 1 1 A 25 25 HIS HA H 25 5.090 5.366 -0.276 1
1 312 . 15 1 1 A 25 25 HIS C C 25 176.100 174.533 1.567 1
1 313 . 15 1 1 A 25 25 HIS CA C 25 56.100 55.489 0.611 1
1 314 . 15 1 1 A 25 25 HIS CB C 25 33.100 30.266 2.834 1
1 317 . 15 1 1 A 25 25 HIS N N 25 127.300 126.735 0.565 1
1 318 . 15 1 1 A 26 26 LEU H H 26 8.820 8.778 0.042 1
1 319 . 15 1 1 A 26 26 LEU HA H 26 5.160 5.012 0.148 1
1 329 . 15 1 1 A 26 26 LEU C C 26 178.000 176.373 1.627 1
1 330 . 15 1 1 A 26 26 LEU CA C 26 52.900 53.227 -0.327 1
1 331 . 15 1 1 A 26 26 LEU CB C 26 48.100 43.470 4.630 1
1 335 . 15 1 1 A 26 26 LEU N N 26 121.600 125.659 -4.059 1
1 336 . 15 1 1 A 27 27 LYS H H 27 8.990 8.873 0.117 1
1 337 . 15 1 1 A 27 27 LYS HA H 27 4.630 4.573 0.057 1
1 345 . 15 1 1 A 27 27 LYS CA C 27 55.700 54.285 1.415 1
1 346 . 15 1 1 A 27 27 LYS CB C 27 31.900 32.228 -0.328 1
1 350 . 15 1 1 A 27 27 LYS N N 27 125.900 120.671 5.229 1
1 351 . 15 1 1 A 28 28 PRO HA H 28 4.500 4.439 0.061 1
1 358 . 15 1 1 A 28 28 PRO C C 28 177.900 178.189 -0.289 1
1 359 . 15 1 1 A 28 28 PRO CA C 28 67.400 66.025 1.375 1
1 360 . 15 1 1 A 28 28 PRO CB C 28 32.100 31.791 0.309 1
1 363 . 15 1 1 A 29 29 GLU H H 29 9.880 8.355 1.525 1
1 364 . 15 1 1 A 29 29 GLU HA H 29 4.140 4.306 -0.166 1
1 369 . 15 1 1 A 29 29 GLU C C 29 178.800 179.369 -0.569 1
1 370 . 15 1 1 A 29 29 GLU CA C 29 60.600 59.847 0.753 1
1 371 . 15 1 1 A 29 29 GLU CB C 29 29.200 29.407 -0.207 1
1 373 . 15 1 1 A 29 29 GLU N N 29 117.100 118.351 -1.251 1
1 374 . 15 1 1 A 30 30 VAL H H 30 7.050 7.634 -0.584 1
1 375 . 15 1 1 A 30 30 VAL HA H 30 3.850 3.737 0.113 1
1 383 . 15 1 1 A 30 30 VAL C C 30 177.700 178.354 -0.654 1
1 384 . 15 1 1 A 30 30 VAL CA C 30 65.600 66.511 -0.911 1
1 385 . 15 1 1 A 30 30 VAL CB C 30 32.100 31.750 0.350 1
1 388 . 15 1 1 A 30 30 VAL N N 30 120.900 120.188 0.712 1
1 389 . 15 1 1 A 31 31 PHE H H 31 8.980 8.817 0.163 1
1 390 . 15 1 1 A 31 31 PHE HA H 31 3.870 4.296 -0.426 1
1 394 . 15 1 1 A 31 31 PHE C C 31 176.700 177.261 -0.561 1
1 395 . 15 1 1 A 31 31 PHE CA C 31 62.200 62.077 0.123 1
1 396 . 15 1 1 A 31 31 PHE CB C 31 39.300 39.191 0.109 1
1 398 . 15 1 1 A 31 31 PHE N N 31 121.100 120.536 0.564 1
1 399 . 15 1 1 A 32 32 TYR H H 32 8.640 8.382 0.258 1
1 400 . 15 1 1 A 32 32 TYR HA H 32 3.880 4.514 -0.634 1
1 405 . 15 1 1 A 32 32 TYR C C 32 176.000 178.226 -2.226 1
1 406 . 15 1 1 A 32 32 TYR CA C 32 63.300 61.915 1.385 1
1 407 . 15 1 1 A 32 32 TYR CB C 32 39.100 38.899 0.201 1
1 410 . 15 1 1 A 32 32 TYR N N 32 117.400 120.871 -3.471 1
1 411 . 15 1 1 A 33 33 GLU H H 33 7.400 8.069 -0.669 1
1 412 . 15 1 1 A 33 33 GLU HA H 33 4.050 3.878 0.172 1
1 417 . 15 1 1 A 33 33 GLU C C 33 180.200 179.643 0.557 1
1 418 . 15 1 1 A 33 33 GLU CA C 33 59.500 58.922 0.578 1
1 419 . 15 1 1 A 33 33 GLU CB C 33 29.300 29.175 0.125 1
1 421 . 15 1 1 A 33 33 GLU N N 33 116.100 118.494 -2.394 1
1 422 . 15 1 1 A 34 34 VAL H H 34 8.530 7.433 1.097 1
1 423 . 15 1 1 A 34 34 VAL HA H 34 3.350 3.477 -0.127 1
1 431 . 15 1 1 A 34 34 VAL C C 34 175.800 178.015 -2.215 1
1 432 . 15 1 1 A 34 34 VAL CA C 34 66.400 65.881 0.519 1
1 433 . 15 1 1 A 34 34 VAL CB C 34 32.200 31.807 0.393 1
1 436 . 15 1 1 A 34 34 VAL N N 34 120.600 120.385 0.215 1
1 437 . 15 1 1 A 35 35 TRP H H 35 9.100 8.148 0.952 1
1 438 . 15 1 1 A 35 35 TRP HA H 35 3.340 3.582 -0.242 1
1 447 . 15 1 1 A 35 35 TRP C C 35 178.000 177.576 0.424 1
1 448 . 15 1 1 A 35 35 TRP CA C 35 61.800 60.549 1.251 1
1 449 . 15 1 1 A 35 35 TRP CB C 35 27.900 29.308 -1.408 1
1 455 . 15 1 1 A 35 35 TRP N N 35 121.700 121.640 0.060 1
1 457 . 15 1 1 A 36 36 LYS H H 36 7.970 7.728 0.242 1
1 458 . 15 1 1 A 36 36 LYS HA H 36 3.330 3.704 -0.374 1
1 467 . 15 1 1 A 36 36 LYS C C 36 180.000 177.688 2.312 1
1 468 . 15 1 1 A 36 36 LYS CA C 36 59.000 57.075 1.925 1
1 469 . 15 1 1 A 36 36 LYS CB C 36 31.800 31.623 0.177 1
1 473 . 15 1 1 A 36 36 LYS N N 36 116.300 118.471 -2.171 1
1 474 . 15 1 1 A 37 37 TYR H H 37 7.750 7.793 -0.043 1
1 475 . 15 1 1 A 37 37 TYR HA H 37 3.940 4.012 -0.072 1
1 480 . 15 1 1 A 37 37 TYR C C 37 177.600 177.543 0.057 1
1 481 . 15 1 1 A 37 37 TYR CA C 37 61.200 60.667 0.533 1
1 482 . 15 1 1 A 37 37 TYR CB C 37 38.800 38.136 0.664 1
1 485 . 15 1 1 A 37 37 TYR N N 37 122.700 121.871 0.829 1
1 486 . 15 1 1 A 38 38 VAL H H 38 7.660 7.105 0.555 1
1 487 . 15 1 1 A 38 38 VAL HA H 38 3.870 3.971 -0.101 1
1 495 . 15 1 1 A 38 38 VAL C C 38 175.600 175.822 -0.222 1
1 496 . 15 1 1 A 38 38 VAL CA C 38 61.100 61.462 -0.362 1
1 497 . 15 1 1 A 38 38 VAL CB C 38 30.700 31.331 -0.631 1
1 500 . 15 1 1 A 38 38 VAL N N 38 108.200 112.774 -4.574 1
1 501 . 15 1 1 A 39 39 GLY H H 39 7.090 7.670 -0.580 1
1 502 . 15 1 1 A 39 39 GLY HA2 H 39 3.320 3.726 -0.406 1
1 503 . 15 1 1 A 39 39 GLY HA3 H 39 3.730 3.757 -0.027 1
1 504 . 15 1 1 A 39 39 GLY C C 39 173.600 174.377 -0.777 1
1 505 . 15 1 1 A 39 39 GLY CA C 39 46.100 45.161 0.939 1
1 506 . 15 1 1 A 39 39 GLY N N 39 107.600 110.539 -2.939 1
1 507 . 15 1 1 A 40 40 GLU H H 40 7.730 7.866 -0.136 1
1 508 . 15 1 1 A 40 40 GLU HA H 40 1.090 3.041 -1.951 1
1 513 . 15 1 1 A 40 40 GLU CA C 40 55.700 56.651 -0.951 1
1 514 . 15 1 1 A 40 40 GLU CB C 40 27.200 27.583 -0.383 1
1 516 . 15 1 1 A 40 40 GLU N N 40 114.400 118.792 -4.392 1
1 517 . 15 1 1 A 41 41 PRO HA H 41 4.310 4.576 -0.266 1
1 524 . 15 1 1 A 41 41 PRO CA C 41 62.300 62.482 -0.182 1
1 525 . 15 1 1 A 41 41 PRO CB C 41 32.700 32.488 0.212 1
1 528 . 15 1 1 A 42 42 GLU H H 42 8.110 8.592 -0.482 1
1 529 . 15 1 1 A 42 42 GLU C C 42 175.800 176.465 -0.665 1
1 530 . 15 1 1 A 42 42 GLU CA C 42 57.800 56.442 1.358 1
1 531 . 15 1 1 A 42 42 GLU CB C 42 30.600 30.336 0.264 1
1 533 . 15 1 1 A 42 42 GLU N N 42 119.100 121.367 -2.267 1
1 534 . 15 1 1 A 43 43 LEU H H 43 8.140 8.786 -0.646 1
1 535 . 15 1 1 A 43 43 LEU HA H 43 4.840 4.689 0.151 1
1 545 . 15 1 1 A 43 43 LEU C C 43 177.300 176.729 0.571 1
1 546 . 15 1 1 A 43 43 LEU CA C 43 53.700 53.877 -0.177 1
1 547 . 15 1 1 A 43 43 LEU CB C 43 43.900 42.876 1.024 1
1 551 . 15 1 1 A 43 43 LEU N N 43 124.700 127.712 -3.012 1
1 552 . 15 1 1 A 44 44 LYS H H 44 8.640 8.083 0.557 1
1 553 . 15 1 1 A 44 44 LYS HA H 44 4.500 4.607 -0.107 1
1 562 . 15 1 1 A 44 44 LYS C C 44 174.500 176.063 -1.563 1
1 563 . 15 1 1 A 44 44 LYS CA C 44 54.700 54.433 0.267 1
1 564 . 15 1 1 A 44 44 LYS CB C 44 36.200 33.769 2.431 1
1 568 . 15 1 1 A 44 44 LYS N N 44 123.300 121.166 2.134 1
1 569 . 15 1 1 A 45 45 THR H H 45 7.990 8.726 -0.736 1
1 570 . 15 1 1 A 45 45 THR HA H 45 5.700 5.391 0.309 1
1 575 . 15 1 1 A 45 45 THR C C 45 175.100 172.708 2.392 1
1 576 . 15 1 1 A 45 45 THR CA C 45 59.600 59.216 0.384 1
1 577 . 15 1 1 A 45 45 THR CB C 45 73.400 71.730 1.670 1
1 579 . 15 1 1 A 45 45 THR N N 45 106.900 111.750 -4.850 1
1 580 . 15 1 1 A 46 46 TYR H H 46 8.470 9.606 -1.136 1
1 581 . 15 1 1 A 46 46 TYR HA H 46 4.930 5.519 -0.589 1
1 586 . 15 1 1 A 46 46 TYR C C 46 172.400 173.925 -1.525 1
1 587 . 15 1 1 A 46 46 TYR CA C 46 57.100 55.702 1.398 1
1 588 . 15 1 1 A 46 46 TYR CB C 46 40.200 41.424 -1.224 1
1 591 . 15 1 1 A 46 46 TYR N N 46 117.100 125.375 -8.275 1
1 592 . 15 1 1 A 47 47 VAL H H 47 8.430 8.884 -0.454 1
1 593 . 15 1 1 A 47 47 VAL HA H 47 4.890 4.876 0.014 1
1 601 . 15 1 1 A 47 47 VAL C C 47 175.800 175.489 0.311 1
1 602 . 15 1 1 A 47 47 VAL CA C 47 60.800 61.993 -1.193 1
1 603 . 15 1 1 A 47 47 VAL CB C 47 34.800 32.957 1.843 1
1 606 . 15 1 1 A 47 47 VAL N N 47 119.200 128.200 -9.000 1
1 607 . 15 1 1 A 48 48 ILE H H 48 8.680 9.092 -0.412 1
1 608 . 15 1 1 A 48 48 ILE HA H 48 4.560 4.893 -0.333 1
1 618 . 15 1 1 A 48 48 ILE C C 48 174.500 174.360 0.140 1
1 619 . 15 1 1 A 48 48 ILE CA C 48 59.700 59.208 0.492 1
1 620 . 15 1 1 A 48 48 ILE CB C 48 41.500 39.962 1.538 1
1 624 . 15 1 1 A 48 48 ILE N N 48 124.400 124.048 0.352 1
1 625 . 15 1 1 A 49 49 GLU H H 49 8.320 8.872 -0.552 1
1 626 . 15 1 1 A 49 49 GLU C C 49 175.500 174.850 0.650 1
1 627 . 15 1 1 A 49 49 GLU CA C 49 55.500 54.873 0.627 1
1 628 . 15 1 1 A 49 49 GLU CB C 49 31.800 31.339 0.461 1
1 630 . 15 1 1 A 49 49 GLU N N 49 123.400 124.800 -1.400 1
1 631 . 15 1 1 A 50 50 ASP H H 50 8.610 8.215 0.395 1
1 632 . 15 1 1 A 50 50 ASP C C 50 175.100 174.634 0.466 1
1 633 . 15 1 1 A 50 50 ASP CA C 50 53.100 53.881 -0.781 1
1 634 . 15 1 1 A 50 50 ASP CB C 50 44.000 43.592 0.408 1
1 635 . 15 1 1 A 50 50 ASP N N 50 124.300 126.274 -1.974 1
1 636 . 15 1 1 A 51 51 GLU H H 51 8.450 8.637 -0.187 1
1 637 . 15 1 1 A 51 51 GLU C C 51 175.900 174.812 1.088 1
1 638 . 15 1 1 A 51 51 GLU CA C 51 56.000 57.775 -1.775 1
1 639 . 15 1 1 A 51 51 GLU CB C 51 31.700 30.905 0.795 1
1 640 . 15 1 1 A 51 51 GLU N N 51 121.300 123.168 -1.868 1
1 641 . 15 1 1 A 52 52 ILE H H 52 8.480 8.035 0.445 1
1 642 . 15 1 1 A 52 52 ILE C C 52 175.400 174.457 0.943 1
1 643 . 15 1 1 A 52 52 ILE CA C 52 60.400 60.448 -0.048 1
1 644 . 15 1 1 A 52 52 ILE CB C 52 40.000 39.419 0.581 1
1 645 . 15 1 1 A 52 52 ILE N N 52 122.700 120.518 2.182 1
1 646 . 15 1 1 A 53 53 VAL H H 53 8.140 8.961 -0.821 1
1 647 . 15 1 1 A 53 53 VAL C C 53 175.600 173.918 1.682 1
1 648 . 15 1 1 A 53 53 VAL CA C 53 61.900 60.452 1.448 1
1 649 . 15 1 1 A 53 53 VAL CB C 53 33.200 33.655 -0.455 1
1 650 . 15 1 1 A 53 53 VAL N N 53 124.400 121.840 2.560 1
1 651 . 15 1 1 A 54 54 GLU H H 54 8.540 8.735 -0.195 1
1 652 . 15 1 1 A 54 54 GLU CA C 54 55.600 52.897 2.703 1
1 653 . 15 1 1 A 54 54 GLU CB C 54 34.300 30.306 3.994 1
1 654 . 15 1 1 A 54 54 GLU N N 54 125.900 127.906 -2.006 1
1 655 . 15 1 1 A 55 55 PRO C C 55 177.500 176.742 0.758 1
1 656 . 15 1 1 A 55 55 PRO CA C 55 63.400 63.696 -0.296 1
1 657 . 15 1 1 A 55 55 PRO CB C 55 32.300 32.044 0.256 1
1 658 . 15 1 1 A 56 56 GLY H H 56 8.420 8.495 -0.075 1
1 659 . 15 1 1 A 56 56 GLY HA2 H 56 3.830 4.004 -0.174 1
1 660 . 15 1 1 A 56 56 GLY HA3 H 56 4.000 4.091 -0.091 1
1 661 . 15 1 1 A 56 56 GLY C C 56 174.500 175.190 -0.690 1
1 662 . 15 1 1 A 56 56 GLY CA C 56 45.400 45.533 -0.133 1
1 663 . 15 1 1 A 56 56 GLY N N 56 109.700 109.857 -0.157 1
1 664 . 15 1 1 A 57 57 GLU H H 57 8.180 7.736 0.444 1
1 665 . 15 1 1 A 57 57 GLU C C 57 176.300 177.611 -1.311 1
1 666 . 15 1 1 A 57 57 GLU CA C 57 57.500 59.130 -1.630 1
1 667 . 15 1 1 A 57 57 GLU CB C 57 30.400 29.994 0.406 1
1 668 . 15 1 1 A 57 57 GLU N N 57 120.900 120.111 0.789 1
1 669 . 15 1 1 A 58 58 TYR H H 58 8.020 7.285 0.735 1
1 670 . 15 1 1 A 58 58 TYR C C 58 175.100 174.535 0.565 1
1 671 . 15 1 1 A 58 58 TYR CA C 58 57.400 57.011 0.389 1
1 672 . 15 1 1 A 58 58 TYR CB C 58 38.900 39.876 -0.976 1
1 673 . 15 1 1 A 58 58 TYR N N 58 118.800 113.725 5.075 1
1 674 . 15 1 1 A 59 59 ASP H H 59 7.950 7.615 0.335 1
1 675 . 15 1 1 A 59 59 ASP CA C 59 52.700 50.839 1.861 1
1 676 . 15 1 1 A 59 59 ASP CB C 59 41.000 42.292 -1.292 1
1 677 . 15 1 1 A 59 59 ASP N N 59 123.500 122.414 1.086 1
1 678 . 15 1 1 A 61 61 PRO HA H 61 4.510 4.693 -0.183 1
1 685 . 15 1 1 A 61 61 PRO C C 61 176.500 176.311 0.189 1
1 686 . 15 1 1 A 61 61 PRO CA C 61 63.700 62.585 1.115 1
1 687 . 15 1 1 A 61 61 PRO CB C 61 34.200 32.138 2.062 1
1 690 . 15 1 1 A 62 62 GLU H H 62 8.490 8.541 -0.051 1
1 691 . 15 1 1 A 62 62 GLU N N 62 124.600 121.120 3.480 1
1 692 . 15 1 1 A 64 64 LYS C C 64 176.300 173.943 2.357 1
1 693 . 15 1 1 A 64 64 LYS CA C 64 57.000 55.323 1.677 1
1 694 . 15 1 1 A 64 64 LYS CB C 64 33.100 31.966 1.134 1
1 695 . 15 1 1 A 65 65 TYR H H 65 7.960 8.414 -0.454 1
1 696 . 15 1 1 A 65 65 TYR C C 65 176.000 175.243 0.757 1
1 697 . 15 1 1 A 65 65 TYR CA C 65 57.800 56.903 0.897 1
1 698 . 15 1 1 A 65 65 TYR CB C 65 38.800 37.756 1.044 1
1 699 . 15 1 1 A 65 65 TYR N N 65 119.300 127.284 -7.984 1
1 700 . 15 1 1 A 66 66 THR H H 66 7.820 8.662 -0.842 1
1 701 . 15 1 1 A 66 66 THR HA H 66 4.280 4.430 -0.150 1
1 706 . 15 1 1 A 66 66 THR C C 66 174.100 174.369 -0.269 1
1 707 . 15 1 1 A 66 66 THR CA C 66 62.100 62.042 0.058 1
1 708 . 15 1 1 A 66 66 THR CB C 66 70.000 69.576 0.424 1
1 710 . 15 1 1 A 66 66 THR N N 66 113.900 119.975 -6.075 1
1 711 . 15 1 1 A 67 67 ASN H H 67 8.270 8.750 -0.480 1
1 712 . 15 1 1 A 67 67 ASN C C 67 174.100 174.492 -0.392 1
1 713 . 15 1 1 A 67 67 ASN CA C 67 53.400 52.611 0.789 1
1 714 . 15 1 1 A 67 67 ASN CB C 67 39.300 36.802 2.498 1
1 715 . 15 1 1 A 67 67 ASN N N 67 121.400 123.418 -2.018 1
1 716 . 15 1 1 A 68 68 VAL H H 68 7.660 8.173 -0.513 1
1 717 . 15 1 1 A 68 68 VAL C C 68 175.500 175.505 -0.005 1
1 718 . 15 1 1 A 68 68 VAL CA C 68 61.800 62.635 -0.835 1
1 719 . 15 1 1 A 68 68 VAL CB C 68 33.700 31.764 1.936 1
1 720 . 15 1 1 A 68 68 VAL N N 68 119.400 123.895 -4.495 1
1 721 . 15 1 1 A 69 69 LYS H H 69 8.690 8.745 -0.055 1
1 722 . 15 1 1 A 69 69 LYS C C 69 175.200 175.461 -0.261 1
1 723 . 15 1 1 A 69 69 LYS CA C 69 55.200 55.702 -0.502 1
1 724 . 15 1 1 A 69 69 LYS CB C 69 35.200 33.048 2.152 1
1 725 . 15 1 1 A 69 69 LYS N N 69 126.500 128.140 -1.640 1
1 726 . 15 1 1 A 70 70 LYS H H 70 8.230 9.065 -0.835 1
1 727 . 15 1 1 A 70 70 LYS C C 70 176.400 175.247 1.153 1
1 728 . 15 1 1 A 70 70 LYS CA C 70 55.600 55.406 0.194 1
1 729 . 15 1 1 A 70 70 LYS CB C 70 33.800 32.287 1.513 1
1 730 . 15 1 1 A 70 70 LYS N N 70 122.700 124.959 -2.259 1
1 731 . 15 1 1 A 71 71 VAL H H 71 8.530 8.684 -0.154 1
1 732 . 15 1 1 A 71 71 VAL HA H 71 4.510 4.461 0.049 1
1 733 . 15 1 1 A 71 71 VAL C C 71 174.700 174.950 -0.250 1
1 734 . 15 1 1 A 71 71 VAL CA C 71 60.900 61.751 -0.851 1
1 735 . 15 1 1 A 71 71 VAL CB C 71 34.800 31.944 2.856 1
1 738 . 15 1 1 A 71 71 VAL N N 71 121.200 125.425 -4.225 1
1 739 . 15 1 1 A 72 72 LYS H H 72 8.210 8.931 -0.721 1
1 740 . 15 1 1 A 72 72 LYS HA H 72 4.800 4.751 0.049 1
1 747 . 15 1 1 A 72 72 LYS C C 72 176.200 175.164 1.036 1
1 748 . 15 1 1 A 72 72 LYS CA C 72 55.700 55.695 0.005 1
1 749 . 15 1 1 A 72 72 LYS CB C 72 33.700 32.562 1.138 1
1 752 . 15 1 1 A 72 72 LYS N N 72 123.600 127.714 -4.114 1
1 753 . 15 1 1 A 73 73 ILE H H 73 8.890 9.244 -0.354 1
1 754 . 15 1 1 A 73 73 ILE C C 73 174.400 174.521 -0.121 1
1 755 . 15 1 1 A 73 73 ILE CA C 73 60.400 60.314 0.086 1
1 756 . 15 1 1 A 73 73 ILE CB C 73 40.800 38.107 2.693 1
1 760 . 15 1 1 A 73 73 ILE N N 73 125.100 126.236 -1.136 1
1 761 . 15 1 1 A 74 74 LYS H H 74 8.420 8.971 -0.551 1
1 762 . 15 1 1 A 74 74 LYS HA H 74 4.800 4.827 -0.027 1
1 771 . 15 1 1 A 74 74 LYS C C 74 175.600 175.455 0.145 1
1 772 . 15 1 1 A 74 74 LYS CA C 74 56.200 55.370 0.830 1
1 773 . 15 1 1 A 74 74 LYS CB C 74 34.300 33.736 0.564 1
1 777 . 15 1 1 A 74 74 LYS N N 74 126.400 128.423 -2.023 1
1 778 . 15 1 1 A 75 75 LYS H H 75 9.090 9.463 -0.373 1
1 779 . 15 1 1 A 75 75 LYS HA H 75 4.800 4.997 -0.197 1
1 788 . 15 1 1 A 75 75 LYS C C 75 174.900 175.218 -0.318 1
1 789 . 15 1 1 A 75 75 LYS CA C 75 53.200 54.839 -1.639 1
1 790 . 15 1 1 A 75 75 LYS CB C 75 34.200 34.263 -0.063 1
1 794 . 15 1 1 A 75 75 LYS N N 75 127.500 127.410 0.090 1
1 795 . 15 1 1 A 76 76 VAL H H 76 8.610 8.977 -0.367 1
1 796 . 15 1 1 A 76 76 VAL HA H 76 5.340 4.970 0.370 1
1 804 . 15 1 1 A 76 76 VAL C C 76 171.400 173.886 -2.486 1
1 805 . 15 1 1 A 76 76 VAL CA C 76 58.000 59.590 -1.590 1
1 806 . 15 1 1 A 76 76 VAL CB C 76 36.400 35.045 1.355 1
1 809 . 15 1 1 A 76 76 VAL N N 76 120.100 120.908 -0.808 1
1 810 . 15 1 1 A 77 77 TYR H H 77 9.110 8.900 0.210 1
1 811 . 15 1 1 A 77 77 TYR HA H 77 6.150 5.693 0.457 1
1 816 . 15 1 1 A 77 77 TYR C C 77 173.600 172.826 0.774 1
1 817 . 15 1 1 A 77 77 TYR CA C 77 56.200 55.878 0.322 1
1 818 . 15 1 1 A 77 77 TYR CB C 77 44.000 41.026 2.974 1
1 821 . 15 1 1 A 77 77 TYR N N 77 121.300 121.595 -0.295 1
1 822 . 15 1 1 A 78 78 PHE H H 78 8.190 8.581 -0.391 1
1 823 . 15 1 1 A 78 78 PHE HA H 78 5.130 5.801 -0.671 1
1 829 . 15 1 1 A 78 78 PHE C C 78 173.600 173.741 -0.141 1
1 830 . 15 1 1 A 78 78 PHE CA C 78 55.900 55.170 0.730 1
1 831 . 15 1 1 A 78 78 PHE CB C 78 42.500 42.635 -0.135 1
1 835 . 15 1 1 A 78 78 PHE N N 78 112.700 117.675 -4.975 1
1 836 . 15 1 1 A 79 79 GLU H H 79 8.920 9.021 -0.101 1
1 837 . 15 1 1 A 79 79 GLU HA H 79 5.390 5.171 0.219 1
1 842 . 15 1 1 A 79 79 GLU C C 79 177.000 176.622 0.378 1
1 843 . 15 1 1 A 79 79 GLU CA C 79 54.900 54.908 -0.008 1
1 844 . 15 1 1 A 79 79 GLU CB C 79 33.600 33.195 0.405 1
1 846 . 15 1 1 A 79 79 GLU N N 79 120.500 119.226 1.274 1
1 847 . 15 1 1 A 80 80 THR H H 80 8.970 8.793 0.177 1
1 848 . 15 1 1 A 80 80 THR HA H 80 4.700 4.879 -0.179 1
1 854 . 15 1 1 A 80 80 THR C C 80 177.000 176.296 0.704 1
1 855 . 15 1 1 A 80 80 THR CA C 80 61.300 60.265 1.035 1
1 856 . 15 1 1 A 80 80 THR CB C 80 70.500 71.727 -1.227 1
1 858 . 15 1 1 A 80 80 THR N N 80 113.200 114.948 -1.748 1
1 859 . 15 1 1 A 81 81 LEU H H 81 8.610 8.387 0.223 1
1 860 . 15 1 1 A 81 81 LEU HA H 81 4.230 4.171 0.059 1
1 870 . 15 1 1 A 81 81 LEU C C 81 177.400 177.250 0.150 1
1 871 . 15 1 1 A 81 81 LEU CA C 81 57.700 56.639 1.061 1
1 872 . 15 1 1 A 81 81 LEU CB C 81 42.400 41.656 0.744 1
1 876 . 15 1 1 A 81 81 LEU N N 81 120.900 121.983 -1.083 1
1 877 . 15 1 1 A 82 82 ASP H H 82 8.850 7.840 1.010 1
1 878 . 15 1 1 A 82 82 ASP HA H 82 4.670 4.799 -0.129 1
1 881 . 15 1 1 A 82 82 ASP C C 82 174.100 175.616 -1.516 1
1 882 . 15 1 1 A 82 82 ASP CA C 82 52.700 53.282 -0.582 1
1 883 . 15 1 1 A 82 82 ASP CB C 82 37.900 40.717 -2.817 1
1 884 . 15 1 1 A 82 82 ASP N N 82 112.300 118.698 -6.398 1
1 885 . 15 1 1 A 83 83 ASN H H 83 7.790 7.825 -0.035 1
1 886 . 15 1 1 A 83 83 ASN HA H 83 4.270 4.420 -0.150 1
1 891 . 15 1 1 A 83 83 ASN C C 83 176.100 174.193 1.907 1
1 892 . 15 1 1 A 83 83 ASN CA C 83 55.300 54.521 0.779 1
1 893 . 15 1 1 A 83 83 ASN CB C 83 36.900 37.167 -0.267 1
1 894 . 15 1 1 A 83 83 ASN N N 83 113.000 114.709 -1.709 1
1 896 . 15 1 1 A 84 84 VAL H H 84 7.660 7.532 0.128 1
1 897 . 15 1 1 A 84 84 VAL HA H 84 4.270 4.183 0.087 1
1 905 . 15 1 1 A 84 84 VAL C C 84 175.800 174.900 0.900 1
1 906 . 15 1 1 A 84 84 VAL CA C 84 61.500 61.779 -0.279 1
1 907 . 15 1 1 A 84 84 VAL CB C 84 33.500 32.809 0.691 1
1 910 . 15 1 1 A 84 84 VAL N N 84 119.700 119.414 0.286 1
1 911 . 15 1 1 A 85 85 ARG H H 85 8.180 9.173 -0.993 1
1 912 . 15 1 1 A 85 85 ARG HA H 85 4.870 4.732 0.138 1
1 920 . 15 1 1 A 85 85 ARG C C 85 174.000 175.011 -1.011 1
1 921 . 15 1 1 A 85 85 ARG CA C 85 55.700 55.295 0.405 1
1 922 . 15 1 1 A 85 85 ARG CB C 85 32.600 31.119 1.481 1
1 925 . 15 1 1 A 85 85 ARG N N 85 124.800 127.560 -2.760 1
1 927 . 15 1 1 A 86 86 VAL H H 86 8.570 8.406 0.164 1
1 928 . 15 1 1 A 86 86 VAL HA H 86 4.580 4.564 0.016 1
1 936 . 15 1 1 A 86 86 VAL C C 86 175.700 175.119 0.581 1
1 937 . 15 1 1 A 86 86 VAL CA C 86 61.700 61.505 0.195 1
1 938 . 15 1 1 A 86 86 VAL CB C 86 30.900 31.280 -0.380 1
1 941 . 15 1 1 A 86 86 VAL N N 86 127.300 124.875 2.425 1
1 942 . 15 1 1 A 87 87 VAL H H 87 8.790 8.738 0.052 1
1 943 . 15 1 1 A 87 87 VAL HA H 87 5.010 4.734 0.276 1
1 951 . 15 1 1 A 87 87 VAL C C 87 175.500 174.651 0.849 1
1 952 . 15 1 1 A 87 87 VAL CA C 87 61.900 60.779 1.121 1
1 953 . 15 1 1 A 87 87 VAL CB C 87 36.300 32.846 3.454 1
1 956 . 15 1 1 A 87 87 VAL N N 87 125.700 129.002 -3.302 1
1 957 . 15 1 1 A 88 88 THR H H 88 8.350 8.858 -0.508 1
1 958 . 15 1 1 A 88 88 THR HA H 88 4.620 4.576 0.044 1
1 964 . 15 1 1 A 88 88 THR C C 88 173.300 172.903 0.397 1
1 965 . 15 1 1 A 88 88 THR CA C 88 61.700 60.732 0.968 1
1 966 . 15 1 1 A 88 88 THR CB C 88 70.400 72.219 -1.819 1
1 968 . 15 1 1 A 88 88 THR N N 88 117.500 120.861 -3.361 1
1 969 . 15 1 1 A 89 89 ASP H H 89 7.700 8.578 -0.878 1
1 970 . 15 1 1 A 89 89 ASP HA H 89 4.480 4.692 -0.212 1
1 973 . 15 1 1 A 89 89 ASP C C 89 175.900 176.704 -0.804 1
1 974 . 15 1 1 A 89 89 ASP CA C 89 55.900 54.869 1.031 1
1 975 . 15 1 1 A 89 89 ASP CB C 89 43.900 41.198 2.702 1
1 976 . 15 1 1 A 89 89 ASP N N 89 120.800 123.702 -2.902 1
1 977 . 15 1 1 A 90 90 TYR H H 90 8.240 9.122 -0.882 1
1 978 . 15 1 1 A 90 90 TYR HA H 90 3.920 4.147 -0.227 1
1 983 . 15 1 1 A 90 90 TYR C C 90 176.400 177.211 -0.811 1
1 984 . 15 1 1 A 90 90 TYR CA C 90 62.300 62.136 0.164 1
1 985 . 15 1 1 A 90 90 TYR CB C 90 39.500 38.685 0.815 1
1 988 . 15 1 1 A 90 90 TYR N N 90 126.100 125.931 0.169 1
1 989 . 15 1 1 A 91 91 SER H H 91 9.160 8.298 0.862 1
1 990 . 15 1 1 A 91 91 SER HA H 91 4.000 4.049 -0.049 1
1 993 . 15 1 1 A 91 91 SER C C 91 178.000 176.097 1.903 1
1 994 . 15 1 1 A 91 91 SER CA C 91 62.600 61.908 0.692 1
1 995 . 15 1 1 A 91 91 SER CB C 91 62.200 62.858 -0.658 1
1 996 . 15 1 1 A 91 91 SER N N 91 116.600 116.462 0.138 1
1 997 . 15 1 1 A 92 92 GLU H H 92 8.590 7.814 0.776 1
1 998 . 15 1 1 A 92 92 GLU HA H 92 4.050 4.245 -0.195 1
1 1003 . 15 1 1 A 92 92 GLU C C 92 179.400 178.571 0.829 1
1 1004 . 15 1 1 A 92 92 GLU CA C 92 58.900 58.191 0.709 1
1 1005 . 15 1 1 A 92 92 GLU CB C 92 30.600 29.337 1.263 1
1 1007 . 15 1 1 A 92 92 GLU N N 92 120.200 121.618 -1.418 1
1 1008 . 15 1 1 A 93 93 PHE H H 93 7.870 8.159 -0.289 1
1 1009 . 15 1 1 A 93 93 PHE HA H 93 4.050 4.138 -0.088 1
1 1015 . 15 1 1 A 93 93 PHE C C 93 176.500 177.719 -1.219 1
1 1016 . 15 1 1 A 93 93 PHE CA C 93 62.200 61.157 1.043 1
1 1017 . 15 1 1 A 93 93 PHE CB C 93 39.700 39.198 0.502 1
1 1021 . 15 1 1 A 93 93 PHE N N 93 120.200 122.316 -2.116 1
1 1022 . 15 1 1 A 94 94 GLN H H 94 8.190 8.507 -0.317 1
1 1023 . 15 1 1 A 94 94 GLN HA H 94 3.390 3.501 -0.111 1
1 1030 . 15 1 1 A 94 94 GLN C C 94 178.600 178.157 0.443 1
1 1031 . 15 1 1 A 94 94 GLN CA C 94 58.800 59.136 -0.336 1
1 1032 . 15 1 1 A 94 94 GLN CB C 94 28.400 28.461 -0.061 1
1 1034 . 15 1 1 A 94 94 GLN N N 94 116.800 118.307 -1.507 1
1 1036 . 15 1 1 A 95 95 LYS H H 95 7.060 7.434 -0.374 1
1 1037 . 15 1 1 A 95 95 LYS HA H 95 3.780 3.982 -0.202 1
1 1046 . 15 1 1 A 95 95 LYS C C 95 179.300 178.713 0.587 1
1 1047 . 15 1 1 A 95 95 LYS CA C 95 59.900 59.121 0.779 1
1 1048 . 15 1 1 A 95 95 LYS CB C 95 32.700 32.069 0.631 1
1 1052 . 15 1 1 A 95 95 LYS N N 95 117.500 120.730 -3.230 1
1 1053 . 15 1 1 A 96 96 ILE H H 96 7.240 7.681 -0.441 1
1 1054 . 15 1 1 A 96 96 ILE HA H 96 3.420 3.524 -0.104 1
1 1064 . 15 1 1 A 96 96 ILE C C 96 177.800 177.945 -0.145 1
1 1065 . 15 1 1 A 96 96 ILE CA C 96 64.300 65.600 -1.300 1
1 1066 . 15 1 1 A 96 96 ILE CB C 96 37.400 37.327 0.073 1
1 1070 . 15 1 1 A 96 96 ILE N N 96 120.700 119.544 1.156 1
1 1071 . 15 1 1 A 97 97 LEU H H 97 7.690 7.781 -0.091 1
1 1072 . 15 1 1 A 97 97 LEU HA H 97 3.580 3.611 -0.031 1
1 1082 . 15 1 1 A 97 97 LEU C C 97 179.900 178.718 1.182 1
1 1083 . 15 1 1 A 97 97 LEU CA C 97 58.100 58.115 -0.015 1
1 1084 . 15 1 1 A 97 97 LEU CB C 97 41.500 41.439 0.061 1
1 1088 . 15 1 1 A 97 97 LEU N N 97 120.000 119.978 0.022 1
1 1089 . 15 1 1 A 98 98 LYS H H 98 7.510 7.944 -0.434 1
1 1090 . 15 1 1 A 98 98 LYS HA H 98 3.950 4.037 -0.087 1
1 1099 . 15 1 1 A 98 98 LYS C C 98 178.700 179.350 -0.650 1
1 1100 . 15 1 1 A 98 98 LYS CA C 98 58.700 59.381 -0.681 1
1 1101 . 15 1 1 A 98 98 LYS CB C 98 32.500 31.928 0.572 1
1 1105 . 15 1 1 A 98 98 LYS N N 98 117.300 116.722 0.578 1
1 1106 . 15 1 1 A 99 99 LYS H H 99 7.470 8.124 -0.654 1
1 1107 . 15 1 1 A 99 99 LYS HA H 99 4.080 4.000 0.080 1
1 1116 . 15 1 1 A 99 99 LYS C C 99 178.100 178.771 -0.671 1
1 1117 . 15 1 1 A 99 99 LYS CA C 99 58.400 58.971 -0.571 1
1 1118 . 15 1 1 A 99 99 LYS CB C 99 33.000 31.813 1.187 1
1 1122 . 15 1 1 A 99 99 LYS N N 99 119.000 118.500 0.500 1
1 1123 . 15 1 1 A 100 100 ARG H H 100 8.020 7.295 0.725 1
1 1124 . 15 1 1 A 100 100 ARG HA H 100 4.210 4.181 0.029 1
1 1131 . 15 1 1 A 100 100 ARG C C 100 177.500 176.165 1.335 1
1 1132 . 15 1 1 A 100 100 ARG CA C 100 56.700 56.407 0.293 1
1 1133 . 15 1 1 A 100 100 ARG CB C 100 30.500 30.643 -0.143 1
1 1136 . 15 1 1 A 100 100 ARG N N 100 117.300 117.359 -0.059 1
1 1137 . 15 1 1 A 101 101 GLY H H 101 7.910 7.888 0.022 1
1 1138 . 15 1 1 A 101 101 GLY HA2 H 101 3.980 4.053 -0.073 1
1 1139 . 15 1 1 A 101 101 GLY HA3 H 101 4.020 4.064 -0.044 1
1 1140 . 15 1 1 A 101 101 GLY C C 101 174.400 174.182 0.218 1
1 1141 . 15 1 1 A 101 101 GLY CA C 101 46.000 45.013 0.987 1
1 1142 . 15 1 1 A 101 101 GLY N N 101 108.000 106.461 1.539 1
1 1143 . 15 1 1 A 102 102 THR H H 102 7.880 8.275 -0.395 1
1 1144 . 15 1 1 A 102 102 THR HA H 102 4.360 4.376 -0.016 1
1 1149 . 15 1 1 A 102 102 THR C C 102 174.400 174.301 0.099 1
1 1150 . 15 1 1 A 102 102 THR CA C 102 62.100 62.688 -0.588 1
1 1151 . 15 1 1 A 102 102 THR CB C 102 70.500 69.641 0.859 1
1 1153 . 15 1 1 A 102 102 THR N N 102 113.900 116.092 -2.192 1
1 1154 . 15 1 1 A 103 103 LYS H H 103 8.440 9.035 -0.595 1
1 1155 . 15 1 1 A 103 103 LYS C C 103 176.400 177.387 -0.987 1
1 1156 . 15 1 1 A 103 103 LYS CA C 103 56.600 54.388 2.212 1
1 1157 . 15 1 1 A 103 103 LYS CB C 103 33.300 34.348 -1.048 1
1 1158 . 15 1 1 A 103 103 LYS N N 103 124.000 124.104 -0.104 1
1 1159 . 15 1 1 A 104 104 LEU H H 104 8.180 8.545 -0.365 1
1 1160 . 15 1 1 A 104 104 LEU HA H 104 4.270 4.344 -0.074 1
1 1170 . 15 1 1 A 104 104 LEU C C 104 177.100 176.530 0.570 1
1 1171 . 15 1 1 A 104 104 LEU CA C 104 55.500 55.510 -0.010 1
1 1172 . 15 1 1 A 104 104 LEU CB C 104 42.500 42.586 -0.086 1
1 1176 . 15 1 1 A 104 104 LEU N N 104 123.500 120.959 2.541 1
1 1177 . 15 1 1 A 105 105 GLU H H 105 8.270 7.800 0.470 1
1 1178 . 15 1 1 A 105 105 GLU CA C 105 56.700 55.020 1.680 1
1 1179 . 15 1 1 A 105 105 GLU CB C 105 30.800 30.863 -0.063 1
1 13 . 16 1 1 A 2 2 ASN HA H 2 4.980 5.137 -0.157 1
1 18 . 16 1 1 A 2 2 ASN C C 2 176.300 176.123 0.177 1
1 19 . 16 1 1 A 2 2 ASN CA C 2 52.500 51.379 1.121 1
1 20 . 16 1 1 A 2 2 ASN CB C 2 40.900 41.714 -0.814 1
1 22 . 16 1 1 A 3 3 SER H H 3 9.940 9.175 0.765 1
1 23 . 16 1 1 A 3 3 SER HA H 3 3.720 4.249 -0.529 1
1 26 . 16 1 1 A 3 3 SER C C 3 175.900 176.899 -0.999 1
1 27 . 16 1 1 A 3 3 SER CA C 3 63.300 61.184 2.116 1
1 28 . 16 1 1 A 3 3 SER CB C 3 61.700 63.118 -1.418 1
1 29 . 16 1 1 A 3 3 SER N N 3 118.200 116.534 1.666 1
1 30 . 16 1 1 A 4 4 GLU H H 4 8.450 8.067 0.383 1
1 31 . 16 1 1 A 4 4 GLU HA H 4 4.010 4.046 -0.036 1
1 36 . 16 1 1 A 4 4 GLU C C 4 178.800 178.938 -0.138 1
1 37 . 16 1 1 A 4 4 GLU CA C 4 60.300 59.164 1.136 1
1 38 . 16 1 1 A 4 4 GLU CB C 4 29.100 29.281 -0.181 1
1 40 . 16 1 1 A 4 4 GLU N N 4 123.600 122.348 1.252 1
1 41 . 16 1 1 A 5 5 VAL H H 5 7.590 7.749 -0.159 1
1 42 . 16 1 1 A 5 5 VAL HA H 5 3.850 3.934 -0.084 1
1 50 . 16 1 1 A 5 5 VAL C C 5 179.100 178.398 0.702 1
1 51 . 16 1 1 A 5 5 VAL CA C 5 65.800 66.157 -0.357 1
1 52 . 16 1 1 A 5 5 VAL CB C 5 32.300 31.602 0.698 1
1 55 . 16 1 1 A 5 5 VAL N N 5 119.300 119.970 -0.670 1
1 56 . 16 1 1 A 6 6 ILE H H 6 7.240 8.345 -1.105 1
1 57 . 16 1 1 A 6 6 ILE HA H 6 3.580 3.774 -0.194 1
1 67 . 16 1 1 A 6 6 ILE C C 6 177.000 177.825 -0.825 1
1 68 . 16 1 1 A 6 6 ILE CA C 6 65.300 65.344 -0.044 1
1 69 . 16 1 1 A 6 6 ILE CB C 6 37.900 37.352 0.548 1
1 73 . 16 1 1 A 6 6 ILE N N 6 120.300 121.007 -0.707 1
1 74 . 16 1 1 A 7 7 LYS H H 7 8.050 7.880 0.170 1
1 75 . 16 1 1 A 7 7 LYS HA H 7 3.570 3.773 -0.203 1
1 84 . 16 1 1 A 7 7 LYS C C 7 178.700 180.104 -1.404 1
1 85 . 16 1 1 A 7 7 LYS CA C 7 61.300 60.497 0.803 1
1 86 . 16 1 1 A 7 7 LYS CB C 7 32.200 32.168 0.032 1
1 90 . 16 1 1 A 7 7 LYS N N 7 119.200 119.235 -0.035 1
1 91 . 16 1 1 A 8 8 GLU H H 8 8.100 7.875 0.225 1
1 92 . 16 1 1 A 8 8 GLU HA H 8 4.000 4.112 -0.112 1
1 97 . 16 1 1 A 8 8 GLU C C 8 178.500 179.227 -0.727 1
1 98 . 16 1 1 A 8 8 GLU CA C 8 59.700 59.337 0.363 1
1 99 . 16 1 1 A 8 8 GLU CB C 8 29.600 29.748 -0.148 1
1 101 . 16 1 1 A 8 8 GLU N N 8 119.400 120.299 -0.899 1
1 102 . 16 1 1 A 9 9 PHE H H 9 7.720 8.076 -0.356 1
1 103 . 16 1 1 A 9 9 PHE HA H 9 4.160 4.164 -0.004 1
1 109 . 16 1 1 A 9 9 PHE C C 9 176.900 177.059 -0.159 1
1 110 . 16 1 1 A 9 9 PHE CA C 9 61.300 61.450 -0.150 1
1 111 . 16 1 1 A 9 9 PHE CB C 9 39.400 39.253 0.147 1
1 115 . 16 1 1 A 9 9 PHE N N 9 121.300 121.984 -0.684 1
1 116 . 16 1 1 A 10 10 LEU H H 10 8.060 8.821 -0.761 1
1 117 . 16 1 1 A 10 10 LEU HA H 10 3.660 3.868 -0.208 1
1 127 . 16 1 1 A 10 10 LEU C C 10 179.000 178.931 0.069 1
1 128 . 16 1 1 A 10 10 LEU CA C 10 58.000 57.854 0.146 1
1 129 . 16 1 1 A 10 10 LEU CB C 10 41.400 41.444 -0.044 1
1 133 . 16 1 1 A 10 10 LEU N N 10 118.000 119.088 -1.088 1
1 134 . 16 1 1 A 11 11 GLU H H 11 7.990 8.617 -0.627 1
1 135 . 16 1 1 A 11 11 GLU HA H 11 4.110 3.893 0.217 1
1 140 . 16 1 1 A 11 11 GLU C C 11 174.200 178.534 -4.334 1
1 141 . 16 1 1 A 11 11 GLU CA C 11 59.200 60.015 -0.815 1
1 142 . 16 1 1 A 11 11 GLU CB C 11 29.300 29.281 0.019 1
1 144 . 16 1 1 A 11 11 GLU N N 11 118.300 120.621 -2.321 1
1 145 . 16 1 1 A 12 12 ASP H H 12 8.080 8.013 0.067 1
1 146 . 16 1 1 A 12 12 ASP HA H 12 4.340 4.381 -0.041 1
1 149 . 16 1 1 A 12 12 ASP C C 12 178.900 177.941 0.959 1
1 150 . 16 1 1 A 12 12 ASP CA C 12 57.600 57.175 0.425 1
1 151 . 16 1 1 A 12 12 ASP CB C 12 41.000 41.054 -0.054 1
1 152 . 16 1 1 A 12 12 ASP N N 12 121.800 120.105 1.695 1
1 153 . 16 1 1 A 13 13 ILE H H 13 7.610 7.490 0.120 1
1 154 . 16 1 1 A 13 13 ILE HA H 13 4.240 3.979 0.261 1
1 164 . 16 1 1 A 13 13 ILE C C 13 176.800 176.689 0.111 1
1 165 . 16 1 1 A 13 13 ILE CA C 13 62.100 61.213 0.887 1
1 166 . 16 1 1 A 13 13 ILE CB C 13 38.300 38.184 0.116 1
1 170 . 16 1 1 A 13 13 ILE N N 13 110.800 111.462 -0.662 1
1 171 . 16 1 1 A 14 14 GLY H H 14 7.640 8.221 -0.581 1
1 172 . 16 1 1 A 14 14 GLY HA2 H 14 3.810 3.930 -0.120 1
1 173 . 16 1 1 A 14 14 GLY HA3 H 14 3.880 3.938 -0.058 1
1 174 . 16 1 1 A 14 14 GLY C C 14 175.200 174.134 1.066 1
1 175 . 16 1 1 A 14 14 GLY CA C 14 46.900 46.372 0.528 1
1 176 . 16 1 1 A 14 14 GLY N N 14 111.800 112.847 -1.047 1
1 177 . 16 1 1 A 15 15 GLU H H 15 7.870 8.353 -0.483 1
1 178 . 16 1 1 A 15 15 GLU HA H 15 4.680 4.830 -0.150 1
1 183 . 16 1 1 A 15 15 GLU C C 15 175.100 174.675 0.425 1
1 184 . 16 1 1 A 15 15 GLU CA C 15 54.800 54.425 0.375 1
1 185 . 16 1 1 A 15 15 GLU CB C 15 32.200 32.984 -0.784 1
1 187 . 16 1 1 A 15 15 GLU N N 15 119.200 118.765 0.435 1
1 188 . 16 1 1 A 16 16 ASP H H 16 8.220 8.818 -0.598 1
1 189 . 16 1 1 A 16 16 ASP HA H 16 4.680 5.582 -0.902 1
1 192 . 16 1 1 A 16 16 ASP C C 16 174.600 174.704 -0.104 1
1 193 . 16 1 1 A 16 16 ASP CA C 16 53.600 52.302 1.298 1
1 194 . 16 1 1 A 16 16 ASP CB C 16 42.900 44.346 -1.446 1
1 195 . 16 1 1 A 16 16 ASP N N 16 120.600 118.524 2.076 1
1 196 . 16 1 1 A 17 17 TYR H H 17 7.540 8.571 -1.031 1
1 197 . 16 1 1 A 17 17 TYR HA H 17 4.910 5.739 -0.829 1
1 202 . 16 1 1 A 17 17 TYR C C 17 173.600 173.218 0.382 1
1 203 . 16 1 1 A 17 17 TYR CA C 17 56.200 55.358 0.842 1
1 204 . 16 1 1 A 17 17 TYR CB C 17 41.100 42.180 -1.080 1
1 207 . 16 1 1 A 17 17 TYR N N 17 112.700 116.052 -3.352 1
1 208 . 16 1 1 A 18 18 ILE H H 18 7.950 8.811 -0.861 1
1 209 . 16 1 1 A 18 18 ILE HA H 18 4.330 4.534 -0.204 1
1 219 . 16 1 1 A 18 18 ILE C C 18 174.700 174.580 0.120 1
1 220 . 16 1 1 A 18 18 ILE CA C 18 60.300 61.066 -0.766 1
1 221 . 16 1 1 A 18 18 ILE CB C 18 41.000 37.208 3.792 1
1 225 . 16 1 1 A 18 18 ILE N N 18 120.400 122.231 -1.831 1
1 226 . 16 1 1 A 19 19 GLU H H 19 8.760 9.029 -0.269 1
1 227 . 16 1 1 A 19 19 GLU HA H 19 5.200 5.297 -0.097 1
1 232 . 16 1 1 A 19 19 GLU C C 19 175.200 175.543 -0.343 1
1 233 . 16 1 1 A 19 19 GLU CA C 19 55.500 55.427 0.073 1
1 234 . 16 1 1 A 19 19 GLU CB C 19 32.400 31.131 1.269 1
1 236 . 16 1 1 A 19 19 GLU N N 19 129.000 128.736 0.264 1
1 237 . 16 1 1 A 20 20 LEU H H 20 8.730 9.160 -0.430 1
1 238 . 16 1 1 A 20 20 LEU HA H 20 4.620 4.676 -0.056 1
1 248 . 16 1 1 A 20 20 LEU C C 20 176.200 177.033 -0.833 1
1 249 . 16 1 1 A 20 20 LEU CA C 20 54.100 53.731 0.369 1
1 250 . 16 1 1 A 20 20 LEU CB C 20 44.400 42.031 2.369 1
1 254 . 16 1 1 A 20 20 LEU N N 20 128.400 129.269 -0.869 1
1 255 . 16 1 1 A 21 21 GLU H H 21 8.700 9.206 -0.506 1
1 256 . 16 1 1 A 21 21 GLU HA H 21 3.870 3.934 -0.064 1
1 261 . 16 1 1 A 21 21 GLU C C 21 176.100 175.369 0.731 1
1 262 . 16 1 1 A 21 21 GLU CA C 21 58.800 57.474 1.326 1
1 263 . 16 1 1 A 21 21 GLU CB C 21 28.200 28.528 -0.328 1
1 265 . 16 1 1 A 21 21 GLU N N 21 122.600 123.717 -1.117 1
1 266 . 16 1 1 A 22 22 ASN H H 22 8.640 9.244 -0.604 1
1 267 . 16 1 1 A 22 22 ASN HA H 22 4.540 4.293 0.247 1
1 272 . 16 1 1 A 22 22 ASN C C 22 173.800 174.035 -0.235 1
1 273 . 16 1 1 A 22 22 ASN CA C 22 54.600 54.886 -0.286 1
1 274 . 16 1 1 A 22 22 ASN CB C 22 38.400 37.027 1.373 1
1 275 . 16 1 1 A 22 22 ASN N N 22 118.000 109.606 8.394 1
1 277 . 16 1 1 A 23 23 GLU H H 23 7.740 7.789 -0.049 1
1 278 . 16 1 1 A 23 23 GLU HA H 23 5.430 4.949 0.481 1
1 283 . 16 1 1 A 23 23 GLU C C 23 175.400 175.509 -0.109 1
1 284 . 16 1 1 A 23 23 GLU CA C 23 54.900 55.460 -0.560 1
1 285 . 16 1 1 A 23 23 GLU CB C 23 34.500 31.506 2.994 1
1 287 . 16 1 1 A 23 23 GLU N N 23 116.400 117.882 -1.482 1
1 288 . 16 1 1 A 24 24 ILE H H 24 9.050 9.094 -0.044 1
1 289 . 16 1 1 A 24 24 ILE HA H 24 4.810 4.663 0.147 1
1 299 . 16 1 1 A 24 24 ILE C C 24 174.600 175.202 -0.602 1
1 300 . 16 1 1 A 24 24 ILE CA C 24 60.700 60.424 0.276 1
1 301 . 16 1 1 A 24 24 ILE CB C 24 41.300 37.587 3.713 1
1 305 . 16 1 1 A 24 24 ILE N N 24 122.800 126.683 -3.883 1
1 306 . 16 1 1 A 25 25 HIS H H 25 9.490 9.739 -0.249 1
1 307 . 16 1 1 A 25 25 HIS HA H 25 5.090 5.580 -0.490 1
1 312 . 16 1 1 A 25 25 HIS C C 25 176.100 174.538 1.562 1
1 313 . 16 1 1 A 25 25 HIS CA C 25 56.100 55.474 0.626 1
1 314 . 16 1 1 A 25 25 HIS CB C 25 33.100 29.833 3.267 1
1 317 . 16 1 1 A 25 25 HIS N N 25 127.300 127.031 0.269 1
1 318 . 16 1 1 A 26 26 LEU H H 26 8.820 8.839 -0.019 1
1 319 . 16 1 1 A 26 26 LEU HA H 26 5.160 4.847 0.313 1
1 329 . 16 1 1 A 26 26 LEU C C 26 178.000 176.866 1.134 1
1 330 . 16 1 1 A 26 26 LEU CA C 26 52.900 53.516 -0.616 1
1 331 . 16 1 1 A 26 26 LEU CB C 26 48.100 43.080 5.020 1
1 335 . 16 1 1 A 26 26 LEU N N 26 121.600 125.588 -3.988 1
1 336 . 16 1 1 A 27 27 LYS H H 27 8.990 8.916 0.074 1
1 337 . 16 1 1 A 27 27 LYS HA H 27 4.630 4.597 0.033 1
1 345 . 16 1 1 A 27 27 LYS CA C 27 55.700 54.184 1.516 1
1 346 . 16 1 1 A 27 27 LYS CB C 27 31.900 32.338 -0.438 1
1 350 . 16 1 1 A 27 27 LYS N N 27 125.900 121.065 4.835 1
1 351 . 16 1 1 A 28 28 PRO HA H 28 4.500 4.480 0.020 1
1 358 . 16 1 1 A 28 28 PRO C C 28 177.900 178.175 -0.275 1
1 359 . 16 1 1 A 28 28 PRO CA C 28 67.400 65.920 1.480 1
1 360 . 16 1 1 A 28 28 PRO CB C 28 32.100 31.945 0.155 1
1 363 . 16 1 1 A 29 29 GLU H H 29 9.880 8.395 1.485 1
1 364 . 16 1 1 A 29 29 GLU HA H 29 4.140 4.219 -0.079 1
1 369 . 16 1 1 A 29 29 GLU C C 29 178.800 179.240 -0.440 1
1 370 . 16 1 1 A 29 29 GLU CA C 29 60.600 60.089 0.511 1
1 371 . 16 1 1 A 29 29 GLU CB C 29 29.200 29.774 -0.574 1
1 373 . 16 1 1 A 29 29 GLU N N 29 117.100 118.492 -1.392 1
1 374 . 16 1 1 A 30 30 VAL H H 30 7.050 7.748 -0.698 1
1 375 . 16 1 1 A 30 30 VAL HA H 30 3.850 3.960 -0.110 1
1 383 . 16 1 1 A 30 30 VAL C C 30 177.700 178.189 -0.489 1
1 384 . 16 1 1 A 30 30 VAL CA C 30 65.600 66.015 -0.415 1
1 385 . 16 1 1 A 30 30 VAL CB C 30 32.100 32.064 0.036 1
1 388 . 16 1 1 A 30 30 VAL N N 30 120.900 119.935 0.965 1
1 389 . 16 1 1 A 31 31 PHE H H 31 8.980 9.044 -0.064 1
1 390 . 16 1 1 A 31 31 PHE HA H 31 3.870 4.219 -0.349 1
1 394 . 16 1 1 A 31 31 PHE C C 31 176.700 177.316 -0.616 1
1 395 . 16 1 1 A 31 31 PHE CA C 31 62.200 61.780 0.420 1
1 396 . 16 1 1 A 31 31 PHE CB C 31 39.300 38.965 0.335 1
1 398 . 16 1 1 A 31 31 PHE N N 31 121.100 120.605 0.495 1
1 399 . 16 1 1 A 32 32 TYR H H 32 8.640 8.446 0.194 1
1 400 . 16 1 1 A 32 32 TYR HA H 32 3.880 4.666 -0.786 1
1 405 . 16 1 1 A 32 32 TYR C C 32 176.000 177.973 -1.973 1
1 406 . 16 1 1 A 32 32 TYR CA C 32 63.300 61.958 1.342 1
1 407 . 16 1 1 A 32 32 TYR CB C 32 39.100 39.224 -0.124 1
1 410 . 16 1 1 A 32 32 TYR N N 32 117.400 120.628 -3.228 1
1 411 . 16 1 1 A 33 33 GLU H H 33 7.400 7.866 -0.466 1
1 412 . 16 1 1 A 33 33 GLU HA H 33 4.050 3.979 0.071 1
1 417 . 16 1 1 A 33 33 GLU C C 33 180.200 178.893 1.307 1
1 418 . 16 1 1 A 33 33 GLU CA C 33 59.500 58.861 0.639 1
1 419 . 16 1 1 A 33 33 GLU CB C 33 29.300 29.815 -0.515 1
1 421 . 16 1 1 A 33 33 GLU N N 33 116.100 119.074 -2.974 1
1 422 . 16 1 1 A 34 34 VAL H H 34 8.530 7.778 0.752 1
1 423 . 16 1 1 A 34 34 VAL HA H 34 3.350 3.284 0.066 1
1 431 . 16 1 1 A 34 34 VAL C C 34 175.800 178.404 -2.604 1
1 432 . 16 1 1 A 34 34 VAL CA C 34 66.400 66.034 0.366 1
1 433 . 16 1 1 A 34 34 VAL CB C 34 32.200 31.437 0.763 1
1 436 . 16 1 1 A 34 34 VAL N N 34 120.600 120.001 0.599 1
1 437 . 16 1 1 A 35 35 TRP H H 35 9.100 8.205 0.895 1
1 438 . 16 1 1 A 35 35 TRP HA H 35 3.340 3.731 -0.391 1
1 447 . 16 1 1 A 35 35 TRP C C 35 178.000 178.049 -0.049 1
1 448 . 16 1 1 A 35 35 TRP CA C 35 61.800 60.826 0.974 1
1 449 . 16 1 1 A 35 35 TRP CB C 35 27.900 29.727 -1.827 1
1 455 . 16 1 1 A 35 35 TRP N N 35 121.700 121.590 0.110 1
1 457 . 16 1 1 A 36 36 LYS H H 36 7.970 8.013 -0.043 1
1 458 . 16 1 1 A 36 36 LYS HA H 36 3.330 3.720 -0.390 1
1 467 . 16 1 1 A 36 36 LYS C C 36 180.000 178.333 1.667 1
1 468 . 16 1 1 A 36 36 LYS CA C 36 59.000 58.502 0.498 1
1 469 . 16 1 1 A 36 36 LYS CB C 36 31.800 32.075 -0.275 1
1 473 . 16 1 1 A 36 36 LYS N N 36 116.300 118.489 -2.189 1
1 474 . 16 1 1 A 37 37 TYR H H 37 7.750 7.745 0.005 1
1 475 . 16 1 1 A 37 37 TYR HA H 37 3.940 3.955 -0.015 1
1 480 . 16 1 1 A 37 37 TYR C C 37 177.600 177.166 0.434 1
1 481 . 16 1 1 A 37 37 TYR CA C 37 61.200 60.620 0.580 1
1 482 . 16 1 1 A 37 37 TYR CB C 37 38.800 38.678 0.122 1
1 485 . 16 1 1 A 37 37 TYR N N 37 122.700 121.458 1.242 1
1 486 . 16 1 1 A 38 38 VAL H H 38 7.660 7.034 0.626 1
1 487 . 16 1 1 A 38 38 VAL HA H 38 3.870 4.161 -0.291 1
1 495 . 16 1 1 A 38 38 VAL C C 38 175.600 175.513 0.087 1
1 496 . 16 1 1 A 38 38 VAL CA C 38 61.100 60.722 0.378 1
1 497 . 16 1 1 A 38 38 VAL CB C 38 30.700 31.194 -0.494 1
1 500 . 16 1 1 A 38 38 VAL N N 38 108.200 112.581 -4.381 1
1 501 . 16 1 1 A 39 39 GLY H H 39 7.090 7.574 -0.484 1
1 502 . 16 1 1 A 39 39 GLY HA2 H 39 3.320 3.716 -0.396 1
1 503 . 16 1 1 A 39 39 GLY HA3 H 39 3.730 3.742 -0.012 1
1 504 . 16 1 1 A 39 39 GLY C C 39 173.600 174.412 -0.812 1
1 505 . 16 1 1 A 39 39 GLY CA C 39 46.100 45.135 0.965 1
1 506 . 16 1 1 A 39 39 GLY N N 39 107.600 109.791 -2.191 1
1 507 . 16 1 1 A 40 40 GLU H H 40 7.730 8.360 -0.630 1
1 508 . 16 1 1 A 40 40 GLU HA H 40 1.090 3.346 -2.256 1
1 513 . 16 1 1 A 40 40 GLU CA C 40 55.700 56.408 -0.708 1
1 514 . 16 1 1 A 40 40 GLU CB C 40 27.200 26.079 1.121 1
1 516 . 16 1 1 A 40 40 GLU N N 40 114.400 118.459 -4.059 1
1 517 . 16 1 1 A 41 41 PRO HA H 41 4.310 4.473 -0.163 1
1 524 . 16 1 1 A 41 41 PRO CA C 41 62.300 62.282 0.018 1
1 525 . 16 1 1 A 41 41 PRO CB C 41 32.700 32.657 0.043 1
1 528 . 16 1 1 A 42 42 GLU H H 42 8.110 8.496 -0.386 1
1 529 . 16 1 1 A 42 42 GLU C C 42 175.800 176.697 -0.897 1
1 530 . 16 1 1 A 42 42 GLU CA C 42 57.800 56.992 0.808 1
1 531 . 16 1 1 A 42 42 GLU CB C 42 30.600 30.218 0.382 1
1 533 . 16 1 1 A 42 42 GLU N N 42 119.100 121.298 -2.198 1
1 534 . 16 1 1 A 43 43 LEU H H 43 8.140 8.502 -0.362 1
1 535 . 16 1 1 A 43 43 LEU HA H 43 4.840 4.663 0.177 1
1 545 . 16 1 1 A 43 43 LEU C C 43 177.300 176.448 0.852 1
1 546 . 16 1 1 A 43 43 LEU CA C 43 53.700 53.821 -0.121 1
1 547 . 16 1 1 A 43 43 LEU CB C 43 43.900 43.013 0.887 1
1 551 . 16 1 1 A 43 43 LEU N N 43 124.700 124.889 -0.189 1
1 552 . 16 1 1 A 44 44 LYS H H 44 8.640 8.280 0.360 1
1 553 . 16 1 1 A 44 44 LYS HA H 44 4.500 4.867 -0.367 1
1 562 . 16 1 1 A 44 44 LYS C C 44 174.500 175.054 -0.554 1
1 563 . 16 1 1 A 44 44 LYS CA C 44 54.700 54.978 -0.278 1
1 564 . 16 1 1 A 44 44 LYS CB C 44 36.200 34.042 2.158 1
1 568 . 16 1 1 A 44 44 LYS N N 44 123.300 122.127 1.173 1
1 569 . 16 1 1 A 45 45 THR H H 45 7.990 8.818 -0.828 1
1 570 . 16 1 1 A 45 45 THR HA H 45 5.700 5.557 0.143 1
1 575 . 16 1 1 A 45 45 THR C C 45 175.100 174.062 1.038 1
1 576 . 16 1 1 A 45 45 THR CA C 45 59.600 60.008 -0.408 1
1 577 . 16 1 1 A 45 45 THR CB C 45 73.400 70.501 2.899 1
1 579 . 16 1 1 A 45 45 THR N N 45 106.900 115.752 -8.852 1
1 580 . 16 1 1 A 46 46 TYR H H 46 8.470 9.242 -0.772 1
1 581 . 16 1 1 A 46 46 TYR HA H 46 4.930 5.881 -0.951 1
1 586 . 16 1 1 A 46 46 TYR C C 46 172.400 173.989 -1.589 1
1 587 . 16 1 1 A 46 46 TYR CA C 46 57.100 55.244 1.856 1
1 588 . 16 1 1 A 46 46 TYR CB C 46 40.200 41.889 -1.689 1
1 591 . 16 1 1 A 46 46 TYR N N 46 117.100 119.066 -1.966 1
1 592 . 16 1 1 A 47 47 VAL H H 47 8.430 9.061 -0.631 1
1 593 . 16 1 1 A 47 47 VAL HA H 47 4.890 4.446 0.444 1
1 601 . 16 1 1 A 47 47 VAL C C 47 175.800 174.233 1.567 1
1 602 . 16 1 1 A 47 47 VAL CA C 47 60.800 61.800 -1.000 1
1 603 . 16 1 1 A 47 47 VAL CB C 47 34.800 33.193 1.607 1
1 606 . 16 1 1 A 47 47 VAL N N 47 119.200 122.374 -3.174 1
1 607 . 16 1 1 A 48 48 ILE H H 48 8.680 8.902 -0.222 1
1 608 . 16 1 1 A 48 48 ILE HA H 48 4.560 4.840 -0.280 1
1 618 . 16 1 1 A 48 48 ILE C C 48 174.500 174.337 0.163 1
1 619 . 16 1 1 A 48 48 ILE CA C 48 59.700 60.068 -0.368 1
1 620 . 16 1 1 A 48 48 ILE CB C 48 41.500 39.842 1.658 1
1 624 . 16 1 1 A 48 48 ILE N N 48 124.400 129.643 -5.243 1
1 625 . 16 1 1 A 49 49 GLU H H 49 8.320 8.914 -0.594 1
1 626 . 16 1 1 A 49 49 GLU C C 49 175.500 174.785 0.715 1
1 627 . 16 1 1 A 49 49 GLU CA C 49 55.500 55.795 -0.295 1
1 628 . 16 1 1 A 49 49 GLU CB C 49 31.800 29.763 2.037 1
1 630 . 16 1 1 A 49 49 GLU N N 49 123.400 128.490 -5.090 1
1 631 . 16 1 1 A 50 50 ASP H H 50 8.610 8.470 0.140 1
1 632 . 16 1 1 A 50 50 ASP C C 50 175.100 174.818 0.282 1
1 633 . 16 1 1 A 50 50 ASP CA C 50 53.100 53.288 -0.188 1
1 634 . 16 1 1 A 50 50 ASP CB C 50 44.000 43.223 0.777 1
1 635 . 16 1 1 A 50 50 ASP N N 50 124.300 126.667 -2.367 1
1 636 . 16 1 1 A 51 51 GLU H H 51 8.450 8.828 -0.378 1
1 637 . 16 1 1 A 51 51 GLU C C 51 175.900 176.791 -0.891 1
1 638 . 16 1 1 A 51 51 GLU CA C 51 56.000 55.521 0.479 1
1 639 . 16 1 1 A 51 51 GLU CB C 51 31.700 30.333 1.367 1
1 640 . 16 1 1 A 51 51 GLU N N 51 121.300 125.639 -4.339 1
1 641 . 16 1 1 A 52 52 ILE H H 52 8.480 8.296 0.184 1
1 642 . 16 1 1 A 52 52 ILE C C 52 175.400 174.861 0.539 1
1 643 . 16 1 1 A 52 52 ILE CA C 52 60.400 60.372 0.028 1
1 644 . 16 1 1 A 52 52 ILE CB C 52 40.000 38.796 1.204 1
1 645 . 16 1 1 A 52 52 ILE N N 52 122.700 122.486 0.214 1
1 646 . 16 1 1 A 53 53 VAL H H 53 8.140 8.900 -0.760 1
1 647 . 16 1 1 A 53 53 VAL C C 53 175.600 174.295 1.305 1
1 648 . 16 1 1 A 53 53 VAL CA C 53 61.900 60.382 1.518 1
1 649 . 16 1 1 A 53 53 VAL CB C 53 33.200 33.859 -0.659 1
1 650 . 16 1 1 A 53 53 VAL N N 53 124.400 125.763 -1.363 1
1 651 . 16 1 1 A 54 54 GLU H H 54 8.540 8.829 -0.289 1
1 652 . 16 1 1 A 54 54 GLU CA C 54 55.600 53.163 2.437 1
1 653 . 16 1 1 A 54 54 GLU CB C 54 34.300 30.238 4.062 1
1 654 . 16 1 1 A 54 54 GLU N N 54 125.900 127.976 -2.076 1
1 655 . 16 1 1 A 55 55 PRO C C 55 177.500 176.600 0.900 1
1 656 . 16 1 1 A 55 55 PRO CA C 55 63.400 62.855 0.545 1
1 657 . 16 1 1 A 55 55 PRO CB C 55 32.300 32.802 -0.502 1
1 658 . 16 1 1 A 56 56 GLY H H 56 8.420 8.467 -0.047 1
1 659 . 16 1 1 A 56 56 GLY HA2 H 56 3.830 4.250 -0.420 1
1 660 . 16 1 1 A 56 56 GLY HA3 H 56 4.000 4.265 -0.265 1
1 661 . 16 1 1 A 56 56 GLY C C 56 174.500 175.237 -0.737 1
1 662 . 16 1 1 A 56 56 GLY CA C 56 45.400 45.809 -0.409 1
1 663 . 16 1 1 A 56 56 GLY N N 56 109.700 109.722 -0.022 1
1 664 . 16 1 1 A 57 57 GLU H H 57 8.180 8.259 -0.079 1
1 665 . 16 1 1 A 57 57 GLU C C 57 176.300 178.831 -2.531 1
1 666 . 16 1 1 A 57 57 GLU CA C 57 57.500 59.195 -1.695 1
1 667 . 16 1 1 A 57 57 GLU CB C 57 30.400 29.223 1.177 1
1 668 . 16 1 1 A 57 57 GLU N N 57 120.900 119.881 1.019 1
1 669 . 16 1 1 A 58 58 TYR H H 58 8.020 8.141 -0.121 1
1 670 . 16 1 1 A 58 58 TYR C C 58 175.100 175.159 -0.059 1
1 671 . 16 1 1 A 58 58 TYR CA C 58 57.400 60.204 -2.804 1
1 672 . 16 1 1 A 58 58 TYR CB C 58 38.900 39.307 -0.407 1
1 673 . 16 1 1 A 58 58 TYR N N 58 118.800 122.405 -3.605 1
1 674 . 16 1 1 A 59 59 ASP H H 59 7.950 8.536 -0.586 1
1 675 . 16 1 1 A 59 59 ASP CA C 59 52.700 54.856 -2.156 1
1 676 . 16 1 1 A 59 59 ASP CB C 59 41.000 39.223 1.777 1
1 677 . 16 1 1 A 59 59 ASP N N 59 123.500 119.899 3.601 1
1 678 . 16 1 1 A 61 61 PRO HA H 61 4.510 4.449 0.061 1
1 685 . 16 1 1 A 61 61 PRO C C 61 176.500 176.346 0.154 1
1 686 . 16 1 1 A 61 61 PRO CA C 61 63.700 64.623 -0.923 1
1 687 . 16 1 1 A 61 61 PRO CB C 61 34.200 31.686 2.514 1
1 690 . 16 1 1 A 62 62 GLU H H 62 8.490 8.035 0.455 1
1 691 . 16 1 1 A 62 62 GLU N N 62 124.600 119.897 4.703 1
1 692 . 16 1 1 A 64 64 LYS C C 64 176.300 175.100 1.200 1
1 693 . 16 1 1 A 64 64 LYS CA C 64 57.000 55.607 1.393 1
1 694 . 16 1 1 A 64 64 LYS CB C 64 33.100 32.956 0.144 1
1 695 . 16 1 1 A 65 65 TYR H H 65 7.960 8.629 -0.669 1
1 696 . 16 1 1 A 65 65 TYR C C 65 176.000 176.715 -0.715 1
1 697 . 16 1 1 A 65 65 TYR CA C 65 57.800 58.669 -0.869 1
1 698 . 16 1 1 A 65 65 TYR CB C 65 38.800 38.916 -0.116 1
1 699 . 16 1 1 A 65 65 TYR N N 65 119.300 125.901 -6.601 1
1 700 . 16 1 1 A 66 66 THR H H 66 7.820 8.672 -0.852 1
1 701 . 16 1 1 A 66 66 THR HA H 66 4.280 4.317 -0.037 1
1 706 . 16 1 1 A 66 66 THR C C 66 174.100 175.164 -1.064 1
1 707 . 16 1 1 A 66 66 THR CA C 66 62.100 63.243 -1.143 1
1 708 . 16 1 1 A 66 66 THR CB C 66 70.000 69.314 0.686 1
1 710 . 16 1 1 A 66 66 THR N N 66 113.900 116.139 -2.239 1
1 711 . 16 1 1 A 67 67 ASN H H 67 8.270 7.743 0.527 1
1 712 . 16 1 1 A 67 67 ASN C C 67 174.100 175.429 -1.329 1
1 713 . 16 1 1 A 67 67 ASN CA C 67 53.400 52.481 0.919 1
1 714 . 16 1 1 A 67 67 ASN CB C 67 39.300 39.972 -0.672 1
1 715 . 16 1 1 A 67 67 ASN N N 67 121.400 121.496 -0.096 1
1 716 . 16 1 1 A 68 68 VAL H H 68 7.660 8.665 -1.005 1
1 717 . 16 1 1 A 68 68 VAL C C 68 175.500 173.725 1.775 1
1 718 . 16 1 1 A 68 68 VAL CA C 68 61.800 59.794 2.006 1
1 719 . 16 1 1 A 68 68 VAL CB C 68 33.700 34.128 -0.428 1
1 720 . 16 1 1 A 68 68 VAL N N 68 119.400 117.488 1.912 1
1 721 . 16 1 1 A 69 69 LYS H H 69 8.690 8.269 0.421 1
1 722 . 16 1 1 A 69 69 LYS C C 69 175.200 175.397 -0.197 1
1 723 . 16 1 1 A 69 69 LYS CA C 69 55.200 54.403 0.797 1
1 724 . 16 1 1 A 69 69 LYS CB C 69 35.200 35.666 -0.466 1
1 725 . 16 1 1 A 69 69 LYS N N 69 126.500 122.263 4.237 1
1 726 . 16 1 1 A 70 70 LYS H H 70 8.230 8.568 -0.338 1
1 727 . 16 1 1 A 70 70 LYS C C 70 176.400 176.012 0.388 1
1 728 . 16 1 1 A 70 70 LYS CA C 70 55.600 55.991 -0.391 1
1 729 . 16 1 1 A 70 70 LYS CB C 70 33.800 33.700 0.100 1
1 730 . 16 1 1 A 70 70 LYS N N 70 122.700 125.838 -3.138 1
1 731 . 16 1 1 A 71 71 VAL H H 71 8.530 9.492 -0.962 1
1 732 . 16 1 1 A 71 71 VAL HA H 71 4.510 4.435 0.075 1
1 733 . 16 1 1 A 71 71 VAL C C 71 174.700 174.724 -0.024 1
1 734 . 16 1 1 A 71 71 VAL CA C 71 60.900 61.424 -0.524 1
1 735 . 16 1 1 A 71 71 VAL CB C 71 34.800 31.964 2.836 1
1 738 . 16 1 1 A 71 71 VAL N N 71 121.200 124.147 -2.947 1
1 739 . 16 1 1 A 72 72 LYS H H 72 8.210 8.739 -0.529 1
1 740 . 16 1 1 A 72 72 LYS HA H 72 4.800 4.587 0.213 1
1 747 . 16 1 1 A 72 72 LYS C C 72 176.200 175.774 0.426 1
1 748 . 16 1 1 A 72 72 LYS CA C 72 55.700 56.273 -0.573 1
1 749 . 16 1 1 A 72 72 LYS CB C 72 33.700 32.983 0.717 1
1 752 . 16 1 1 A 72 72 LYS N N 72 123.600 128.240 -4.640 1
1 753 . 16 1 1 A 73 73 ILE H H 73 8.890 8.486 0.404 1
1 754 . 16 1 1 A 73 73 ILE C C 73 174.400 174.272 0.128 1
1 755 . 16 1 1 A 73 73 ILE CA C 73 60.400 59.560 0.840 1
1 756 . 16 1 1 A 73 73 ILE CB C 73 40.800 39.989 0.811 1
1 760 . 16 1 1 A 73 73 ILE N N 73 125.100 121.927 3.173 1
1 761 . 16 1 1 A 74 74 LYS H H 74 8.420 9.087 -0.667 1
1 762 . 16 1 1 A 74 74 LYS HA H 74 4.800 5.074 -0.274 1
1 771 . 16 1 1 A 74 74 LYS C C 74 175.600 174.815 0.785 1
1 772 . 16 1 1 A 74 74 LYS CA C 74 56.200 54.513 1.687 1
1 773 . 16 1 1 A 74 74 LYS CB C 74 34.300 34.894 -0.594 1
1 777 . 16 1 1 A 74 74 LYS N N 74 126.400 126.141 0.259 1
1 778 . 16 1 1 A 75 75 LYS H H 75 9.090 8.691 0.399 1
1 779 . 16 1 1 A 75 75 LYS HA H 75 4.800 5.012 -0.212 1
1 788 . 16 1 1 A 75 75 LYS C C 75 174.900 174.653 0.247 1
1 789 . 16 1 1 A 75 75 LYS CA C 75 53.200 54.474 -1.274 1
1 790 . 16 1 1 A 75 75 LYS CB C 75 34.200 36.525 -2.325 1
1 794 . 16 1 1 A 75 75 LYS N N 75 127.500 125.320 2.180 1
1 795 . 16 1 1 A 76 76 VAL H H 76 8.610 8.949 -0.339 1
1 796 . 16 1 1 A 76 76 VAL HA H 76 5.340 5.212 0.128 1
1 804 . 16 1 1 A 76 76 VAL C C 76 171.400 173.928 -2.528 1
1 805 . 16 1 1 A 76 76 VAL CA C 76 58.000 59.670 -1.670 1
1 806 . 16 1 1 A 76 76 VAL CB C 76 36.400 35.476 0.924 1
1 809 . 16 1 1 A 76 76 VAL N N 76 120.100 121.508 -1.408 1
1 810 . 16 1 1 A 77 77 TYR H H 77 9.110 9.454 -0.344 1
1 811 . 16 1 1 A 77 77 TYR HA H 77 6.150 5.824 0.326 1
1 816 . 16 1 1 A 77 77 TYR C C 77 173.600 173.191 0.409 1
1 817 . 16 1 1 A 77 77 TYR CA C 77 56.200 55.620 0.580 1
1 818 . 16 1 1 A 77 77 TYR CB C 77 44.000 41.849 2.151 1
1 821 . 16 1 1 A 77 77 TYR N N 77 121.300 121.993 -0.693 1
1 822 . 16 1 1 A 78 78 PHE H H 78 8.190 8.887 -0.697 1
1 823 . 16 1 1 A 78 78 PHE HA H 78 5.130 5.564 -0.434 1
1 829 . 16 1 1 A 78 78 PHE C C 78 173.600 172.402 1.198 1
1 830 . 16 1 1 A 78 78 PHE CA C 78 55.900 55.290 0.610 1
1 831 . 16 1 1 A 78 78 PHE CB C 78 42.500 42.807 -0.307 1
1 835 . 16 1 1 A 78 78 PHE N N 78 112.700 116.678 -3.978 1
1 836 . 16 1 1 A 79 79 GLU H H 79 8.920 8.946 -0.026 1
1 837 . 16 1 1 A 79 79 GLU HA H 79 5.390 4.941 0.449 1
1 842 . 16 1 1 A 79 79 GLU C C 79 177.000 176.927 0.073 1
1 843 . 16 1 1 A 79 79 GLU CA C 79 54.900 55.432 -0.532 1
1 844 . 16 1 1 A 79 79 GLU CB C 79 33.600 31.429 2.171 1
1 846 . 16 1 1 A 79 79 GLU N N 79 120.500 119.953 0.547 1
1 847 . 16 1 1 A 80 80 THR H H 80 8.970 8.776 0.194 1
1 848 . 16 1 1 A 80 80 THR HA H 80 4.700 4.876 -0.176 1
1 854 . 16 1 1 A 80 80 THR C C 80 177.000 176.083 0.917 1
1 855 . 16 1 1 A 80 80 THR CA C 80 61.300 60.504 0.796 1
1 856 . 16 1 1 A 80 80 THR CB C 80 70.500 71.920 -1.420 1
1 858 . 16 1 1 A 80 80 THR N N 80 113.200 116.832 -3.632 1
1 859 . 16 1 1 A 81 81 LEU H H 81 8.610 8.959 -0.349 1
1 860 . 16 1 1 A 81 81 LEU HA H 81 4.230 4.079 0.151 1
1 870 . 16 1 1 A 81 81 LEU C C 81 177.400 178.444 -1.044 1
1 871 . 16 1 1 A 81 81 LEU CA C 81 57.700 57.366 0.334 1
1 872 . 16 1 1 A 81 81 LEU CB C 81 42.400 41.549 0.851 1
1 876 . 16 1 1 A 81 81 LEU N N 81 120.900 122.169 -1.269 1
1 877 . 16 1 1 A 82 82 ASP H H 82 8.850 7.863 0.987 1
1 878 . 16 1 1 A 82 82 ASP HA H 82 4.670 4.612 0.058 1
1 881 . 16 1 1 A 82 82 ASP C C 82 174.100 176.237 -2.137 1
1 882 . 16 1 1 A 82 82 ASP CA C 82 52.700 54.174 -1.474 1
1 883 . 16 1 1 A 82 82 ASP CB C 82 37.900 40.908 -3.008 1
1 884 . 16 1 1 A 82 82 ASP N N 82 112.300 118.260 -5.960 1
1 885 . 16 1 1 A 83 83 ASN H H 83 7.790 8.053 -0.263 1
1 886 . 16 1 1 A 83 83 ASN HA H 83 4.270 4.348 -0.078 1
1 891 . 16 1 1 A 83 83 ASN C C 83 176.100 174.138 1.962 1
1 892 . 16 1 1 A 83 83 ASN CA C 83 55.300 54.572 0.728 1
1 893 . 16 1 1 A 83 83 ASN CB C 83 36.900 38.184 -1.284 1
1 894 . 16 1 1 A 83 83 ASN N N 83 113.000 116.620 -3.620 1
1 896 . 16 1 1 A 84 84 VAL H H 84 7.660 7.792 -0.132 1
1 897 . 16 1 1 A 84 84 VAL HA H 84 4.270 4.091 0.179 1
1 905 . 16 1 1 A 84 84 VAL C C 84 175.800 175.060 0.740 1
1 906 . 16 1 1 A 84 84 VAL CA C 84 61.500 62.858 -1.358 1
1 907 . 16 1 1 A 84 84 VAL CB C 84 33.500 31.653 1.847 1
1 910 . 16 1 1 A 84 84 VAL N N 84 119.700 120.851 -1.151 1
1 911 . 16 1 1 A 85 85 ARG H H 85 8.180 8.479 -0.299 1
1 912 . 16 1 1 A 85 85 ARG HA H 85 4.870 4.614 0.256 1
1 920 . 16 1 1 A 85 85 ARG C C 85 174.000 174.896 -0.896 1
1 921 . 16 1 1 A 85 85 ARG CA C 85 55.700 55.594 0.106 1
1 922 . 16 1 1 A 85 85 ARG CB C 85 32.600 30.523 2.077 1
1 925 . 16 1 1 A 85 85 ARG N N 85 124.800 127.635 -2.835 1
1 927 . 16 1 1 A 86 86 VAL H H 86 8.570 8.246 0.324 1
1 928 . 16 1 1 A 86 86 VAL HA H 86 4.580 4.401 0.179 1
1 936 . 16 1 1 A 86 86 VAL C C 86 175.700 175.053 0.647 1
1 937 . 16 1 1 A 86 86 VAL CA C 86 61.700 62.294 -0.594 1
1 938 . 16 1 1 A 86 86 VAL CB C 86 30.900 30.736 0.164 1
1 941 . 16 1 1 A 86 86 VAL N N 86 127.300 125.635 1.665 1
1 942 . 16 1 1 A 87 87 VAL H H 87 8.790 8.844 -0.054 1
1 943 . 16 1 1 A 87 87 VAL HA H 87 5.010 4.746 0.264 1
1 951 . 16 1 1 A 87 87 VAL C C 87 175.500 174.717 0.783 1
1 952 . 16 1 1 A 87 87 VAL CA C 87 61.900 60.803 1.097 1
1 953 . 16 1 1 A 87 87 VAL CB C 87 36.300 33.264 3.036 1
1 956 . 16 1 1 A 87 87 VAL N N 87 125.700 128.482 -2.782 1
1 957 . 16 1 1 A 88 88 THR H H 88 8.350 9.137 -0.787 1
1 958 . 16 1 1 A 88 88 THR HA H 88 4.620 4.555 0.065 1
1 964 . 16 1 1 A 88 88 THR C C 88 173.300 172.540 0.760 1
1 965 . 16 1 1 A 88 88 THR CA C 88 61.700 60.632 1.068 1
1 966 . 16 1 1 A 88 88 THR CB C 88 70.400 72.211 -1.811 1
1 968 . 16 1 1 A 88 88 THR N N 88 117.500 121.224 -3.724 1
1 969 . 16 1 1 A 89 89 ASP H H 89 7.700 8.559 -0.859 1
1 970 . 16 1 1 A 89 89 ASP HA H 89 4.480 4.584 -0.104 1
1 973 . 16 1 1 A 89 89 ASP C C 89 175.900 176.999 -1.099 1
1 974 . 16 1 1 A 89 89 ASP CA C 89 55.900 54.617 1.283 1
1 975 . 16 1 1 A 89 89 ASP CB C 89 43.900 42.086 1.814 1
1 976 . 16 1 1 A 89 89 ASP N N 89 120.800 126.030 -5.230 1
1 977 . 16 1 1 A 90 90 TYR H H 90 8.240 9.004 -0.764 1
1 978 . 16 1 1 A 90 90 TYR HA H 90 3.920 4.181 -0.261 1
1 983 . 16 1 1 A 90 90 TYR C C 90 176.400 177.221 -0.821 1
1 984 . 16 1 1 A 90 90 TYR CA C 90 62.300 62.353 -0.053 1
1 985 . 16 1 1 A 90 90 TYR CB C 90 39.500 38.681 0.819 1
1 988 . 16 1 1 A 90 90 TYR N N 90 126.100 128.474 -2.374 1
1 989 . 16 1 1 A 91 91 SER H H 91 9.160 8.271 0.889 1
1 990 . 16 1 1 A 91 91 SER HA H 91 4.000 4.062 -0.062 1
1 993 . 16 1 1 A 91 91 SER C C 91 178.000 176.935 1.065 1
1 994 . 16 1 1 A 91 91 SER CA C 91 62.600 61.914 0.686 1
1 995 . 16 1 1 A 91 91 SER CB C 91 62.200 62.715 -0.515 1
1 996 . 16 1 1 A 91 91 SER N N 91 116.600 116.785 -0.185 1
1 997 . 16 1 1 A 92 92 GLU H H 92 8.590 8.242 0.348 1
1 998 . 16 1 1 A 92 92 GLU HA H 92 4.050 4.112 -0.062 1
1 1003 . 16 1 1 A 92 92 GLU C C 92 179.400 178.666 0.734 1
1 1004 . 16 1 1 A 92 92 GLU CA C 92 58.900 58.743 0.157 1
1 1005 . 16 1 1 A 92 92 GLU CB C 92 30.600 29.500 1.100 1
1 1007 . 16 1 1 A 92 92 GLU N N 92 120.200 121.598 -1.398 1
1 1008 . 16 1 1 A 93 93 PHE H H 93 7.870 8.035 -0.165 1
1 1009 . 16 1 1 A 93 93 PHE HA H 93 4.050 4.113 -0.063 1
1 1015 . 16 1 1 A 93 93 PHE C C 93 176.500 177.987 -1.487 1
1 1016 . 16 1 1 A 93 93 PHE CA C 93 62.200 61.017 1.183 1
1 1017 . 16 1 1 A 93 93 PHE CB C 93 39.700 39.108 0.592 1
1 1021 . 16 1 1 A 93 93 PHE N N 93 120.200 122.284 -2.084 1
1 1022 . 16 1 1 A 94 94 GLN H H 94 8.190 8.215 -0.025 1
1 1023 . 16 1 1 A 94 94 GLN HA H 94 3.390 3.620 -0.230 1
1 1030 . 16 1 1 A 94 94 GLN C C 94 178.600 178.168 0.432 1
1 1031 . 16 1 1 A 94 94 GLN CA C 94 58.800 58.815 -0.015 1
1 1032 . 16 1 1 A 94 94 GLN CB C 94 28.400 27.927 0.473 1
1 1034 . 16 1 1 A 94 94 GLN N N 94 116.800 118.440 -1.640 1
1 1036 . 16 1 1 A 95 95 LYS H H 95 7.060 7.897 -0.837 1
1 1037 . 16 1 1 A 95 95 LYS HA H 95 3.780 3.977 -0.197 1
1 1046 . 16 1 1 A 95 95 LYS C C 95 179.300 179.228 0.072 1
1 1047 . 16 1 1 A 95 95 LYS CA C 95 59.900 59.150 0.750 1
1 1048 . 16 1 1 A 95 95 LYS CB C 95 32.700 32.209 0.491 1
1 1052 . 16 1 1 A 95 95 LYS N N 95 117.500 120.783 -3.283 1
1 1053 . 16 1 1 A 96 96 ILE H H 96 7.240 7.490 -0.250 1
1 1054 . 16 1 1 A 96 96 ILE HA H 96 3.420 3.484 -0.064 1
1 1064 . 16 1 1 A 96 96 ILE C C 96 177.800 178.258 -0.458 1
1 1065 . 16 1 1 A 96 96 ILE CA C 96 64.300 64.682 -0.382 1
1 1066 . 16 1 1 A 96 96 ILE CB C 96 37.400 36.941 0.459 1
1 1070 . 16 1 1 A 96 96 ILE N N 96 120.700 119.319 1.381 1
1 1071 . 16 1 1 A 97 97 LEU H H 97 7.690 7.800 -0.110 1
1 1072 . 16 1 1 A 97 97 LEU HA H 97 3.580 3.798 -0.218 1
1 1082 . 16 1 1 A 97 97 LEU C C 97 179.900 179.213 0.687 1
1 1083 . 16 1 1 A 97 97 LEU CA C 97 58.100 57.799 0.301 1
1 1084 . 16 1 1 A 97 97 LEU CB C 97 41.500 40.932 0.568 1
1 1088 . 16 1 1 A 97 97 LEU N N 97 120.000 120.572 -0.572 1
1 1089 . 16 1 1 A 98 98 LYS H H 98 7.510 7.982 -0.472 1
1 1090 . 16 1 1 A 98 98 LYS HA H 98 3.950 3.942 0.008 1
1 1099 . 16 1 1 A 98 98 LYS C C 98 178.700 179.202 -0.502 1
1 1100 . 16 1 1 A 98 98 LYS CA C 98 58.700 59.790 -1.090 1
1 1101 . 16 1 1 A 98 98 LYS CB C 98 32.500 32.074 0.426 1
1 1105 . 16 1 1 A 98 98 LYS N N 98 117.300 118.453 -1.153 1
1 1106 . 16 1 1 A 99 99 LYS H H 99 7.470 8.202 -0.732 1
1 1107 . 16 1 1 A 99 99 LYS HA H 99 4.080 3.920 0.160 1
1 1116 . 16 1 1 A 99 99 LYS C C 99 178.100 179.302 -1.202 1
1 1117 . 16 1 1 A 99 99 LYS CA C 99 58.400 59.650 -1.250 1
1 1118 . 16 1 1 A 99 99 LYS CB C 99 33.000 32.523 0.477 1
1 1122 . 16 1 1 A 99 99 LYS N N 99 119.000 120.936 -1.936 1
1 1123 . 16 1 1 A 100 100 ARG H H 100 8.020 7.883 0.137 1
1 1124 . 16 1 1 A 100 100 ARG HA H 100 4.210 4.220 -0.010 1
1 1131 . 16 1 1 A 100 100 ARG C C 100 177.500 176.937 0.563 1
1 1132 . 16 1 1 A 100 100 ARG CA C 100 56.700 55.624 1.076 1
1 1133 . 16 1 1 A 100 100 ARG CB C 100 30.500 30.977 -0.477 1
1 1136 . 16 1 1 A 100 100 ARG N N 100 117.300 115.770 1.530 1
1 1137 . 16 1 1 A 101 101 GLY H H 101 7.910 7.712 0.198 1
1 1138 . 16 1 1 A 101 101 GLY HA2 H 101 3.980 3.962 0.018 1
1 1139 . 16 1 1 A 101 101 GLY HA3 H 101 4.020 3.975 0.045 1
1 1140 . 16 1 1 A 101 101 GLY C C 101 174.400 174.752 -0.352 1
1 1141 . 16 1 1 A 101 101 GLY CA C 101 46.000 45.617 0.383 1
1 1142 . 16 1 1 A 101 101 GLY N N 101 108.000 108.242 -0.242 1
1 1143 . 16 1 1 A 102 102 THR H H 102 7.880 8.217 -0.337 1
1 1144 . 16 1 1 A 102 102 THR HA H 102 4.360 4.531 -0.171 1
1 1149 . 16 1 1 A 102 102 THR C C 102 174.400 173.941 0.459 1
1 1150 . 16 1 1 A 102 102 THR CA C 102 62.100 63.386 -1.286 1
1 1151 . 16 1 1 A 102 102 THR CB C 102 70.500 71.311 -0.811 1
1 1153 . 16 1 1 A 102 102 THR N N 102 113.900 113.531 0.369 1
1 1154 . 16 1 1 A 103 103 LYS H H 103 8.440 7.919 0.521 1
1 1155 . 16 1 1 A 103 103 LYS C C 103 176.400 175.131 1.269 1
1 1156 . 16 1 1 A 103 103 LYS CA C 103 56.600 55.319 1.281 1
1 1157 . 16 1 1 A 103 103 LYS CB C 103 33.300 33.887 -0.587 1
1 1158 . 16 1 1 A 103 103 LYS N N 103 124.000 118.087 5.913 1
1 1159 . 16 1 1 A 104 104 LEU H H 104 8.180 8.878 -0.698 1
1 1160 . 16 1 1 A 104 104 LEU HA H 104 4.270 4.613 -0.343 1
1 1170 . 16 1 1 A 104 104 LEU C C 104 177.100 177.080 0.020 1
1 1171 . 16 1 1 A 104 104 LEU CA C 104 55.500 53.936 1.564 1
1 1172 . 16 1 1 A 104 104 LEU CB C 104 42.500 42.359 0.141 1
1 1176 . 16 1 1 A 104 104 LEU N N 104 123.500 126.201 -2.701 1
1 1177 . 16 1 1 A 105 105 GLU H H 105 8.270 8.491 -0.221 1
1 1178 . 16 1 1 A 105 105 GLU CA C 105 56.700 56.657 0.043 1
1 1179 . 16 1 1 A 105 105 GLU CB C 105 30.800 30.747 0.053 1
1 13 . 17 1 1 A 2 2 ASN HA H 2 4.980 5.045 -0.065 1
1 18 . 17 1 1 A 2 2 ASN C C 2 176.300 176.737 -0.437 1
1 19 . 17 1 1 A 2 2 ASN CA C 2 52.500 52.270 0.230 1
1 20 . 17 1 1 A 2 2 ASN CB C 2 40.900 39.729 1.171 1
1 22 . 17 1 1 A 3 3 SER H H 3 9.940 9.449 0.491 1
1 23 . 17 1 1 A 3 3 SER HA H 3 3.720 4.136 -0.416 1
1 26 . 17 1 1 A 3 3 SER C C 3 175.900 176.529 -0.629 1
1 27 . 17 1 1 A 3 3 SER CA C 3 63.300 61.740 1.560 1
1 28 . 17 1 1 A 3 3 SER CB C 3 61.700 62.993 -1.293 1
1 29 . 17 1 1 A 3 3 SER N N 3 118.200 115.639 2.561 1
1 30 . 17 1 1 A 4 4 GLU H H 4 8.450 8.165 0.285 1
1 31 . 17 1 1 A 4 4 GLU HA H 4 4.010 4.081 -0.071 1
1 36 . 17 1 1 A 4 4 GLU C C 4 178.800 178.982 -0.182 1
1 37 . 17 1 1 A 4 4 GLU CA C 4 60.300 59.178 1.122 1
1 38 . 17 1 1 A 4 4 GLU CB C 4 29.100 29.382 -0.282 1
1 40 . 17 1 1 A 4 4 GLU N N 4 123.600 122.035 1.565 1
1 41 . 17 1 1 A 5 5 VAL H H 5 7.590 7.620 -0.030 1
1 42 . 17 1 1 A 5 5 VAL HA H 5 3.850 3.674 0.176 1
1 50 . 17 1 1 A 5 5 VAL C C 5 179.100 178.485 0.615 1
1 51 . 17 1 1 A 5 5 VAL CA C 5 65.800 66.246 -0.446 1
1 52 . 17 1 1 A 5 5 VAL CB C 5 32.300 31.500 0.800 1
1 55 . 17 1 1 A 5 5 VAL N N 5 119.300 119.643 -0.343 1
1 56 . 17 1 1 A 6 6 ILE H H 6 7.240 8.374 -1.134 1
1 57 . 17 1 1 A 6 6 ILE HA H 6 3.580 3.590 -0.010 1
1 67 . 17 1 1 A 6 6 ILE C C 6 177.000 177.727 -0.727 1
1 68 . 17 1 1 A 6 6 ILE CA C 6 65.300 65.712 -0.412 1
1 69 . 17 1 1 A 6 6 ILE CB C 6 37.900 37.789 0.111 1
1 73 . 17 1 1 A 6 6 ILE N N 6 120.300 121.031 -0.731 1
1 74 . 17 1 1 A 7 7 LYS H H 7 8.050 8.014 0.036 1
1 75 . 17 1 1 A 7 7 LYS HA H 7 3.570 3.900 -0.330 1
1 84 . 17 1 1 A 7 7 LYS C C 7 178.700 180.039 -1.339 1
1 85 . 17 1 1 A 7 7 LYS CA C 7 61.300 60.427 0.873 1
1 86 . 17 1 1 A 7 7 LYS CB C 7 32.200 32.040 0.160 1
1 90 . 17 1 1 A 7 7 LYS N N 7 119.200 118.669 0.531 1
1 91 . 17 1 1 A 8 8 GLU H H 8 8.100 8.017 0.083 1
1 92 . 17 1 1 A 8 8 GLU HA H 8 4.000 4.084 -0.084 1
1 97 . 17 1 1 A 8 8 GLU C C 8 178.500 179.166 -0.666 1
1 98 . 17 1 1 A 8 8 GLU CA C 8 59.700 59.567 0.133 1
1 99 . 17 1 1 A 8 8 GLU CB C 8 29.600 29.675 -0.075 1
1 101 . 17 1 1 A 8 8 GLU N N 8 119.400 120.370 -0.970 1
1 102 . 17 1 1 A 9 9 PHE H H 9 7.720 7.880 -0.160 1
1 103 . 17 1 1 A 9 9 PHE HA H 9 4.160 4.091 0.069 1
1 109 . 17 1 1 A 9 9 PHE C C 9 176.900 177.225 -0.325 1
1 110 . 17 1 1 A 9 9 PHE CA C 9 61.300 61.221 0.079 1
1 111 . 17 1 1 A 9 9 PHE CB C 9 39.400 39.232 0.168 1
1 115 . 17 1 1 A 9 9 PHE N N 9 121.300 121.946 -0.646 1
1 116 . 17 1 1 A 10 10 LEU H H 10 8.060 8.488 -0.428 1
1 117 . 17 1 1 A 10 10 LEU HA H 10 3.660 3.815 -0.155 1
1 127 . 17 1 1 A 10 10 LEU C C 10 179.000 179.233 -0.233 1
1 128 . 17 1 1 A 10 10 LEU CA C 10 58.000 57.904 0.096 1
1 129 . 17 1 1 A 10 10 LEU CB C 10 41.400 41.473 -0.073 1
1 133 . 17 1 1 A 10 10 LEU N N 10 118.000 119.273 -1.273 1
1 134 . 17 1 1 A 11 11 GLU H H 11 7.990 8.673 -0.683 1
1 135 . 17 1 1 A 11 11 GLU HA H 11 4.110 4.027 0.083 1
1 140 . 17 1 1 A 11 11 GLU C C 11 174.200 178.247 -4.047 1
1 141 . 17 1 1 A 11 11 GLU CA C 11 59.200 59.275 -0.075 1
1 142 . 17 1 1 A 11 11 GLU CB C 11 29.300 29.236 0.064 1
1 144 . 17 1 1 A 11 11 GLU N N 11 118.300 119.707 -1.407 1
1 145 . 17 1 1 A 12 12 ASP H H 12 8.080 8.018 0.062 1
1 146 . 17 1 1 A 12 12 ASP HA H 12 4.340 4.323 0.017 1
1 149 . 17 1 1 A 12 12 ASP C C 12 178.900 178.045 0.855 1
1 150 . 17 1 1 A 12 12 ASP CA C 12 57.600 57.915 -0.315 1
1 151 . 17 1 1 A 12 12 ASP CB C 12 41.000 41.334 -0.334 1
1 152 . 17 1 1 A 12 12 ASP N N 12 121.800 120.321 1.479 1
1 153 . 17 1 1 A 13 13 ILE H H 13 7.610 7.365 0.245 1
1 154 . 17 1 1 A 13 13 ILE HA H 13 4.240 4.000 0.240 1
1 164 . 17 1 1 A 13 13 ILE C C 13 176.800 176.610 0.190 1
1 165 . 17 1 1 A 13 13 ILE CA C 13 62.100 61.183 0.917 1
1 166 . 17 1 1 A 13 13 ILE CB C 13 38.300 38.081 0.219 1
1 170 . 17 1 1 A 13 13 ILE N N 13 110.800 111.902 -1.102 1
1 171 . 17 1 1 A 14 14 GLY H H 14 7.640 7.650 -0.010 1
1 172 . 17 1 1 A 14 14 GLY HA2 H 14 3.810 3.922 -0.112 1
1 173 . 17 1 1 A 14 14 GLY HA3 H 14 3.880 3.930 -0.050 1
1 174 . 17 1 1 A 14 14 GLY C C 14 175.200 174.618 0.582 1
1 175 . 17 1 1 A 14 14 GLY CA C 14 46.900 46.237 0.663 1
1 176 . 17 1 1 A 14 14 GLY N N 14 111.800 112.079 -0.279 1
1 177 . 17 1 1 A 15 15 GLU H H 15 7.870 8.346 -0.476 1
1 178 . 17 1 1 A 15 15 GLU HA H 15 4.680 4.616 0.064 1
1 183 . 17 1 1 A 15 15 GLU C C 15 175.100 174.718 0.382 1
1 184 . 17 1 1 A 15 15 GLU CA C 15 54.800 55.376 -0.576 1
1 185 . 17 1 1 A 15 15 GLU CB C 15 32.200 30.889 1.311 1
1 187 . 17 1 1 A 15 15 GLU N N 15 119.200 121.052 -1.852 1
1 188 . 17 1 1 A 16 16 ASP H H 16 8.220 8.859 -0.639 1
1 189 . 17 1 1 A 16 16 ASP HA H 16 4.680 4.945 -0.265 1
1 192 . 17 1 1 A 16 16 ASP C C 16 174.600 175.045 -0.445 1
1 193 . 17 1 1 A 16 16 ASP CA C 16 53.600 52.697 0.903 1
1 194 . 17 1 1 A 16 16 ASP CB C 16 42.900 41.541 1.359 1
1 195 . 17 1 1 A 16 16 ASP N N 16 120.600 128.515 -7.915 1
1 196 . 17 1 1 A 17 17 TYR H H 17 7.540 8.623 -1.083 1
1 197 . 17 1 1 A 17 17 TYR HA H 17 4.910 5.451 -0.541 1
1 202 . 17 1 1 A 17 17 TYR C C 17 173.600 175.001 -1.401 1
1 203 . 17 1 1 A 17 17 TYR CA C 17 56.200 55.530 0.670 1
1 204 . 17 1 1 A 17 17 TYR CB C 17 41.100 41.682 -0.582 1
1 207 . 17 1 1 A 17 17 TYR N N 17 112.700 124.654 -11.954 1
1 208 . 17 1 1 A 18 18 ILE H H 18 7.950 8.787 -0.837 1
1 209 . 17 1 1 A 18 18 ILE HA H 18 4.330 4.583 -0.253 1
1 219 . 17 1 1 A 18 18 ILE C C 18 174.700 174.854 -0.154 1
1 220 . 17 1 1 A 18 18 ILE CA C 18 60.300 60.903 -0.603 1
1 221 . 17 1 1 A 18 18 ILE CB C 18 41.000 37.665 3.335 1
1 225 . 17 1 1 A 18 18 ILE N N 18 120.400 121.528 -1.128 1
1 226 . 17 1 1 A 19 19 GLU H H 19 8.760 8.926 -0.166 1
1 227 . 17 1 1 A 19 19 GLU HA H 19 5.200 5.146 0.054 1
1 232 . 17 1 1 A 19 19 GLU C C 19 175.200 175.534 -0.334 1
1 233 . 17 1 1 A 19 19 GLU CA C 19 55.500 55.741 -0.241 1
1 234 . 17 1 1 A 19 19 GLU CB C 19 32.400 31.212 1.188 1
1 236 . 17 1 1 A 19 19 GLU N N 19 129.000 128.716 0.284 1
1 237 . 17 1 1 A 20 20 LEU H H 20 8.730 9.347 -0.617 1
1 238 . 17 1 1 A 20 20 LEU HA H 20 4.620 5.029 -0.409 1
1 248 . 17 1 1 A 20 20 LEU C C 20 176.200 175.362 0.838 1
1 249 . 17 1 1 A 20 20 LEU CA C 20 54.100 52.613 1.487 1
1 250 . 17 1 1 A 20 20 LEU CB C 20 44.400 45.155 -0.755 1
1 254 . 17 1 1 A 20 20 LEU N N 20 128.400 127.158 1.242 1
1 255 . 17 1 1 A 21 21 GLU H H 21 8.700 8.791 -0.091 1
1 256 . 17 1 1 A 21 21 GLU HA H 21 3.870 3.950 -0.080 1
1 261 . 17 1 1 A 21 21 GLU C C 21 176.100 176.966 -0.866 1
1 262 . 17 1 1 A 21 21 GLU CA C 21 58.800 57.569 1.231 1
1 263 . 17 1 1 A 21 21 GLU CB C 21 28.200 29.197 -0.997 1
1 265 . 17 1 1 A 21 21 GLU N N 21 122.600 122.310 0.290 1
1 266 . 17 1 1 A 22 22 ASN H H 22 8.640 8.982 -0.342 1
1 267 . 17 1 1 A 22 22 ASN HA H 22 4.540 4.354 0.186 1
1 272 . 17 1 1 A 22 22 ASN C C 22 173.800 173.955 -0.155 1
1 273 . 17 1 1 A 22 22 ASN CA C 22 54.600 54.659 -0.059 1
1 274 . 17 1 1 A 22 22 ASN CB C 22 38.400 36.952 1.448 1
1 275 . 17 1 1 A 22 22 ASN N N 22 118.000 119.909 -1.909 1
1 277 . 17 1 1 A 23 23 GLU H H 23 7.740 7.717 0.023 1
1 278 . 17 1 1 A 23 23 GLU HA H 23 5.430 5.032 0.398 1
1 283 . 17 1 1 A 23 23 GLU C C 23 175.400 174.899 0.501 1
1 284 . 17 1 1 A 23 23 GLU CA C 23 54.900 54.779 0.121 1
1 285 . 17 1 1 A 23 23 GLU CB C 23 34.500 32.530 1.970 1
1 287 . 17 1 1 A 23 23 GLU N N 23 116.400 117.501 -1.101 1
1 288 . 17 1 1 A 24 24 ILE H H 24 9.050 9.202 -0.152 1
1 289 . 17 1 1 A 24 24 ILE HA H 24 4.810 4.771 0.039 1
1 299 . 17 1 1 A 24 24 ILE C C 24 174.600 174.450 0.150 1
1 300 . 17 1 1 A 24 24 ILE CA C 24 60.700 60.408 0.292 1
1 301 . 17 1 1 A 24 24 ILE CB C 24 41.300 39.397 1.903 1
1 305 . 17 1 1 A 24 24 ILE N N 24 122.800 123.727 -0.927 1
1 306 . 17 1 1 A 25 25 HIS H H 25 9.490 9.473 0.017 1
1 307 . 17 1 1 A 25 25 HIS HA H 25 5.090 5.477 -0.387 1
1 312 . 17 1 1 A 25 25 HIS C C 25 176.100 174.523 1.577 1
1 313 . 17 1 1 A 25 25 HIS CA C 25 56.100 55.172 0.928 1
1 314 . 17 1 1 A 25 25 HIS CB C 25 33.100 30.459 2.641 1
1 317 . 17 1 1 A 25 25 HIS N N 25 127.300 126.457 0.843 1
1 318 . 17 1 1 A 26 26 LEU H H 26 8.820 8.820 0.000 1
1 319 . 17 1 1 A 26 26 LEU HA H 26 5.160 5.094 0.066 1
1 329 . 17 1 1 A 26 26 LEU C C 26 178.000 176.808 1.192 1
1 330 . 17 1 1 A 26 26 LEU CA C 26 52.900 53.346 -0.446 1
1 331 . 17 1 1 A 26 26 LEU CB C 26 48.100 44.889 3.211 1
1 335 . 17 1 1 A 26 26 LEU N N 26 121.600 125.704 -4.104 1
1 336 . 17 1 1 A 27 27 LYS H H 27 8.990 8.823 0.167 1
1 337 . 17 1 1 A 27 27 LYS HA H 27 4.630 4.351 0.279 1
1 345 . 17 1 1 A 27 27 LYS CA C 27 55.700 55.005 0.695 1
1 346 . 17 1 1 A 27 27 LYS CB C 27 31.900 32.133 -0.233 1
1 350 . 17 1 1 A 27 27 LYS N N 27 125.900 121.508 4.392 1
1 351 . 17 1 1 A 28 28 PRO HA H 28 4.500 4.420 0.080 1
1 358 . 17 1 1 A 28 28 PRO C C 28 177.900 179.274 -1.374 1
1 359 . 17 1 1 A 28 28 PRO CA C 28 67.400 65.639 1.761 1
1 360 . 17 1 1 A 28 28 PRO CB C 28 32.100 32.161 -0.061 1
1 363 . 17 1 1 A 29 29 GLU H H 29 9.880 8.340 1.540 1
1 364 . 17 1 1 A 29 29 GLU HA H 29 4.140 4.202 -0.062 1
1 369 . 17 1 1 A 29 29 GLU C C 29 178.800 179.820 -1.020 1
1 370 . 17 1 1 A 29 29 GLU CA C 29 60.600 59.886 0.714 1
1 371 . 17 1 1 A 29 29 GLU CB C 29 29.200 29.219 -0.019 1
1 373 . 17 1 1 A 29 29 GLU N N 29 117.100 118.013 -0.913 1
1 374 . 17 1 1 A 30 30 VAL H H 30 7.050 8.289 -1.239 1
1 375 . 17 1 1 A 30 30 VAL HA H 30 3.850 3.800 0.050 1
1 383 . 17 1 1 A 30 30 VAL C C 30 177.700 178.560 -0.860 1
1 384 . 17 1 1 A 30 30 VAL CA C 30 65.600 66.141 -0.541 1
1 385 . 17 1 1 A 30 30 VAL CB C 30 32.100 31.958 0.142 1
1 388 . 17 1 1 A 30 30 VAL N N 30 120.900 120.804 0.096 1
1 389 . 17 1 1 A 31 31 PHE H H 31 8.980 8.823 0.157 1
1 390 . 17 1 1 A 31 31 PHE HA H 31 3.870 4.229 -0.359 1
1 394 . 17 1 1 A 31 31 PHE C C 31 176.700 177.066 -0.366 1
1 395 . 17 1 1 A 31 31 PHE CA C 31 62.200 61.966 0.234 1
1 396 . 17 1 1 A 31 31 PHE CB C 31 39.300 38.865 0.435 1
1 398 . 17 1 1 A 31 31 PHE N N 31 121.100 120.819 0.281 1
1 399 . 17 1 1 A 32 32 TYR H H 32 8.640 8.548 0.092 1
1 400 . 17 1 1 A 32 32 TYR HA H 32 3.880 4.605 -0.725 1
1 405 . 17 1 1 A 32 32 TYR C C 32 176.000 177.949 -1.949 1
1 406 . 17 1 1 A 32 32 TYR CA C 32 63.300 62.043 1.257 1
1 407 . 17 1 1 A 32 32 TYR CB C 32 39.100 39.143 -0.043 1
1 410 . 17 1 1 A 32 32 TYR N N 32 117.400 120.790 -3.390 1
1 411 . 17 1 1 A 33 33 GLU H H 33 7.400 8.374 -0.974 1
1 412 . 17 1 1 A 33 33 GLU HA H 33 4.050 4.191 -0.141 1
1 417 . 17 1 1 A 33 33 GLU C C 33 180.200 177.677 2.523 1
1 418 . 17 1 1 A 33 33 GLU CA C 33 59.500 58.432 1.068 1
1 419 . 17 1 1 A 33 33 GLU CB C 33 29.300 29.562 -0.262 1
1 421 . 17 1 1 A 33 33 GLU N N 33 116.100 118.628 -2.528 1
1 422 . 17 1 1 A 34 34 VAL H H 34 8.530 7.393 1.137 1
1 423 . 17 1 1 A 34 34 VAL HA H 34 3.350 3.432 -0.082 1
1 431 . 17 1 1 A 34 34 VAL C C 34 175.800 177.657 -1.857 1
1 432 . 17 1 1 A 34 34 VAL CA C 34 66.400 64.892 1.508 1
1 433 . 17 1 1 A 34 34 VAL CB C 34 32.200 31.840 0.360 1
1 436 . 17 1 1 A 34 34 VAL N N 34 120.600 118.450 2.150 1
1 437 . 17 1 1 A 35 35 TRP H H 35 9.100 8.351 0.749 1
1 438 . 17 1 1 A 35 35 TRP HA H 35 3.340 3.679 -0.339 1
1 447 . 17 1 1 A 35 35 TRP C C 35 178.000 178.297 -0.297 1
1 448 . 17 1 1 A 35 35 TRP CA C 35 61.800 60.765 1.035 1
1 449 . 17 1 1 A 35 35 TRP CB C 35 27.900 29.493 -1.593 1
1 455 . 17 1 1 A 35 35 TRP N N 35 121.700 121.537 0.163 1
1 457 . 17 1 1 A 36 36 LYS H H 36 7.970 7.851 0.119 1
1 458 . 17 1 1 A 36 36 LYS HA H 36 3.330 3.626 -0.296 1
1 467 . 17 1 1 A 36 36 LYS C C 36 180.000 178.344 1.656 1
1 468 . 17 1 1 A 36 36 LYS CA C 36 59.000 58.383 0.617 1
1 469 . 17 1 1 A 36 36 LYS CB C 36 31.800 31.615 0.185 1
1 473 . 17 1 1 A 36 36 LYS N N 36 116.300 119.076 -2.776 1
1 474 . 17 1 1 A 37 37 TYR H H 37 7.750 7.876 -0.126 1
1 475 . 17 1 1 A 37 37 TYR HA H 37 3.940 3.996 -0.056 1
1 480 . 17 1 1 A 37 37 TYR C C 37 177.600 177.587 0.013 1
1 481 . 17 1 1 A 37 37 TYR CA C 37 61.200 60.977 0.223 1
1 482 . 17 1 1 A 37 37 TYR CB C 37 38.800 38.499 0.301 1
1 485 . 17 1 1 A 37 37 TYR N N 37 122.700 120.612 2.088 1
1 486 . 17 1 1 A 38 38 VAL H H 38 7.660 7.236 0.424 1
1 487 . 17 1 1 A 38 38 VAL HA H 38 3.870 3.880 -0.010 1
1 495 . 17 1 1 A 38 38 VAL C C 38 175.600 175.707 -0.107 1
1 496 . 17 1 1 A 38 38 VAL CA C 38 61.100 61.292 -0.192 1
1 497 . 17 1 1 A 38 38 VAL CB C 38 30.700 31.858 -1.158 1
1 500 . 17 1 1 A 38 38 VAL N N 38 108.200 113.849 -5.649 1
1 501 . 17 1 1 A 39 39 GLY H H 39 7.090 7.377 -0.287 1
1 502 . 17 1 1 A 39 39 GLY HA2 H 39 3.320 3.824 -0.504 1
1 503 . 17 1 1 A 39 39 GLY HA3 H 39 3.730 3.837 -0.107 1
1 504 . 17 1 1 A 39 39 GLY C C 39 173.600 172.113 1.487 1
1 505 . 17 1 1 A 39 39 GLY CA C 39 46.100 45.437 0.663 1
1 506 . 17 1 1 A 39 39 GLY N N 39 107.600 110.012 -2.412 1
1 507 . 17 1 1 A 40 40 GLU H H 40 7.730 7.840 -0.110 1
1 508 . 17 1 1 A 40 40 GLU HA H 40 1.090 3.208 -2.118 1
1 513 . 17 1 1 A 40 40 GLU CA C 40 55.700 53.403 2.297 1
1 514 . 17 1 1 A 40 40 GLU CB C 40 27.200 28.921 -1.721 1
1 516 . 17 1 1 A 40 40 GLU N N 40 114.400 119.302 -4.902 1
1 517 . 17 1 1 A 41 41 PRO HA H 41 4.310 4.347 -0.037 1
1 524 . 17 1 1 A 41 41 PRO CA C 41 62.300 63.208 -0.908 1
1 525 . 17 1 1 A 41 41 PRO CB C 41 32.700 31.652 1.048 1
1 528 . 17 1 1 A 42 42 GLU H H 42 8.110 8.449 -0.339 1
1 529 . 17 1 1 A 42 42 GLU C C 42 175.800 176.376 -0.576 1
1 530 . 17 1 1 A 42 42 GLU CA C 42 57.800 56.760 1.040 1
1 531 . 17 1 1 A 42 42 GLU CB C 42 30.600 29.794 0.806 1
1 533 . 17 1 1 A 42 42 GLU N N 42 119.100 123.082 -3.982 1
1 534 . 17 1 1 A 43 43 LEU H H 43 8.140 8.777 -0.637 1
1 535 . 17 1 1 A 43 43 LEU HA H 43 4.840 4.613 0.227 1
1 545 . 17 1 1 A 43 43 LEU C C 43 177.300 176.385 0.915 1
1 546 . 17 1 1 A 43 43 LEU CA C 43 53.700 54.273 -0.573 1
1 547 . 17 1 1 A 43 43 LEU CB C 43 43.900 41.906 1.994 1
1 551 . 17 1 1 A 43 43 LEU N N 43 124.700 127.634 -2.934 1
1 552 . 17 1 1 A 44 44 LYS H H 44 8.640 8.461 0.179 1
1 553 . 17 1 1 A 44 44 LYS HA H 44 4.500 4.605 -0.105 1
1 562 . 17 1 1 A 44 44 LYS C C 44 174.500 175.949 -1.449 1
1 563 . 17 1 1 A 44 44 LYS CA C 44 54.700 55.661 -0.961 1
1 564 . 17 1 1 A 44 44 LYS CB C 44 36.200 33.610 2.590 1
1 568 . 17 1 1 A 44 44 LYS N N 44 123.300 124.033 -0.733 1
1 569 . 17 1 1 A 45 45 THR H H 45 7.990 8.801 -0.811 1
1 570 . 17 1 1 A 45 45 THR HA H 45 5.700 5.581 0.119 1
1 575 . 17 1 1 A 45 45 THR C C 45 175.100 173.950 1.150 1
1 576 . 17 1 1 A 45 45 THR CA C 45 59.600 59.373 0.227 1
1 577 . 17 1 1 A 45 45 THR CB C 45 73.400 71.732 1.668 1
1 579 . 17 1 1 A 45 45 THR N N 45 106.900 113.736 -6.836 1
1 580 . 17 1 1 A 46 46 TYR H H 46 8.470 9.043 -0.573 1
1 581 . 17 1 1 A 46 46 TYR HA H 46 4.930 5.689 -0.759 1
1 586 . 17 1 1 A 46 46 TYR C C 46 172.400 173.119 -0.719 1
1 587 . 17 1 1 A 46 46 TYR CA C 46 57.100 55.396 1.704 1
1 588 . 17 1 1 A 46 46 TYR CB C 46 40.200 42.174 -1.974 1
1 591 . 17 1 1 A 46 46 TYR N N 46 117.100 118.923 -1.823 1
1 592 . 17 1 1 A 47 47 VAL H H 47 8.430 8.856 -0.426 1
1 593 . 17 1 1 A 47 47 VAL HA H 47 4.890 4.451 0.439 1
1 601 . 17 1 1 A 47 47 VAL C C 47 175.800 174.216 1.584 1
1 602 . 17 1 1 A 47 47 VAL CA C 47 60.800 62.316 -1.516 1
1 603 . 17 1 1 A 47 47 VAL CB C 47 34.800 32.174 2.626 1
1 606 . 17 1 1 A 47 47 VAL N N 47 119.200 121.769 -2.569 1
1 607 . 17 1 1 A 48 48 ILE H H 48 8.680 9.104 -0.424 1
1 608 . 17 1 1 A 48 48 ILE HA H 48 4.560 4.944 -0.384 1
1 618 . 17 1 1 A 48 48 ILE C C 48 174.500 174.346 0.154 1
1 619 . 17 1 1 A 48 48 ILE CA C 48 59.700 59.451 0.249 1
1 620 . 17 1 1 A 48 48 ILE CB C 48 41.500 41.181 0.319 1
1 624 . 17 1 1 A 48 48 ILE N N 48 124.400 129.498 -5.098 1
1 625 . 17 1 1 A 49 49 GLU H H 49 8.320 8.871 -0.551 1
1 626 . 17 1 1 A 49 49 GLU C C 49 175.500 175.464 0.036 1
1 627 . 17 1 1 A 49 49 GLU CA C 49 55.500 56.457 -0.957 1
1 628 . 17 1 1 A 49 49 GLU CB C 49 31.800 30.313 1.487 1
1 630 . 17 1 1 A 49 49 GLU N N 49 123.400 129.018 -5.618 1
1 631 . 17 1 1 A 50 50 ASP H H 50 8.610 9.172 -0.562 1
1 632 . 17 1 1 A 50 50 ASP C C 50 175.100 175.060 0.040 1
1 633 . 17 1 1 A 50 50 ASP CA C 50 53.100 53.360 -0.260 1
1 634 . 17 1 1 A 50 50 ASP CB C 50 44.000 42.477 1.523 1
1 635 . 17 1 1 A 50 50 ASP N N 50 124.300 125.806 -1.506 1
1 636 . 17 1 1 A 51 51 GLU H H 51 8.450 8.814 -0.364 1
1 637 . 17 1 1 A 51 51 GLU C C 51 175.900 176.296 -0.396 1
1 638 . 17 1 1 A 51 51 GLU CA C 51 56.000 55.525 0.475 1
1 639 . 17 1 1 A 51 51 GLU CB C 51 31.700 31.212 0.488 1
1 640 . 17 1 1 A 51 51 GLU N N 51 121.300 125.255 -3.955 1
1 641 . 17 1 1 A 52 52 ILE H H 52 8.480 8.915 -0.435 1
1 642 . 17 1 1 A 52 52 ILE C C 52 175.400 175.302 0.098 1
1 643 . 17 1 1 A 52 52 ILE CA C 52 60.400 61.607 -1.207 1
1 644 . 17 1 1 A 52 52 ILE CB C 52 40.000 37.093 2.907 1
1 645 . 17 1 1 A 52 52 ILE N N 52 122.700 120.316 2.384 1
1 646 . 17 1 1 A 53 53 VAL H H 53 8.140 8.378 -0.238 1
1 647 . 17 1 1 A 53 53 VAL C C 53 175.600 175.347 0.253 1
1 648 . 17 1 1 A 53 53 VAL CA C 53 61.900 62.578 -0.678 1
1 649 . 17 1 1 A 53 53 VAL CB C 53 33.200 32.310 0.890 1
1 650 . 17 1 1 A 53 53 VAL N N 53 124.400 124.995 -0.595 1
1 651 . 17 1 1 A 54 54 GLU H H 54 8.540 8.501 0.039 1
1 652 . 17 1 1 A 54 54 GLU CA C 54 55.600 54.889 0.711 1
1 653 . 17 1 1 A 54 54 GLU CB C 54 34.300 30.163 4.137 1
1 654 . 17 1 1 A 54 54 GLU N N 54 125.900 125.861 0.039 1
1 655 . 17 1 1 A 55 55 PRO C C 55 177.500 176.831 0.669 1
1 656 . 17 1 1 A 55 55 PRO CA C 55 63.400 62.156 1.244 1
1 657 . 17 1 1 A 55 55 PRO CB C 55 32.300 32.615 -0.315 1
1 658 . 17 1 1 A 56 56 GLY H H 56 8.420 8.372 0.048 1
1 659 . 17 1 1 A 56 56 GLY HA2 H 56 3.830 4.126 -0.296 1
1 660 . 17 1 1 A 56 56 GLY HA3 H 56 4.000 4.136 -0.136 1
1 661 . 17 1 1 A 56 56 GLY C C 56 174.500 175.388 -0.888 1
1 662 . 17 1 1 A 56 56 GLY CA C 56 45.400 45.368 0.032 1
1 663 . 17 1 1 A 56 56 GLY N N 56 109.700 108.681 1.019 1
1 664 . 17 1 1 A 57 57 GLU H H 57 8.180 8.058 0.122 1
1 665 . 17 1 1 A 57 57 GLU C C 57 176.300 176.151 0.149 1
1 666 . 17 1 1 A 57 57 GLU CA C 57 57.500 57.930 -0.430 1
1 667 . 17 1 1 A 57 57 GLU CB C 57 30.400 30.315 0.085 1
1 668 . 17 1 1 A 57 57 GLU N N 57 120.900 118.585 2.315 1
1 669 . 17 1 1 A 58 58 TYR H H 58 8.020 7.667 0.353 1
1 670 . 17 1 1 A 58 58 TYR C C 58 175.100 174.322 0.778 1
1 671 . 17 1 1 A 58 58 TYR CA C 58 57.400 56.707 0.693 1
1 672 . 17 1 1 A 58 58 TYR CB C 58 38.900 42.884 -3.984 1
1 673 . 17 1 1 A 58 58 TYR N N 58 118.800 115.502 3.298 1
1 674 . 17 1 1 A 59 59 ASP H H 59 7.950 9.177 -1.227 1
1 675 . 17 1 1 A 59 59 ASP CA C 59 52.700 51.352 1.348 1
1 676 . 17 1 1 A 59 59 ASP CB C 59 41.000 44.069 -3.069 1
1 677 . 17 1 1 A 59 59 ASP N N 59 123.500 119.300 4.200 1
1 678 . 17 1 1 A 61 61 PRO HA H 61 4.510 4.383 0.127 1
1 685 . 17 1 1 A 61 61 PRO C C 61 176.500 176.701 -0.201 1
1 686 . 17 1 1 A 61 61 PRO CA C 61 63.700 65.548 -1.848 1
1 687 . 17 1 1 A 61 61 PRO CB C 61 34.200 31.776 2.424 1
1 690 . 17 1 1 A 62 62 GLU H H 62 8.490 8.402 0.088 1
1 691 . 17 1 1 A 62 62 GLU N N 62 124.600 117.663 6.937 1
1 692 . 17 1 1 A 64 64 LYS C C 64 176.300 175.472 0.828 1
1 693 . 17 1 1 A 64 64 LYS CA C 64 57.000 57.066 -0.066 1
1 694 . 17 1 1 A 64 64 LYS CB C 64 33.100 32.785 0.315 1
1 695 . 17 1 1 A 65 65 TYR H H 65 7.960 7.368 0.592 1
1 696 . 17 1 1 A 65 65 TYR C C 65 176.000 174.819 1.181 1
1 697 . 17 1 1 A 65 65 TYR CA C 65 57.800 56.241 1.559 1
1 698 . 17 1 1 A 65 65 TYR CB C 65 38.800 41.375 -2.575 1
1 699 . 17 1 1 A 65 65 TYR N N 65 119.300 118.186 1.114 1
1 700 . 17 1 1 A 66 66 THR H H 66 7.820 8.898 -1.078 1
1 701 . 17 1 1 A 66 66 THR HA H 66 4.280 5.029 -0.749 1
1 706 . 17 1 1 A 66 66 THR C C 66 174.100 173.519 0.581 1
1 707 . 17 1 1 A 66 66 THR CA C 66 62.100 61.691 0.409 1
1 708 . 17 1 1 A 66 66 THR CB C 66 70.000 71.483 -1.483 1
1 710 . 17 1 1 A 66 66 THR N N 66 113.900 115.930 -2.030 1
1 711 . 17 1 1 A 67 67 ASN H H 67 8.270 9.130 -0.860 1
1 712 . 17 1 1 A 67 67 ASN C C 67 174.100 174.183 -0.083 1
1 713 . 17 1 1 A 67 67 ASN CA C 67 53.400 53.526 -0.126 1
1 714 . 17 1 1 A 67 67 ASN CB C 67 39.300 38.884 0.416 1
1 715 . 17 1 1 A 67 67 ASN N N 67 121.400 126.452 -5.052 1
1 716 . 17 1 1 A 68 68 VAL H H 68 7.660 8.694 -1.034 1
1 717 . 17 1 1 A 68 68 VAL C C 68 175.500 175.434 0.066 1
1 718 . 17 1 1 A 68 68 VAL CA C 68 61.800 62.438 -0.638 1
1 719 . 17 1 1 A 68 68 VAL CB C 68 33.700 31.391 2.309 1
1 720 . 17 1 1 A 68 68 VAL N N 68 119.400 127.542 -8.142 1
1 721 . 17 1 1 A 69 69 LYS H H 69 8.690 8.936 -0.246 1
1 722 . 17 1 1 A 69 69 LYS C C 69 175.200 175.310 -0.110 1
1 723 . 17 1 1 A 69 69 LYS CA C 69 55.200 55.506 -0.306 1
1 724 . 17 1 1 A 69 69 LYS CB C 69 35.200 33.861 1.339 1
1 725 . 17 1 1 A 69 69 LYS N N 69 126.500 127.896 -1.396 1
1 726 . 17 1 1 A 70 70 LYS H H 70 8.230 9.004 -0.774 1
1 727 . 17 1 1 A 70 70 LYS C C 70 176.400 174.870 1.530 1
1 728 . 17 1 1 A 70 70 LYS CA C 70 55.600 55.008 0.592 1
1 729 . 17 1 1 A 70 70 LYS CB C 70 33.800 35.111 -1.311 1
1 730 . 17 1 1 A 70 70 LYS N N 70 122.700 125.160 -2.460 1
1 731 . 17 1 1 A 71 71 VAL H H 71 8.530 8.815 -0.285 1
1 732 . 17 1 1 A 71 71 VAL HA H 71 4.510 4.485 0.025 1
1 733 . 17 1 1 A 71 71 VAL C C 71 174.700 175.523 -0.823 1
1 734 . 17 1 1 A 71 71 VAL CA C 71 60.900 61.137 -0.237 1
1 735 . 17 1 1 A 71 71 VAL CB C 71 34.800 34.277 0.523 1
1 738 . 17 1 1 A 71 71 VAL N N 71 121.200 126.951 -5.751 1
1 739 . 17 1 1 A 72 72 LYS H H 72 8.210 8.589 -0.379 1
1 740 . 17 1 1 A 72 72 LYS HA H 72 4.800 4.524 0.276 1
1 747 . 17 1 1 A 72 72 LYS C C 72 176.200 175.288 0.912 1
1 748 . 17 1 1 A 72 72 LYS CA C 72 55.700 56.060 -0.360 1
1 749 . 17 1 1 A 72 72 LYS CB C 72 33.700 32.599 1.101 1
1 752 . 17 1 1 A 72 72 LYS N N 72 123.600 127.555 -3.955 1
1 753 . 17 1 1 A 73 73 ILE H H 73 8.890 8.893 -0.003 1
1 754 . 17 1 1 A 73 73 ILE C C 73 174.400 174.384 0.016 1
1 755 . 17 1 1 A 73 73 ILE CA C 73 60.400 59.949 0.451 1
1 756 . 17 1 1 A 73 73 ILE CB C 73 40.800 38.206 2.594 1
1 760 . 17 1 1 A 73 73 ILE N N 73 125.100 126.145 -1.045 1
1 761 . 17 1 1 A 74 74 LYS H H 74 8.420 8.916 -0.496 1
1 762 . 17 1 1 A 74 74 LYS HA H 74 4.800 4.749 0.051 1
1 771 . 17 1 1 A 74 74 LYS C C 74 175.600 175.140 0.460 1
1 772 . 17 1 1 A 74 74 LYS CA C 74 56.200 55.366 0.834 1
1 773 . 17 1 1 A 74 74 LYS CB C 74 34.300 33.605 0.695 1
1 777 . 17 1 1 A 74 74 LYS N N 74 126.400 128.621 -2.221 1
1 778 . 17 1 1 A 75 75 LYS H H 75 9.090 8.404 0.686 1
1 779 . 17 1 1 A 75 75 LYS HA H 75 4.800 4.915 -0.115 1
1 788 . 17 1 1 A 75 75 LYS C C 75 174.900 174.917 -0.017 1
1 789 . 17 1 1 A 75 75 LYS CA C 75 53.200 54.279 -1.079 1
1 790 . 17 1 1 A 75 75 LYS CB C 75 34.200 35.611 -1.411 1
1 794 . 17 1 1 A 75 75 LYS N N 75 127.500 126.330 1.170 1
1 795 . 17 1 1 A 76 76 VAL H H 76 8.610 8.586 0.024 1
1 796 . 17 1 1 A 76 76 VAL HA H 76 5.340 5.174 0.166 1
1 804 . 17 1 1 A 76 76 VAL C C 76 171.400 173.676 -2.276 1
1 805 . 17 1 1 A 76 76 VAL CA C 76 58.000 59.714 -1.714 1
1 806 . 17 1 1 A 76 76 VAL CB C 76 36.400 35.764 0.636 1
1 809 . 17 1 1 A 76 76 VAL N N 76 120.100 120.691 -0.591 1
1 810 . 17 1 1 A 77 77 TYR H H 77 9.110 9.111 -0.001 1
1 811 . 17 1 1 A 77 77 TYR HA H 77 6.150 5.621 0.529 1
1 816 . 17 1 1 A 77 77 TYR C C 77 173.600 172.929 0.671 1
1 817 . 17 1 1 A 77 77 TYR CA C 77 56.200 55.998 0.202 1
1 818 . 17 1 1 A 77 77 TYR CB C 77 44.000 40.979 3.021 1
1 821 . 17 1 1 A 77 77 TYR N N 77 121.300 121.760 -0.460 1
1 822 . 17 1 1 A 78 78 PHE H H 78 8.190 8.585 -0.395 1
1 823 . 17 1 1 A 78 78 PHE HA H 78 5.130 5.782 -0.652 1
1 829 . 17 1 1 A 78 78 PHE C C 78 173.600 173.078 0.522 1
1 830 . 17 1 1 A 78 78 PHE CA C 78 55.900 55.236 0.664 1
1 831 . 17 1 1 A 78 78 PHE CB C 78 42.500 42.650 -0.150 1
1 835 . 17 1 1 A 78 78 PHE N N 78 112.700 118.023 -5.323 1
1 836 . 17 1 1 A 79 79 GLU H H 79 8.920 9.228 -0.308 1
1 837 . 17 1 1 A 79 79 GLU HA H 79 5.390 5.221 0.169 1
1 842 . 17 1 1 A 79 79 GLU C C 79 177.000 176.610 0.390 1
1 843 . 17 1 1 A 79 79 GLU CA C 79 54.900 55.128 -0.228 1
1 844 . 17 1 1 A 79 79 GLU CB C 79 33.600 33.232 0.368 1
1 846 . 17 1 1 A 79 79 GLU N N 79 120.500 121.857 -1.357 1
1 847 . 17 1 1 A 80 80 THR H H 80 8.970 8.747 0.223 1
1 848 . 17 1 1 A 80 80 THR HA H 80 4.700 4.859 -0.159 1
1 854 . 17 1 1 A 80 80 THR C C 80 177.000 176.076 0.924 1
1 855 . 17 1 1 A 80 80 THR CA C 80 61.300 60.492 0.808 1
1 856 . 17 1 1 A 80 80 THR CB C 80 70.500 72.006 -1.506 1
1 858 . 17 1 1 A 80 80 THR N N 80 113.200 117.272 -4.072 1
1 859 . 17 1 1 A 81 81 LEU H H 81 8.610 8.958 -0.348 1
1 860 . 17 1 1 A 81 81 LEU HA H 81 4.230 4.058 0.172 1
1 870 . 17 1 1 A 81 81 LEU C C 81 177.400 178.378 -0.978 1
1 871 . 17 1 1 A 81 81 LEU CA C 81 57.700 57.616 0.084 1
1 872 . 17 1 1 A 81 81 LEU CB C 81 42.400 41.346 1.054 1
1 876 . 17 1 1 A 81 81 LEU N N 81 120.900 122.169 -1.269 1
1 877 . 17 1 1 A 82 82 ASP H H 82 8.850 7.885 0.965 1
1 878 . 17 1 1 A 82 82 ASP HA H 82 4.670 4.643 0.027 1
1 881 . 17 1 1 A 82 82 ASP C C 82 174.100 175.181 -1.081 1
1 882 . 17 1 1 A 82 82 ASP CA C 82 52.700 54.085 -1.385 1
1 883 . 17 1 1 A 82 82 ASP CB C 82 37.900 40.914 -3.014 1
1 884 . 17 1 1 A 82 82 ASP N N 82 112.300 117.283 -4.983 1
1 885 . 17 1 1 A 83 83 ASN H H 83 7.790 7.883 -0.093 1
1 886 . 17 1 1 A 83 83 ASN HA H 83 4.270 4.402 -0.132 1
1 891 . 17 1 1 A 83 83 ASN C C 83 176.100 174.200 1.900 1
1 892 . 17 1 1 A 83 83 ASN CA C 83 55.300 54.530 0.770 1
1 893 . 17 1 1 A 83 83 ASN CB C 83 36.900 36.962 -0.062 1
1 894 . 17 1 1 A 83 83 ASN N N 83 113.000 114.990 -1.990 1
1 896 . 17 1 1 A 84 84 VAL H H 84 7.660 7.417 0.243 1
1 897 . 17 1 1 A 84 84 VAL HA H 84 4.270 4.108 0.162 1
1 905 . 17 1 1 A 84 84 VAL C C 84 175.800 174.991 0.809 1
1 906 . 17 1 1 A 84 84 VAL CA C 84 61.500 62.069 -0.569 1
1 907 . 17 1 1 A 84 84 VAL CB C 84 33.500 32.864 0.636 1
1 910 . 17 1 1 A 84 84 VAL N N 84 119.700 119.484 0.216 1
1 911 . 17 1 1 A 85 85 ARG H H 85 8.180 9.167 -0.987 1
1 912 . 17 1 1 A 85 85 ARG HA H 85 4.870 4.767 0.103 1
1 920 . 17 1 1 A 85 85 ARG C C 85 174.000 174.962 -0.962 1
1 921 . 17 1 1 A 85 85 ARG CA C 85 55.700 55.175 0.525 1
1 922 . 17 1 1 A 85 85 ARG CB C 85 32.600 30.903 1.697 1
1 925 . 17 1 1 A 85 85 ARG N N 85 124.800 127.513 -2.713 1
1 927 . 17 1 1 A 86 86 VAL H H 86 8.570 8.176 0.394 1
1 928 . 17 1 1 A 86 86 VAL HA H 86 4.580 4.516 0.064 1
1 936 . 17 1 1 A 86 86 VAL C C 86 175.700 175.288 0.412 1
1 937 . 17 1 1 A 86 86 VAL CA C 86 61.700 62.386 -0.686 1
1 938 . 17 1 1 A 86 86 VAL CB C 86 30.900 30.644 0.256 1
1 941 . 17 1 1 A 86 86 VAL N N 86 127.300 124.971 2.329 1
1 942 . 17 1 1 A 87 87 VAL H H 87 8.790 8.765 0.025 1
1 943 . 17 1 1 A 87 87 VAL HA H 87 5.010 4.838 0.172 1
1 951 . 17 1 1 A 87 87 VAL C C 87 175.500 175.065 0.435 1
1 952 . 17 1 1 A 87 87 VAL CA C 87 61.900 61.025 0.875 1
1 953 . 17 1 1 A 87 87 VAL CB C 87 36.300 33.073 3.227 1
1 956 . 17 1 1 A 87 87 VAL N N 87 125.700 128.314 -2.614 1
1 957 . 17 1 1 A 88 88 THR H H 88 8.350 8.954 -0.604 1
1 958 . 17 1 1 A 88 88 THR HA H 88 4.620 4.707 -0.087 1
1 964 . 17 1 1 A 88 88 THR C C 88 173.300 171.507 1.793 1
1 965 . 17 1 1 A 88 88 THR CA C 88 61.700 59.616 2.084 1
1 966 . 17 1 1 A 88 88 THR CB C 88 70.400 70.362 0.038 1
1 968 . 17 1 1 A 88 88 THR N N 88 117.500 119.600 -2.100 1
1 969 . 17 1 1 A 89 89 ASP H H 89 7.700 8.599 -0.899 1
1 970 . 17 1 1 A 89 89 ASP HA H 89 4.480 4.873 -0.393 1
1 973 . 17 1 1 A 89 89 ASP C C 89 175.900 176.241 -0.341 1
1 974 . 17 1 1 A 89 89 ASP CA C 89 55.900 52.730 3.170 1
1 975 . 17 1 1 A 89 89 ASP CB C 89 43.900 41.810 2.090 1
1 976 . 17 1 1 A 89 89 ASP N N 89 120.800 123.501 -2.701 1
1 977 . 17 1 1 A 90 90 TYR H H 90 8.240 8.936 -0.696 1
1 978 . 17 1 1 A 90 90 TYR HA H 90 3.920 4.100 -0.180 1
1 983 . 17 1 1 A 90 90 TYR C C 90 176.400 177.677 -1.277 1
1 984 . 17 1 1 A 90 90 TYR CA C 90 62.300 62.278 0.022 1
1 985 . 17 1 1 A 90 90 TYR CB C 90 39.500 38.651 0.849 1
1 988 . 17 1 1 A 90 90 TYR N N 90 126.100 128.060 -1.960 1
1 989 . 17 1 1 A 91 91 SER H H 91 9.160 7.932 1.228 1
1 990 . 17 1 1 A 91 91 SER HA H 91 4.000 4.078 -0.078 1
1 993 . 17 1 1 A 91 91 SER C C 91 178.000 177.432 0.568 1
1 994 . 17 1 1 A 91 91 SER CA C 91 62.600 61.743 0.857 1
1 995 . 17 1 1 A 91 91 SER CB C 91 62.200 62.976 -0.776 1
1 996 . 17 1 1 A 91 91 SER N N 91 116.600 114.598 2.002 1
1 997 . 17 1 1 A 92 92 GLU H H 92 8.590 7.975 0.615 1
1 998 . 17 1 1 A 92 92 GLU HA H 92 4.050 4.035 0.015 1
1 1003 . 17 1 1 A 92 92 GLU C C 92 179.400 178.849 0.551 1
1 1004 . 17 1 1 A 92 92 GLU CA C 92 58.900 59.234 -0.334 1
1 1005 . 17 1 1 A 92 92 GLU CB C 92 30.600 29.256 1.344 1
1 1007 . 17 1 1 A 92 92 GLU N N 92 120.200 121.356 -1.156 1
1 1008 . 17 1 1 A 93 93 PHE H H 93 7.870 8.314 -0.444 1
1 1009 . 17 1 1 A 93 93 PHE HA H 93 4.050 4.074 -0.024 1
1 1015 . 17 1 1 A 93 93 PHE C C 93 176.500 177.788 -1.288 1
1 1016 . 17 1 1 A 93 93 PHE CA C 93 62.200 61.218 0.982 1
1 1017 . 17 1 1 A 93 93 PHE CB C 93 39.700 39.155 0.545 1
1 1021 . 17 1 1 A 93 93 PHE N N 93 120.200 120.768 -0.568 1
1 1022 . 17 1 1 A 94 94 GLN H H 94 8.190 8.196 -0.006 1
1 1023 . 17 1 1 A 94 94 GLN HA H 94 3.390 3.475 -0.085 1
1 1030 . 17 1 1 A 94 94 GLN C C 94 178.600 178.711 -0.111 1
1 1031 . 17 1 1 A 94 94 GLN CA C 94 58.800 59.146 -0.346 1
1 1032 . 17 1 1 A 94 94 GLN CB C 94 28.400 28.348 0.052 1
1 1034 . 17 1 1 A 94 94 GLN N N 94 116.800 118.442 -1.642 1
1 1036 . 17 1 1 A 95 95 LYS H H 95 7.060 7.346 -0.286 1
1 1037 . 17 1 1 A 95 95 LYS HA H 95 3.780 4.009 -0.229 1
1 1046 . 17 1 1 A 95 95 LYS C C 95 179.300 179.344 -0.044 1
1 1047 . 17 1 1 A 95 95 LYS CA C 95 59.900 59.365 0.535 1
1 1048 . 17 1 1 A 95 95 LYS CB C 95 32.700 32.377 0.323 1
1 1052 . 17 1 1 A 95 95 LYS N N 95 117.500 119.377 -1.877 1
1 1053 . 17 1 1 A 96 96 ILE H H 96 7.240 7.732 -0.492 1
1 1054 . 17 1 1 A 96 96 ILE HA H 96 3.420 3.541 -0.121 1
1 1064 . 17 1 1 A 96 96 ILE C C 96 177.800 178.088 -0.288 1
1 1065 . 17 1 1 A 96 96 ILE CA C 96 64.300 64.822 -0.522 1
1 1066 . 17 1 1 A 96 96 ILE CB C 96 37.400 36.992 0.408 1
1 1070 . 17 1 1 A 96 96 ILE N N 96 120.700 120.123 0.577 1
1 1071 . 17 1 1 A 97 97 LEU H H 97 7.690 8.088 -0.398 1
1 1072 . 17 1 1 A 97 97 LEU HA H 97 3.580 3.524 0.056 1
1 1082 . 17 1 1 A 97 97 LEU C C 97 179.900 179.314 0.586 1
1 1083 . 17 1 1 A 97 97 LEU CA C 97 58.100 57.222 0.878 1
1 1084 . 17 1 1 A 97 97 LEU CB C 97 41.500 41.093 0.407 1
1 1088 . 17 1 1 A 97 97 LEU N N 97 120.000 120.748 -0.748 1
1 1089 . 17 1 1 A 98 98 LYS H H 98 7.510 7.741 -0.231 1
1 1090 . 17 1 1 A 98 98 LYS HA H 98 3.950 3.955 -0.005 1
1 1099 . 17 1 1 A 98 98 LYS C C 98 178.700 179.221 -0.521 1
1 1100 . 17 1 1 A 98 98 LYS CA C 98 58.700 59.563 -0.863 1
1 1101 . 17 1 1 A 98 98 LYS CB C 98 32.500 32.199 0.301 1
1 1105 . 17 1 1 A 98 98 LYS N N 98 117.300 118.674 -1.374 1
1 1106 . 17 1 1 A 99 99 LYS H H 99 7.470 7.657 -0.187 1
1 1107 . 17 1 1 A 99 99 LYS HA H 99 4.080 4.007 0.073 1
1 1116 . 17 1 1 A 99 99 LYS C C 99 178.100 179.248 -1.148 1
1 1117 . 17 1 1 A 99 99 LYS CA C 99 58.400 59.856 -1.456 1
1 1118 . 17 1 1 A 99 99 LYS CB C 99 33.000 32.034 0.966 1
1 1122 . 17 1 1 A 99 99 LYS N N 99 119.000 120.040 -1.040 1
1 1123 . 17 1 1 A 100 100 ARG H H 100 8.020 8.010 0.010 1
1 1124 . 17 1 1 A 100 100 ARG HA H 100 4.210 4.277 -0.067 1
1 1131 . 17 1 1 A 100 100 ARG C C 100 177.500 176.444 1.056 1
1 1132 . 17 1 1 A 100 100 ARG CA C 100 56.700 57.594 -0.894 1
1 1133 . 17 1 1 A 100 100 ARG CB C 100 30.500 30.864 -0.364 1
1 1136 . 17 1 1 A 100 100 ARG N N 100 117.300 118.497 -1.197 1
1 1137 . 17 1 1 A 101 101 GLY H H 101 7.910 7.646 0.264 1
1 1138 . 17 1 1 A 101 101 GLY HA2 H 101 3.980 3.923 0.057 1
1 1139 . 17 1 1 A 101 101 GLY HA3 H 101 4.020 3.938 0.082 1
1 1140 . 17 1 1 A 101 101 GLY C C 101 174.400 174.432 -0.032 1
1 1141 . 17 1 1 A 101 101 GLY CA C 101 46.000 46.300 -0.300 1
1 1142 . 17 1 1 A 101 101 GLY N N 101 108.000 108.129 -0.129 1
1 1143 . 17 1 1 A 102 102 THR H H 102 7.880 8.137 -0.257 1
1 1144 . 17 1 1 A 102 102 THR HA H 102 4.360 4.409 -0.049 1
1 1149 . 17 1 1 A 102 102 THR C C 102 174.400 173.213 1.187 1
1 1150 . 17 1 1 A 102 102 THR CA C 102 62.100 61.276 0.824 1
1 1151 . 17 1 1 A 102 102 THR CB C 102 70.500 66.615 3.885 1
1 1153 . 17 1 1 A 102 102 THR N N 102 113.900 115.959 -2.059 1
1 1154 . 17 1 1 A 103 103 LYS H H 103 8.440 7.817 0.623 1
1 1155 . 17 1 1 A 103 103 LYS C C 103 176.400 174.532 1.868 1
1 1156 . 17 1 1 A 103 103 LYS CA C 103 56.600 55.999 0.601 1
1 1157 . 17 1 1 A 103 103 LYS CB C 103 33.300 36.522 -3.222 1
1 1158 . 17 1 1 A 103 103 LYS N N 103 124.000 125.100 -1.100 1
1 1159 . 17 1 1 A 104 104 LEU H H 104 8.180 8.834 -0.654 1
1 1160 . 17 1 1 A 104 104 LEU HA H 104 4.270 4.681 -0.411 1
1 1170 . 17 1 1 A 104 104 LEU C C 104 177.100 177.440 -0.340 1
1 1171 . 17 1 1 A 104 104 LEU CA C 104 55.500 54.045 1.455 1
1 1172 . 17 1 1 A 104 104 LEU CB C 104 42.500 42.483 0.017 1
1 1176 . 17 1 1 A 104 104 LEU N N 104 123.500 127.709 -4.209 1
1 1177 . 17 1 1 A 105 105 GLU H H 105 8.270 8.592 -0.322 1
1 1178 . 17 1 1 A 105 105 GLU CA C 105 56.700 58.511 -1.811 1
1 1179 . 17 1 1 A 105 105 GLU CB C 105 30.800 30.661 0.139 1
1 13 . 18 1 1 A 2 2 ASN HA H 2 4.980 5.006 -0.026 1
1 18 . 18 1 1 A 2 2 ASN C C 2 176.300 177.076 -0.776 1
1 19 . 18 1 1 A 2 2 ASN CA C 2 52.500 52.282 0.218 1
1 20 . 18 1 1 A 2 2 ASN CB C 2 40.900 39.446 1.454 1
1 22 . 18 1 1 A 3 3 SER H H 3 9.940 9.586 0.354 1
1 23 . 18 1 1 A 3 3 SER HA H 3 3.720 4.120 -0.400 1
1 26 . 18 1 1 A 3 3 SER C C 3 175.900 176.744 -0.844 1
1 27 . 18 1 1 A 3 3 SER CA C 3 63.300 61.031 2.269 1
1 28 . 18 1 1 A 3 3 SER CB C 3 61.700 62.953 -1.253 1
1 29 . 18 1 1 A 3 3 SER N N 3 118.200 117.331 0.869 1
1 30 . 18 1 1 A 4 4 GLU H H 4 8.450 8.186 0.264 1
1 31 . 18 1 1 A 4 4 GLU HA H 4 4.010 4.071 -0.061 1
1 36 . 18 1 1 A 4 4 GLU C C 4 178.800 179.156 -0.356 1
1 37 . 18 1 1 A 4 4 GLU CA C 4 60.300 59.228 1.072 1
1 38 . 18 1 1 A 4 4 GLU CB C 4 29.100 29.393 -0.293 1
1 40 . 18 1 1 A 4 4 GLU N N 4 123.600 121.445 2.155 1
1 41 . 18 1 1 A 5 5 VAL H H 5 7.590 7.756 -0.166 1
1 42 . 18 1 1 A 5 5 VAL HA H 5 3.850 3.707 0.143 1
1 50 . 18 1 1 A 5 5 VAL C C 5 179.100 178.543 0.557 1
1 51 . 18 1 1 A 5 5 VAL CA C 5 65.800 66.408 -0.608 1
1 52 . 18 1 1 A 5 5 VAL CB C 5 32.300 31.615 0.685 1
1 55 . 18 1 1 A 5 5 VAL N N 5 119.300 119.396 -0.096 1
1 56 . 18 1 1 A 6 6 ILE H H 6 7.240 7.860 -0.620 1
1 57 . 18 1 1 A 6 6 ILE HA H 6 3.580 3.656 -0.076 1
1 67 . 18 1 1 A 6 6 ILE C C 6 177.000 177.485 -0.485 1
1 68 . 18 1 1 A 6 6 ILE CA C 6 65.300 65.563 -0.263 1
1 69 . 18 1 1 A 6 6 ILE CB C 6 37.900 37.892 0.008 1
1 73 . 18 1 1 A 6 6 ILE N N 6 120.300 120.937 -0.637 1
1 74 . 18 1 1 A 7 7 LYS H H 7 8.050 8.132 -0.082 1
1 75 . 18 1 1 A 7 7 LYS HA H 7 3.570 3.663 -0.093 1
1 84 . 18 1 1 A 7 7 LYS C C 7 178.700 179.952 -1.252 1
1 85 . 18 1 1 A 7 7 LYS CA C 7 61.300 59.969 1.331 1
1 86 . 18 1 1 A 7 7 LYS CB C 7 32.200 31.860 0.340 1
1 90 . 18 1 1 A 7 7 LYS N N 7 119.200 118.660 0.540 1
1 91 . 18 1 1 A 8 8 GLU H H 8 8.100 8.157 -0.057 1
1 92 . 18 1 1 A 8 8 GLU HA H 8 4.000 4.060 -0.060 1
1 97 . 18 1 1 A 8 8 GLU C C 8 178.500 179.247 -0.747 1
1 98 . 18 1 1 A 8 8 GLU CA C 8 59.700 59.638 0.062 1
1 99 . 18 1 1 A 8 8 GLU CB C 8 29.600 29.585 0.015 1
1 101 . 18 1 1 A 8 8 GLU N N 8 119.400 120.509 -1.109 1
1 102 . 18 1 1 A 9 9 PHE H H 9 7.720 7.869 -0.149 1
1 103 . 18 1 1 A 9 9 PHE HA H 9 4.160 4.023 0.137 1
1 109 . 18 1 1 A 9 9 PHE C C 9 176.900 177.391 -0.491 1
1 110 . 18 1 1 A 9 9 PHE CA C 9 61.300 61.361 -0.061 1
1 111 . 18 1 1 A 9 9 PHE CB C 9 39.400 38.939 0.461 1
1 115 . 18 1 1 A 9 9 PHE N N 9 121.300 121.553 -0.253 1
1 116 . 18 1 1 A 10 10 LEU H H 10 8.060 8.449 -0.389 1
1 117 . 18 1 1 A 10 10 LEU HA H 10 3.660 3.804 -0.144 1
1 127 . 18 1 1 A 10 10 LEU C C 10 179.000 179.294 -0.294 1
1 128 . 18 1 1 A 10 10 LEU CA C 10 58.000 58.069 -0.069 1
1 129 . 18 1 1 A 10 10 LEU CB C 10 41.400 41.414 -0.014 1
1 133 . 18 1 1 A 10 10 LEU N N 10 118.000 119.753 -1.753 1
1 134 . 18 1 1 A 11 11 GLU H H 11 7.990 8.474 -0.484 1
1 135 . 18 1 1 A 11 11 GLU HA H 11 4.110 4.258 -0.148 1
1 140 . 18 1 1 A 11 11 GLU C C 11 174.200 178.862 -4.662 1
1 141 . 18 1 1 A 11 11 GLU CA C 11 59.200 59.189 0.011 1
1 142 . 18 1 1 A 11 11 GLU CB C 11 29.300 29.053 0.247 1
1 144 . 18 1 1 A 11 11 GLU N N 11 118.300 117.402 0.898 1
1 145 . 18 1 1 A 12 12 ASP H H 12 8.080 7.944 0.136 1
1 146 . 18 1 1 A 12 12 ASP HA H 12 4.340 4.365 -0.025 1
1 149 . 18 1 1 A 12 12 ASP C C 12 178.900 178.318 0.582 1
1 150 . 18 1 1 A 12 12 ASP CA C 12 57.600 57.367 0.233 1
1 151 . 18 1 1 A 12 12 ASP CB C 12 41.000 41.016 -0.016 1
1 152 . 18 1 1 A 12 12 ASP N N 12 121.800 119.869 1.931 1
1 153 . 18 1 1 A 13 13 ILE H H 13 7.610 7.495 0.115 1
1 154 . 18 1 1 A 13 13 ILE HA H 13 4.240 3.984 0.256 1
1 164 . 18 1 1 A 13 13 ILE C C 13 176.800 176.678 0.122 1
1 165 . 18 1 1 A 13 13 ILE CA C 13 62.100 61.290 0.810 1
1 166 . 18 1 1 A 13 13 ILE CB C 13 38.300 38.110 0.190 1
1 170 . 18 1 1 A 13 13 ILE N N 13 110.800 112.081 -1.281 1
1 171 . 18 1 1 A 14 14 GLY H H 14 7.640 7.802 -0.162 1
1 172 . 18 1 1 A 14 14 GLY HA2 H 14 3.810 3.877 -0.067 1
1 173 . 18 1 1 A 14 14 GLY HA3 H 14 3.880 3.886 -0.006 1
1 174 . 18 1 1 A 14 14 GLY C C 14 175.200 174.036 1.164 1
1 175 . 18 1 1 A 14 14 GLY CA C 14 46.900 45.883 1.017 1
1 176 . 18 1 1 A 14 14 GLY N N 14 111.800 112.221 -0.421 1
1 177 . 18 1 1 A 15 15 GLU H H 15 7.870 7.595 0.275 1
1 178 . 18 1 1 A 15 15 GLU HA H 15 4.680 4.791 -0.111 1
1 183 . 18 1 1 A 15 15 GLU C C 15 175.100 173.924 1.176 1
1 184 . 18 1 1 A 15 15 GLU CA C 15 54.800 54.611 0.189 1
1 185 . 18 1 1 A 15 15 GLU CB C 15 32.200 32.855 -0.655 1
1 187 . 18 1 1 A 15 15 GLU N N 15 119.200 120.248 -1.048 1
1 188 . 18 1 1 A 16 16 ASP H H 16 8.220 8.805 -0.585 1
1 189 . 18 1 1 A 16 16 ASP HA H 16 4.680 5.393 -0.713 1
1 192 . 18 1 1 A 16 16 ASP C C 16 174.600 174.664 -0.064 1
1 193 . 18 1 1 A 16 16 ASP CA C 16 53.600 52.661 0.939 1
1 194 . 18 1 1 A 16 16 ASP CB C 16 42.900 44.548 -1.648 1
1 195 . 18 1 1 A 16 16 ASP N N 16 120.600 123.044 -2.444 1
1 196 . 18 1 1 A 17 17 TYR H H 17 7.540 8.421 -0.881 1
1 197 . 18 1 1 A 17 17 TYR HA H 17 4.910 5.817 -0.907 1
1 202 . 18 1 1 A 17 17 TYR C C 17 173.600 173.428 0.172 1
1 203 . 18 1 1 A 17 17 TYR CA C 17 56.200 55.320 0.880 1
1 204 . 18 1 1 A 17 17 TYR CB C 17 41.100 42.083 -0.983 1
1 207 . 18 1 1 A 17 17 TYR N N 17 112.700 119.293 -6.593 1
1 208 . 18 1 1 A 18 18 ILE H H 18 7.950 8.519 -0.569 1
1 209 . 18 1 1 A 18 18 ILE HA H 18 4.330 4.490 -0.160 1
1 219 . 18 1 1 A 18 18 ILE C C 18 174.700 174.631 0.069 1
1 220 . 18 1 1 A 18 18 ILE CA C 18 60.300 61.358 -1.058 1
1 221 . 18 1 1 A 18 18 ILE CB C 18 41.000 37.166 3.834 1
1 225 . 18 1 1 A 18 18 ILE N N 18 120.400 122.279 -1.879 1
1 226 . 18 1 1 A 19 19 GLU H H 19 8.760 8.995 -0.235 1
1 227 . 18 1 1 A 19 19 GLU HA H 19 5.200 5.088 0.112 1
1 232 . 18 1 1 A 19 19 GLU C C 19 175.200 175.526 -0.326 1
1 233 . 18 1 1 A 19 19 GLU CA C 19 55.500 55.483 0.017 1
1 234 . 18 1 1 A 19 19 GLU CB C 19 32.400 31.539 0.861 1
1 236 . 18 1 1 A 19 19 GLU N N 19 129.000 128.800 0.200 1
1 237 . 18 1 1 A 20 20 LEU H H 20 8.730 9.393 -0.663 1
1 238 . 18 1 1 A 20 20 LEU HA H 20 4.620 4.929 -0.309 1
1 248 . 18 1 1 A 20 20 LEU C C 20 176.200 175.705 0.495 1
1 249 . 18 1 1 A 20 20 LEU CA C 20 54.100 53.313 0.787 1
1 250 . 18 1 1 A 20 20 LEU CB C 20 44.400 43.489 0.911 1
1 254 . 18 1 1 A 20 20 LEU N N 20 128.400 127.888 0.512 1
1 255 . 18 1 1 A 21 21 GLU H H 21 8.700 8.644 0.056 1
1 256 . 18 1 1 A 21 21 GLU HA H 21 3.870 4.175 -0.305 1
1 261 . 18 1 1 A 21 21 GLU C C 21 176.100 177.121 -1.021 1
1 262 . 18 1 1 A 21 21 GLU CA C 21 58.800 57.427 1.373 1
1 263 . 18 1 1 A 21 21 GLU CB C 21 28.200 29.706 -1.506 1
1 265 . 18 1 1 A 21 21 GLU N N 21 122.600 120.959 1.641 1
1 266 . 18 1 1 A 22 22 ASN H H 22 8.640 8.981 -0.341 1
1 267 . 18 1 1 A 22 22 ASN HA H 22 4.540 4.342 0.198 1
1 272 . 18 1 1 A 22 22 ASN C C 22 173.800 173.918 -0.118 1
1 273 . 18 1 1 A 22 22 ASN CA C 22 54.600 54.764 -0.164 1
1 274 . 18 1 1 A 22 22 ASN CB C 22 38.400 37.086 1.314 1
1 275 . 18 1 1 A 22 22 ASN N N 22 118.000 119.822 -1.822 1
1 277 . 18 1 1 A 23 23 GLU H H 23 7.740 7.372 0.368 1
1 278 . 18 1 1 A 23 23 GLU HA H 23 5.430 4.920 0.510 1
1 283 . 18 1 1 A 23 23 GLU C C 23 175.400 175.427 -0.027 1
1 284 . 18 1 1 A 23 23 GLU CA C 23 54.900 55.071 -0.171 1
1 285 . 18 1 1 A 23 23 GLU CB C 23 34.500 31.834 2.666 1
1 287 . 18 1 1 A 23 23 GLU N N 23 116.400 117.538 -1.138 1
1 288 . 18 1 1 A 24 24 ILE H H 24 9.050 9.039 0.011 1
1 289 . 18 1 1 A 24 24 ILE HA H 24 4.810 4.849 -0.039 1
1 299 . 18 1 1 A 24 24 ILE C C 24 174.600 174.518 0.082 1
1 300 . 18 1 1 A 24 24 ILE CA C 24 60.700 60.303 0.397 1
1 301 . 18 1 1 A 24 24 ILE CB C 24 41.300 39.476 1.824 1
1 305 . 18 1 1 A 24 24 ILE N N 24 122.800 125.543 -2.743 1
1 306 . 18 1 1 A 25 25 HIS H H 25 9.490 9.315 0.175 1
1 307 . 18 1 1 A 25 25 HIS HA H 25 5.090 5.503 -0.413 1
1 312 . 18 1 1 A 25 25 HIS C C 25 176.100 174.599 1.501 1
1 313 . 18 1 1 A 25 25 HIS CA C 25 56.100 55.057 1.043 1
1 314 . 18 1 1 A 25 25 HIS CB C 25 33.100 31.349 1.751 1
1 317 . 18 1 1 A 25 25 HIS N N 25 127.300 125.890 1.410 1
1 318 . 18 1 1 A 26 26 LEU H H 26 8.820 8.662 0.158 1
1 319 . 18 1 1 A 26 26 LEU HA H 26 5.160 4.968 0.192 1
1 329 . 18 1 1 A 26 26 LEU C C 26 178.000 175.973 2.027 1
1 330 . 18 1 1 A 26 26 LEU CA C 26 52.900 53.470 -0.570 1
1 331 . 18 1 1 A 26 26 LEU CB C 26 48.100 43.753 4.347 1
1 335 . 18 1 1 A 26 26 LEU N N 26 121.600 125.009 -3.409 1
1 336 . 18 1 1 A 27 27 LYS H H 27 8.990 8.755 0.235 1
1 337 . 18 1 1 A 27 27 LYS HA H 27 4.630 4.653 -0.023 1
1 345 . 18 1 1 A 27 27 LYS CA C 27 55.700 54.127 1.573 1
1 346 . 18 1 1 A 27 27 LYS CB C 27 31.900 32.043 -0.143 1
1 350 . 18 1 1 A 27 27 LYS N N 27 125.900 120.772 5.128 1
1 351 . 18 1 1 A 28 28 PRO HA H 28 4.500 4.475 0.025 1
1 358 . 18 1 1 A 28 28 PRO C C 28 177.900 179.264 -1.364 1
1 359 . 18 1 1 A 28 28 PRO CA C 28 67.400 65.941 1.459 1
1 360 . 18 1 1 A 28 28 PRO CB C 28 32.100 31.911 0.189 1
1 363 . 18 1 1 A 29 29 GLU H H 29 9.880 8.322 1.558 1
1 364 . 18 1 1 A 29 29 GLU HA H 29 4.140 4.287 -0.147 1
1 369 . 18 1 1 A 29 29 GLU C C 29 178.800 179.816 -1.016 1
1 370 . 18 1 1 A 29 29 GLU CA C 29 60.600 59.511 1.089 1
1 371 . 18 1 1 A 29 29 GLU CB C 29 29.200 29.472 -0.272 1
1 373 . 18 1 1 A 29 29 GLU N N 29 117.100 117.918 -0.818 1
1 374 . 18 1 1 A 30 30 VAL H H 30 7.050 8.159 -1.109 1
1 375 . 18 1 1 A 30 30 VAL HA H 30 3.850 3.776 0.074 1
1 383 . 18 1 1 A 30 30 VAL C C 30 177.700 178.380 -0.680 1
1 384 . 18 1 1 A 30 30 VAL CA C 30 65.600 66.804 -1.204 1
1 385 . 18 1 1 A 30 30 VAL CB C 30 32.100 31.689 0.411 1
1 388 . 18 1 1 A 30 30 VAL N N 30 120.900 121.852 -0.952 1
1 389 . 18 1 1 A 31 31 PHE H H 31 8.980 8.922 0.058 1
1 390 . 18 1 1 A 31 31 PHE HA H 31 3.870 4.237 -0.367 1
1 394 . 18 1 1 A 31 31 PHE C C 31 176.700 177.185 -0.485 1
1 395 . 18 1 1 A 31 31 PHE CA C 31 62.200 61.963 0.237 1
1 396 . 18 1 1 A 31 31 PHE CB C 31 39.300 39.040 0.260 1
1 398 . 18 1 1 A 31 31 PHE N N 31 121.100 120.286 0.814 1
1 399 . 18 1 1 A 32 32 TYR H H 32 8.640 8.488 0.152 1
1 400 . 18 1 1 A 32 32 TYR HA H 32 3.880 4.607 -0.727 1
1 405 . 18 1 1 A 32 32 TYR C C 32 176.000 178.278 -2.278 1
1 406 . 18 1 1 A 32 32 TYR CA C 32 63.300 62.050 1.250 1
1 407 . 18 1 1 A 32 32 TYR CB C 32 39.100 39.189 -0.089 1
1 410 . 18 1 1 A 32 32 TYR N N 32 117.400 120.816 -3.416 1
1 411 . 18 1 1 A 33 33 GLU H H 33 7.400 7.889 -0.489 1
1 412 . 18 1 1 A 33 33 GLU HA H 33 4.050 4.060 -0.010 1
1 417 . 18 1 1 A 33 33 GLU C C 33 180.200 179.193 1.007 1
1 418 . 18 1 1 A 33 33 GLU CA C 33 59.500 58.900 0.600 1
1 419 . 18 1 1 A 33 33 GLU CB C 33 29.300 29.922 -0.622 1
1 421 . 18 1 1 A 33 33 GLU N N 33 116.100 118.809 -2.709 1
1 422 . 18 1 1 A 34 34 VAL H H 34 8.530 7.811 0.719 1
1 423 . 18 1 1 A 34 34 VAL HA H 34 3.350 3.357 -0.007 1
1 431 . 18 1 1 A 34 34 VAL C C 34 175.800 178.134 -2.334 1
1 432 . 18 1 1 A 34 34 VAL CA C 34 66.400 66.015 0.385 1
1 433 . 18 1 1 A 34 34 VAL CB C 34 32.200 31.382 0.818 1
1 436 . 18 1 1 A 34 34 VAL N N 34 120.600 120.315 0.285 1
1 437 . 18 1 1 A 35 35 TRP H H 35 9.100 8.132 0.968 1
1 438 . 18 1 1 A 35 35 TRP HA H 35 3.340 3.544 -0.204 1
1 447 . 18 1 1 A 35 35 TRP C C 35 178.000 178.275 -0.275 1
1 448 . 18 1 1 A 35 35 TRP CA C 35 61.800 60.742 1.058 1
1 449 . 18 1 1 A 35 35 TRP CB C 35 27.900 29.378 -1.478 1
1 455 . 18 1 1 A 35 35 TRP N N 35 121.700 121.825 -0.125 1
1 457 . 18 1 1 A 36 36 LYS H H 36 7.970 7.928 0.042 1
1 458 . 18 1 1 A 36 36 LYS HA H 36 3.330 3.633 -0.303 1
1 467 . 18 1 1 A 36 36 LYS C C 36 180.000 178.328 1.672 1
1 468 . 18 1 1 A 36 36 LYS CA C 36 59.000 58.486 0.514 1
1 469 . 18 1 1 A 36 36 LYS CB C 36 31.800 31.898 -0.098 1
1 473 . 18 1 1 A 36 36 LYS N N 36 116.300 118.457 -2.157 1
1 474 . 18 1 1 A 37 37 TYR H H 37 7.750 7.614 0.136 1
1 475 . 18 1 1 A 37 37 TYR HA H 37 3.940 3.847 0.093 1
1 480 . 18 1 1 A 37 37 TYR C C 37 177.600 177.489 0.111 1
1 481 . 18 1 1 A 37 37 TYR CA C 37 61.200 60.629 0.571 1
1 482 . 18 1 1 A 37 37 TYR CB C 37 38.800 38.450 0.350 1
1 485 . 18 1 1 A 37 37 TYR N N 37 122.700 121.441 1.259 1
1 486 . 18 1 1 A 38 38 VAL H H 38 7.660 7.430 0.230 1
1 487 . 18 1 1 A 38 38 VAL HA H 38 3.870 3.985 -0.115 1
1 495 . 18 1 1 A 38 38 VAL C C 38 175.600 175.606 -0.006 1
1 496 . 18 1 1 A 38 38 VAL CA C 38 61.100 61.185 -0.085 1
1 497 . 18 1 1 A 38 38 VAL CB C 38 30.700 31.228 -0.528 1
1 500 . 18 1 1 A 38 38 VAL N N 38 108.200 112.665 -4.465 1
1 501 . 18 1 1 A 39 39 GLY H H 39 7.090 7.541 -0.451 1
1 502 . 18 1 1 A 39 39 GLY HA2 H 39 3.320 3.728 -0.408 1
1 503 . 18 1 1 A 39 39 GLY HA3 H 39 3.730 3.757 -0.027 1
1 504 . 18 1 1 A 39 39 GLY C C 39 173.600 174.419 -0.819 1
1 505 . 18 1 1 A 39 39 GLY CA C 39 46.100 45.105 0.995 1
1 506 . 18 1 1 A 39 39 GLY N N 39 107.600 110.076 -2.476 1
1 507 . 18 1 1 A 40 40 GLU H H 40 7.730 8.059 -0.329 1
1 508 . 18 1 1 A 40 40 GLU HA H 40 1.090 3.262 -2.172 1
1 513 . 18 1 1 A 40 40 GLU CA C 40 55.700 56.712 -1.012 1
1 514 . 18 1 1 A 40 40 GLU CB C 40 27.200 27.575 -0.375 1
1 516 . 18 1 1 A 40 40 GLU N N 40 114.400 118.726 -4.326 1
1 517 . 18 1 1 A 41 41 PRO HA H 41 4.310 4.555 -0.245 1
1 524 . 18 1 1 A 41 41 PRO CA C 41 62.300 62.394 -0.094 1
1 525 . 18 1 1 A 41 41 PRO CB C 41 32.700 32.472 0.228 1
1 528 . 18 1 1 A 42 42 GLU H H 42 8.110 8.551 -0.441 1
1 529 . 18 1 1 A 42 42 GLU C C 42 175.800 176.024 -0.224 1
1 530 . 18 1 1 A 42 42 GLU CA C 42 57.800 56.710 1.090 1
1 531 . 18 1 1 A 42 42 GLU CB C 42 30.600 30.147 0.453 1
1 533 . 18 1 1 A 42 42 GLU N N 42 119.100 121.233 -2.133 1
1 534 . 18 1 1 A 43 43 LEU H H 43 8.140 8.723 -0.583 1
1 535 . 18 1 1 A 43 43 LEU HA H 43 4.840 4.283 0.557 1
1 545 . 18 1 1 A 43 43 LEU C C 43 177.300 177.122 0.178 1
1 546 . 18 1 1 A 43 43 LEU CA C 43 53.700 55.098 -1.398 1
1 547 . 18 1 1 A 43 43 LEU CB C 43 43.900 42.138 1.762 1
1 551 . 18 1 1 A 43 43 LEU N N 43 124.700 126.654 -1.954 1
1 552 . 18 1 1 A 44 44 LYS H H 44 8.640 8.185 0.455 1
1 553 . 18 1 1 A 44 44 LYS HA H 44 4.500 4.481 0.019 1
1 562 . 18 1 1 A 44 44 LYS C C 44 174.500 176.031 -1.531 1
1 563 . 18 1 1 A 44 44 LYS CA C 44 54.700 55.952 -1.252 1
1 564 . 18 1 1 A 44 44 LYS CB C 44 36.200 33.156 3.044 1
1 568 . 18 1 1 A 44 44 LYS N N 44 123.300 122.943 0.357 1
1 569 . 18 1 1 A 45 45 THR H H 45 7.990 8.733 -0.743 1
1 570 . 18 1 1 A 45 45 THR HA H 45 5.700 5.681 0.019 1
1 575 . 18 1 1 A 45 45 THR C C 45 175.100 173.764 1.336 1
1 576 . 18 1 1 A 45 45 THR CA C 45 59.600 59.987 -0.387 1
1 577 . 18 1 1 A 45 45 THR CB C 45 73.400 71.270 2.130 1
1 579 . 18 1 1 A 45 45 THR N N 45 106.900 114.393 -7.493 1
1 580 . 18 1 1 A 46 46 TYR H H 46 8.470 9.057 -0.587 1
1 581 . 18 1 1 A 46 46 TYR HA H 46 4.930 5.913 -0.983 1
1 586 . 18 1 1 A 46 46 TYR C C 46 172.400 173.878 -1.478 1
1 587 . 18 1 1 A 46 46 TYR CA C 46 57.100 55.243 1.857 1
1 588 . 18 1 1 A 46 46 TYR CB C 46 40.200 42.099 -1.899 1
1 591 . 18 1 1 A 46 46 TYR N N 46 117.100 119.485 -2.385 1
1 592 . 18 1 1 A 47 47 VAL H H 47 8.430 8.936 -0.506 1
1 593 . 18 1 1 A 47 47 VAL HA H 47 4.890 4.422 0.468 1
1 601 . 18 1 1 A 47 47 VAL C C 47 175.800 174.650 1.150 1
1 602 . 18 1 1 A 47 47 VAL CA C 47 60.800 62.417 -1.617 1
1 603 . 18 1 1 A 47 47 VAL CB C 47 34.800 31.446 3.354 1
1 606 . 18 1 1 A 47 47 VAL N N 47 119.200 121.894 -2.694 1
1 607 . 18 1 1 A 48 48 ILE H H 48 8.680 8.996 -0.316 1
1 608 . 18 1 1 A 48 48 ILE HA H 48 4.560 4.992 -0.432 1
1 618 . 18 1 1 A 48 48 ILE C C 48 174.500 174.356 0.144 1
1 619 . 18 1 1 A 48 48 ILE CA C 48 59.700 59.351 0.349 1
1 620 . 18 1 1 A 48 48 ILE CB C 48 41.500 40.517 0.983 1
1 624 . 18 1 1 A 48 48 ILE N N 48 124.400 129.142 -4.742 1
1 625 . 18 1 1 A 49 49 GLU H H 49 8.320 8.795 -0.475 1
1 626 . 18 1 1 A 49 49 GLU C C 49 175.500 174.702 0.798 1
1 627 . 18 1 1 A 49 49 GLU CA C 49 55.500 56.042 -0.542 1
1 628 . 18 1 1 A 49 49 GLU CB C 49 31.800 30.351 1.449 1
1 630 . 18 1 1 A 49 49 GLU N N 49 123.400 128.285 -4.885 1
1 631 . 18 1 1 A 50 50 ASP H H 50 8.610 9.238 -0.628 1
1 632 . 18 1 1 A 50 50 ASP C C 50 175.100 174.868 0.232 1
1 633 . 18 1 1 A 50 50 ASP CA C 50 53.100 53.053 0.047 1
1 634 . 18 1 1 A 50 50 ASP CB C 50 44.000 41.293 2.707 1
1 635 . 18 1 1 A 50 50 ASP N N 50 124.300 126.742 -2.442 1
1 636 . 18 1 1 A 51 51 GLU H H 51 8.450 8.751 -0.301 1
1 637 . 18 1 1 A 51 51 GLU C C 51 175.900 176.613 -0.713 1
1 638 . 18 1 1 A 51 51 GLU CA C 51 56.000 55.403 0.597 1
1 639 . 18 1 1 A 51 51 GLU CB C 51 31.700 28.740 2.960 1
1 640 . 18 1 1 A 51 51 GLU N N 51 121.300 125.854 -4.554 1
1 641 . 18 1 1 A 52 52 ILE H H 52 8.480 8.128 0.352 1
1 642 . 18 1 1 A 52 52 ILE C C 52 175.400 175.110 0.290 1
1 643 . 18 1 1 A 52 52 ILE CA C 52 60.400 63.189 -2.789 1
1 644 . 18 1 1 A 52 52 ILE CB C 52 40.000 38.582 1.418 1
1 645 . 18 1 1 A 52 52 ILE N N 52 122.700 126.115 -3.415 1
1 646 . 18 1 1 A 53 53 VAL H H 53 8.140 7.805 0.335 1
1 647 . 18 1 1 A 53 53 VAL C C 53 175.600 173.850 1.750 1
1 648 . 18 1 1 A 53 53 VAL CA C 53 61.900 59.967 1.933 1
1 649 . 18 1 1 A 53 53 VAL CB C 53 33.200 34.674 -1.474 1
1 650 . 18 1 1 A 53 53 VAL N N 53 124.400 120.084 4.316 1
1 651 . 18 1 1 A 54 54 GLU H H 54 8.540 8.801 -0.261 1
1 652 . 18 1 1 A 54 54 GLU CA C 54 55.600 53.297 2.303 1
1 653 . 18 1 1 A 54 54 GLU CB C 54 34.300 30.954 3.346 1
1 654 . 18 1 1 A 54 54 GLU N N 54 125.900 127.046 -1.146 1
1 655 . 18 1 1 A 55 55 PRO C C 55 177.500 177.128 0.372 1
1 656 . 18 1 1 A 55 55 PRO CA C 55 63.400 63.148 0.252 1
1 657 . 18 1 1 A 55 55 PRO CB C 55 32.300 32.009 0.291 1
1 658 . 18 1 1 A 56 56 GLY H H 56 8.420 8.399 0.021 1
1 659 . 18 1 1 A 56 56 GLY HA2 H 56 3.830 4.073 -0.243 1
1 660 . 18 1 1 A 56 56 GLY HA3 H 56 4.000 4.075 -0.075 1
1 661 . 18 1 1 A 56 56 GLY C C 56 174.500 175.440 -0.940 1
1 662 . 18 1 1 A 56 56 GLY CA C 56 45.400 45.609 -0.209 1
1 663 . 18 1 1 A 56 56 GLY N N 56 109.700 107.712 1.988 1
1 664 . 18 1 1 A 57 57 GLU H H 57 8.180 8.118 0.062 1
1 665 . 18 1 1 A 57 57 GLU C C 57 176.300 175.836 0.464 1
1 666 . 18 1 1 A 57 57 GLU CA C 57 57.500 59.107 -1.607 1
1 667 . 18 1 1 A 57 57 GLU CB C 57 30.400 30.351 0.049 1
1 668 . 18 1 1 A 57 57 GLU N N 57 120.900 121.619 -0.719 1
1 669 . 18 1 1 A 58 58 TYR H H 58 8.020 7.723 0.297 1
1 670 . 18 1 1 A 58 58 TYR C C 58 175.100 173.858 1.242 1
1 671 . 18 1 1 A 58 58 TYR CA C 58 57.400 56.817 0.583 1
1 672 . 18 1 1 A 58 58 TYR CB C 58 38.900 42.741 -3.841 1
1 673 . 18 1 1 A 58 58 TYR N N 58 118.800 115.348 3.452 1
1 674 . 18 1 1 A 59 59 ASP H H 59 7.950 8.946 -0.996 1
1 675 . 18 1 1 A 59 59 ASP CA C 59 52.700 51.019 1.681 1
1 676 . 18 1 1 A 59 59 ASP CB C 59 41.000 41.701 -0.701 1
1 677 . 18 1 1 A 59 59 ASP N N 59 123.500 123.172 0.328 1
1 678 . 18 1 1 A 61 61 PRO HA H 61 4.510 4.355 0.155 1
1 685 . 18 1 1 A 61 61 PRO C C 61 176.500 178.366 -1.866 1
1 686 . 18 1 1 A 61 61 PRO CA C 61 63.700 65.149 -1.449 1
1 687 . 18 1 1 A 61 61 PRO CB C 61 34.200 31.530 2.670 1
1 690 . 18 1 1 A 62 62 GLU H H 62 8.490 7.962 0.528 1
1 691 . 18 1 1 A 62 62 GLU N N 62 124.600 118.327 6.273 1
1 692 . 18 1 1 A 64 64 LYS C C 64 176.300 175.751 0.549 1
1 693 . 18 1 1 A 64 64 LYS CA C 64 57.000 54.071 2.929 1
1 694 . 18 1 1 A 64 64 LYS CB C 64 33.100 34.851 -1.751 1
1 695 . 18 1 1 A 65 65 TYR H H 65 7.960 8.220 -0.260 1
1 696 . 18 1 1 A 65 65 TYR C C 65 176.000 175.105 0.895 1
1 697 . 18 1 1 A 65 65 TYR CA C 65 57.800 57.838 -0.038 1
1 698 . 18 1 1 A 65 65 TYR CB C 65 38.800 39.488 -0.688 1
1 699 . 18 1 1 A 65 65 TYR N N 65 119.300 118.492 0.808 1
1 700 . 18 1 1 A 66 66 THR H H 66 7.820 7.741 0.079 1
1 701 . 18 1 1 A 66 66 THR HA H 66 4.280 4.747 -0.467 1
1 706 . 18 1 1 A 66 66 THR C C 66 174.100 174.162 -0.062 1
1 707 . 18 1 1 A 66 66 THR CA C 66 62.100 61.594 0.506 1
1 708 . 18 1 1 A 66 66 THR CB C 66 70.000 70.750 -0.750 1
1 710 . 18 1 1 A 66 66 THR N N 66 113.900 114.211 -0.311 1
1 711 . 18 1 1 A 67 67 ASN H H 67 8.270 8.688 -0.418 1
1 712 . 18 1 1 A 67 67 ASN C C 67 174.100 175.480 -1.380 1
1 713 . 18 1 1 A 67 67 ASN CA C 67 53.400 55.971 -2.571 1
1 714 . 18 1 1 A 67 67 ASN CB C 67 39.300 40.586 -1.286 1
1 715 . 18 1 1 A 67 67 ASN N N 67 121.400 125.778 -4.378 1
1 716 . 18 1 1 A 68 68 VAL H H 68 7.660 7.381 0.279 1
1 717 . 18 1 1 A 68 68 VAL C C 68 175.500 173.950 1.550 1
1 718 . 18 1 1 A 68 68 VAL CA C 68 61.800 59.480 2.320 1
1 719 . 18 1 1 A 68 68 VAL CB C 68 33.700 34.916 -1.216 1
1 720 . 18 1 1 A 68 68 VAL N N 68 119.400 114.460 4.940 1
1 721 . 18 1 1 A 69 69 LYS H H 69 8.690 8.886 -0.196 1
1 722 . 18 1 1 A 69 69 LYS C C 69 175.200 174.900 0.300 1
1 723 . 18 1 1 A 69 69 LYS CA C 69 55.200 54.744 0.456 1
1 724 . 18 1 1 A 69 69 LYS CB C 69 35.200 34.441 0.759 1
1 725 . 18 1 1 A 69 69 LYS N N 69 126.500 123.496 3.004 1
1 726 . 18 1 1 A 70 70 LYS H H 70 8.230 8.802 -0.572 1
1 727 . 18 1 1 A 70 70 LYS C C 70 176.400 176.020 0.380 1
1 728 . 18 1 1 A 70 70 LYS CA C 70 55.600 55.991 -0.391 1
1 729 . 18 1 1 A 70 70 LYS CB C 70 33.800 33.138 0.662 1
1 730 . 18 1 1 A 70 70 LYS N N 70 122.700 127.150 -4.450 1
1 731 . 18 1 1 A 71 71 VAL H H 71 8.530 8.754 -0.224 1
1 732 . 18 1 1 A 71 71 VAL HA H 71 4.510 4.861 -0.351 1
1 733 . 18 1 1 A 71 71 VAL C C 71 174.700 175.084 -0.384 1
1 734 . 18 1 1 A 71 71 VAL CA C 71 60.900 60.914 -0.014 1
1 735 . 18 1 1 A 71 71 VAL CB C 71 34.800 33.360 1.440 1
1 738 . 18 1 1 A 71 71 VAL N N 71 121.200 119.999 1.201 1
1 739 . 18 1 1 A 72 72 LYS H H 72 8.210 8.750 -0.540 1
1 740 . 18 1 1 A 72 72 LYS HA H 72 4.800 4.589 0.211 1
1 747 . 18 1 1 A 72 72 LYS C C 72 176.200 175.405 0.795 1
1 748 . 18 1 1 A 72 72 LYS CA C 72 55.700 56.160 -0.460 1
1 749 . 18 1 1 A 72 72 LYS CB C 72 33.700 32.821 0.879 1
1 752 . 18 1 1 A 72 72 LYS N N 72 123.600 126.289 -2.689 1
1 753 . 18 1 1 A 73 73 ILE H H 73 8.890 9.506 -0.616 1
1 754 . 18 1 1 A 73 73 ILE C C 73 174.400 174.088 0.312 1
1 755 . 18 1 1 A 73 73 ILE CA C 73 60.400 60.326 0.074 1
1 756 . 18 1 1 A 73 73 ILE CB C 73 40.800 39.340 1.460 1
1 760 . 18 1 1 A 73 73 ILE N N 73 125.100 126.245 -1.145 1
1 761 . 18 1 1 A 74 74 LYS H H 74 8.420 8.870 -0.450 1
1 762 . 18 1 1 A 74 74 LYS HA H 74 4.800 4.748 0.052 1
1 771 . 18 1 1 A 74 74 LYS C C 74 175.600 175.089 0.511 1
1 772 . 18 1 1 A 74 74 LYS CA C 74 56.200 55.290 0.910 1
1 773 . 18 1 1 A 74 74 LYS CB C 74 34.300 32.675 1.625 1
1 777 . 18 1 1 A 74 74 LYS N N 74 126.400 128.569 -2.169 1
1 778 . 18 1 1 A 75 75 LYS H H 75 9.090 8.350 0.740 1
1 779 . 18 1 1 A 75 75 LYS HA H 75 4.800 4.788 0.012 1
1 788 . 18 1 1 A 75 75 LYS C C 75 174.900 175.072 -0.172 1
1 789 . 18 1 1 A 75 75 LYS CA C 75 53.200 55.489 -2.289 1
1 790 . 18 1 1 A 75 75 LYS CB C 75 34.200 33.867 0.333 1
1 794 . 18 1 1 A 75 75 LYS N N 75 127.500 126.790 0.710 1
1 795 . 18 1 1 A 76 76 VAL H H 76 8.610 8.303 0.307 1
1 796 . 18 1 1 A 76 76 VAL HA H 76 5.340 5.127 0.213 1
1 804 . 18 1 1 A 76 76 VAL C C 76 171.400 174.120 -2.720 1
1 805 . 18 1 1 A 76 76 VAL CA C 76 58.000 59.616 -1.616 1
1 806 . 18 1 1 A 76 76 VAL CB C 76 36.400 34.844 1.556 1
1 809 . 18 1 1 A 76 76 VAL N N 76 120.100 120.915 -0.815 1
1 810 . 18 1 1 A 77 77 TYR H H 77 9.110 9.257 -0.147 1
1 811 . 18 1 1 A 77 77 TYR HA H 77 6.150 5.812 0.338 1
1 816 . 18 1 1 A 77 77 TYR C C 77 173.600 173.224 0.376 1
1 817 . 18 1 1 A 77 77 TYR CA C 77 56.200 55.823 0.377 1
1 818 . 18 1 1 A 77 77 TYR CB C 77 44.000 41.248 2.752 1
1 821 . 18 1 1 A 77 77 TYR N N 77 121.300 122.157 -0.857 1
1 822 . 18 1 1 A 78 78 PHE H H 78 8.190 8.723 -0.533 1
1 823 . 18 1 1 A 78 78 PHE HA H 78 5.130 5.618 -0.488 1
1 829 . 18 1 1 A 78 78 PHE C C 78 173.600 172.443 1.157 1
1 830 . 18 1 1 A 78 78 PHE CA C 78 55.900 55.182 0.718 1
1 831 . 18 1 1 A 78 78 PHE CB C 78 42.500 43.101 -0.601 1
1 835 . 18 1 1 A 78 78 PHE N N 78 112.700 116.886 -4.186 1
1 836 . 18 1 1 A 79 79 GLU H H 79 8.920 9.067 -0.147 1
1 837 . 18 1 1 A 79 79 GLU HA H 79 5.390 5.426 -0.036 1
1 842 . 18 1 1 A 79 79 GLU C C 79 177.000 176.230 0.770 1
1 843 . 18 1 1 A 79 79 GLU CA C 79 54.900 54.859 0.041 1
1 844 . 18 1 1 A 79 79 GLU CB C 79 33.600 33.427 0.173 1
1 846 . 18 1 1 A 79 79 GLU N N 79 120.500 120.107 0.393 1
1 847 . 18 1 1 A 80 80 THR H H 80 8.970 8.621 0.349 1
1 848 . 18 1 1 A 80 80 THR HA H 80 4.700 4.863 -0.163 1
1 854 . 18 1 1 A 80 80 THR C C 80 177.000 175.940 1.060 1
1 855 . 18 1 1 A 80 80 THR CA C 80 61.300 60.290 1.010 1
1 856 . 18 1 1 A 80 80 THR CB C 80 70.500 71.785 -1.285 1
1 858 . 18 1 1 A 80 80 THR N N 80 113.200 116.950 -3.750 1
1 859 . 18 1 1 A 81 81 LEU H H 81 8.610 8.976 -0.366 1
1 860 . 18 1 1 A 81 81 LEU HA H 81 4.230 4.070 0.160 1
1 870 . 18 1 1 A 81 81 LEU C C 81 177.400 178.008 -0.608 1
1 871 . 18 1 1 A 81 81 LEU CA C 81 57.700 56.988 0.712 1
1 872 . 18 1 1 A 81 81 LEU CB C 81 42.400 41.453 0.947 1
1 876 . 18 1 1 A 81 81 LEU N N 81 120.900 121.991 -1.091 1
1 877 . 18 1 1 A 82 82 ASP H H 82 8.850 7.853 0.997 1
1 878 . 18 1 1 A 82 82 ASP HA H 82 4.670 4.664 0.006 1
1 881 . 18 1 1 A 82 82 ASP C C 82 174.100 175.256 -1.156 1
1 882 . 18 1 1 A 82 82 ASP CA C 82 52.700 53.974 -1.274 1
1 883 . 18 1 1 A 82 82 ASP CB C 82 37.900 40.949 -3.049 1
1 884 . 18 1 1 A 82 82 ASP N N 82 112.300 117.776 -5.476 1
1 885 . 18 1 1 A 83 83 ASN H H 83 7.790 8.079 -0.289 1
1 886 . 18 1 1 A 83 83 ASN HA H 83 4.270 4.819 -0.549 1
1 891 . 18 1 1 A 83 83 ASN C C 83 176.100 174.630 1.470 1
1 892 . 18 1 1 A 83 83 ASN CA C 83 55.300 54.563 0.737 1
1 893 . 18 1 1 A 83 83 ASN CB C 83 36.900 37.148 -0.248 1
1 894 . 18 1 1 A 83 83 ASN N N 83 113.000 114.815 -1.815 1
1 896 . 18 1 1 A 84 84 VAL H H 84 7.660 7.837 -0.177 1
1 897 . 18 1 1 A 84 84 VAL HA H 84 4.270 4.038 0.232 1
1 905 . 18 1 1 A 84 84 VAL C C 84 175.800 175.158 0.642 1
1 906 . 18 1 1 A 84 84 VAL CA C 84 61.500 62.522 -1.022 1
1 907 . 18 1 1 A 84 84 VAL CB C 84 33.500 32.149 1.351 1
1 910 . 18 1 1 A 84 84 VAL N N 84 119.700 119.670 0.030 1
1 911 . 18 1 1 A 85 85 ARG H H 85 8.180 9.319 -1.139 1
1 912 . 18 1 1 A 85 85 ARG HA H 85 4.870 4.905 -0.035 1
1 920 . 18 1 1 A 85 85 ARG C C 85 174.000 174.963 -0.963 1
1 921 . 18 1 1 A 85 85 ARG CA C 85 55.700 55.169 0.531 1
1 922 . 18 1 1 A 85 85 ARG CB C 85 32.600 31.117 1.483 1
1 925 . 18 1 1 A 85 85 ARG N N 85 124.800 127.739 -2.939 1
1 927 . 18 1 1 A 86 86 VAL H H 86 8.570 8.472 0.098 1
1 928 . 18 1 1 A 86 86 VAL HA H 86 4.580 4.716 -0.136 1
1 936 . 18 1 1 A 86 86 VAL C C 86 175.700 175.302 0.398 1
1 937 . 18 1 1 A 86 86 VAL CA C 86 61.700 62.097 -0.397 1
1 938 . 18 1 1 A 86 86 VAL CB C 86 30.900 30.839 0.061 1
1 941 . 18 1 1 A 86 86 VAL N N 86 127.300 124.902 2.398 1
1 942 . 18 1 1 A 87 87 VAL H H 87 8.790 8.588 0.202 1
1 943 . 18 1 1 A 87 87 VAL HA H 87 5.010 4.853 0.157 1
1 951 . 18 1 1 A 87 87 VAL C C 87 175.500 174.720 0.780 1
1 952 . 18 1 1 A 87 87 VAL CA C 87 61.900 60.977 0.923 1
1 953 . 18 1 1 A 87 87 VAL CB C 87 36.300 32.981 3.319 1
1 956 . 18 1 1 A 87 87 VAL N N 87 125.700 128.561 -2.861 1
1 957 . 18 1 1 A 88 88 THR H H 88 8.350 8.789 -0.439 1
1 958 . 18 1 1 A 88 88 THR HA H 88 4.620 4.638 -0.018 1
1 964 . 18 1 1 A 88 88 THR C C 88 173.300 172.053 1.247 1
1 965 . 18 1 1 A 88 88 THR CA C 88 61.700 60.806 0.894 1
1 966 . 18 1 1 A 88 88 THR CB C 88 70.400 72.158 -1.758 1
1 968 . 18 1 1 A 88 88 THR N N 88 117.500 120.656 -3.156 1
1 969 . 18 1 1 A 89 89 ASP H H 89 7.700 8.633 -0.933 1
1 970 . 18 1 1 A 89 89 ASP HA H 89 4.480 4.688 -0.208 1
1 973 . 18 1 1 A 89 89 ASP C C 89 175.900 177.370 -1.470 1
1 974 . 18 1 1 A 89 89 ASP CA C 89 55.900 54.256 1.644 1
1 975 . 18 1 1 A 89 89 ASP CB C 89 43.900 41.791 2.109 1
1 976 . 18 1 1 A 89 89 ASP N N 89 120.800 124.936 -4.136 1
1 977 . 18 1 1 A 90 90 TYR H H 90 8.240 9.008 -0.768 1
1 978 . 18 1 1 A 90 90 TYR HA H 90 3.920 4.157 -0.237 1
1 983 . 18 1 1 A 90 90 TYR C C 90 176.400 177.647 -1.247 1
1 984 . 18 1 1 A 90 90 TYR CA C 90 62.300 61.093 1.207 1
1 985 . 18 1 1 A 90 90 TYR CB C 90 39.500 39.018 0.482 1
1 988 . 18 1 1 A 90 90 TYR N N 90 126.100 128.142 -2.042 1
1 989 . 18 1 1 A 91 91 SER H H 91 9.160 7.768 1.392 1
1 990 . 18 1 1 A 91 91 SER HA H 91 4.000 4.062 -0.062 1
1 993 . 18 1 1 A 91 91 SER C C 91 178.000 177.349 0.651 1
1 994 . 18 1 1 A 91 91 SER CA C 91 62.600 61.474 1.126 1
1 995 . 18 1 1 A 91 91 SER CB C 91 62.200 62.703 -0.503 1
1 996 . 18 1 1 A 91 91 SER N N 91 116.600 114.729 1.871 1
1 997 . 18 1 1 A 92 92 GLU H H 92 8.590 8.239 0.351 1
1 998 . 18 1 1 A 92 92 GLU HA H 92 4.050 4.007 0.043 1
1 1003 . 18 1 1 A 92 92 GLU C C 92 179.400 178.963 0.437 1
1 1004 . 18 1 1 A 92 92 GLU CA C 92 58.900 59.323 -0.423 1
1 1005 . 18 1 1 A 92 92 GLU CB C 92 30.600 29.342 1.258 1
1 1007 . 18 1 1 A 92 92 GLU N N 92 120.200 121.663 -1.463 1
1 1008 . 18 1 1 A 93 93 PHE H H 93 7.870 8.312 -0.442 1
1 1009 . 18 1 1 A 93 93 PHE HA H 93 4.050 4.134 -0.084 1
1 1015 . 18 1 1 A 93 93 PHE C C 93 176.500 177.867 -1.367 1
1 1016 . 18 1 1 A 93 93 PHE CA C 93 62.200 61.305 0.895 1
1 1017 . 18 1 1 A 93 93 PHE CB C 93 39.700 39.386 0.314 1
1 1021 . 18 1 1 A 93 93 PHE N N 93 120.200 120.594 -0.394 1
1 1022 . 18 1 1 A 94 94 GLN H H 94 8.190 8.388 -0.198 1
1 1023 . 18 1 1 A 94 94 GLN HA H 94 3.390 3.619 -0.229 1
1 1030 . 18 1 1 A 94 94 GLN C C 94 178.600 178.633 -0.033 1
1 1031 . 18 1 1 A 94 94 GLN CA C 94 58.800 58.899 -0.099 1
1 1032 . 18 1 1 A 94 94 GLN CB C 94 28.400 27.966 0.434 1
1 1034 . 18 1 1 A 94 94 GLN N N 94 116.800 118.318 -1.518 1
1 1036 . 18 1 1 A 95 95 LYS H H 95 7.060 7.661 -0.601 1
1 1037 . 18 1 1 A 95 95 LYS HA H 95 3.780 4.082 -0.302 1
1 1046 . 18 1 1 A 95 95 LYS C C 95 179.300 179.088 0.212 1
1 1047 . 18 1 1 A 95 95 LYS CA C 95 59.900 58.772 1.128 1
1 1048 . 18 1 1 A 95 95 LYS CB C 95 32.700 31.998 0.702 1
1 1052 . 18 1 1 A 95 95 LYS N N 95 117.500 120.646 -3.146 1
1 1053 . 18 1 1 A 96 96 ILE H H 96 7.240 7.608 -0.368 1
1 1054 . 18 1 1 A 96 96 ILE HA H 96 3.420 3.657 -0.237 1
1 1064 . 18 1 1 A 96 96 ILE C C 96 177.800 178.060 -0.260 1
1 1065 . 18 1 1 A 96 96 ILE CA C 96 64.300 65.019 -0.719 1
1 1066 . 18 1 1 A 96 96 ILE CB C 96 37.400 37.454 -0.054 1
1 1070 . 18 1 1 A 96 96 ILE N N 96 120.700 122.256 -1.556 1
1 1071 . 18 1 1 A 97 97 LEU H H 97 7.690 8.071 -0.381 1
1 1072 . 18 1 1 A 97 97 LEU HA H 97 3.580 3.746 -0.166 1
1 1082 . 18 1 1 A 97 97 LEU C C 97 179.900 179.107 0.793 1
1 1083 . 18 1 1 A 97 97 LEU CA C 97 58.100 57.200 0.900 1
1 1084 . 18 1 1 A 97 97 LEU CB C 97 41.500 40.397 1.103 1
1 1088 . 18 1 1 A 97 97 LEU N N 97 120.000 119.660 0.340 1
1 1089 . 18 1 1 A 98 98 LYS H H 98 7.510 8.221 -0.711 1
1 1090 . 18 1 1 A 98 98 LYS HA H 98 3.950 3.776 0.174 1
1 1099 . 18 1 1 A 98 98 LYS C C 98 178.700 178.667 0.033 1
1 1100 . 18 1 1 A 98 98 LYS CA C 98 58.700 58.705 -0.005 1
1 1101 . 18 1 1 A 98 98 LYS CB C 98 32.500 32.064 0.436 1
1 1105 . 18 1 1 A 98 98 LYS N N 98 117.300 121.818 -4.518 1
1 1106 . 18 1 1 A 99 99 LYS H H 99 7.470 7.429 0.041 1
1 1107 . 18 1 1 A 99 99 LYS HA H 99 4.080 4.042 0.038 1
1 1116 . 18 1 1 A 99 99 LYS C C 99 178.100 178.999 -0.899 1
1 1117 . 18 1 1 A 99 99 LYS CA C 99 58.400 59.923 -1.523 1
1 1118 . 18 1 1 A 99 99 LYS CB C 99 33.000 32.178 0.822 1
1 1122 . 18 1 1 A 99 99 LYS N N 99 119.000 118.509 0.491 1
1 1123 . 18 1 1 A 100 100 ARG H H 100 8.020 7.786 0.234 1
1 1124 . 18 1 1 A 100 100 ARG HA H 100 4.210 4.217 -0.007 1
1 1131 . 18 1 1 A 100 100 ARG C C 100 177.500 176.459 1.041 1
1 1132 . 18 1 1 A 100 100 ARG CA C 100 56.700 58.306 -1.606 1
1 1133 . 18 1 1 A 100 100 ARG CB C 100 30.500 30.777 -0.277 1
1 1136 . 18 1 1 A 100 100 ARG N N 100 117.300 119.185 -1.885 1
1 1137 . 18 1 1 A 101 101 GLY H H 101 7.910 8.187 -0.277 1
1 1138 . 18 1 1 A 101 101 GLY HA2 H 101 3.980 4.013 -0.033 1
1 1139 . 18 1 1 A 101 101 GLY HA3 H 101 4.020 4.066 -0.046 1
1 1140 . 18 1 1 A 101 101 GLY C C 101 174.400 175.110 -0.710 1
1 1141 . 18 1 1 A 101 101 GLY CA C 101 46.000 46.401 -0.401 1
1 1142 . 18 1 1 A 101 101 GLY N N 101 108.000 107.594 0.406 1
1 1143 . 18 1 1 A 102 102 THR H H 102 7.880 7.672 0.208 1
1 1144 . 18 1 1 A 102 102 THR HA H 102 4.360 4.166 0.194 1
1 1149 . 18 1 1 A 102 102 THR C C 102 174.400 175.234 -0.834 1
1 1150 . 18 1 1 A 102 102 THR CA C 102 62.100 63.387 -1.287 1
1 1151 . 18 1 1 A 102 102 THR CB C 102 70.500 69.005 1.495 1
1 1153 . 18 1 1 A 102 102 THR N N 102 113.900 114.802 -0.902 1
1 1154 . 18 1 1 A 103 103 LYS H H 103 8.440 8.715 -0.275 1
1 1155 . 18 1 1 A 103 103 LYS C C 103 176.400 178.078 -1.678 1
1 1156 . 18 1 1 A 103 103 LYS CA C 103 56.600 58.859 -2.259 1
1 1157 . 18 1 1 A 103 103 LYS CB C 103 33.300 32.420 0.880 1
1 1158 . 18 1 1 A 103 103 LYS N N 103 124.000 127.415 -3.415 1
1 1159 . 18 1 1 A 104 104 LEU H H 104 8.180 7.805 0.375 1
1 1160 . 18 1 1 A 104 104 LEU HA H 104 4.270 3.790 0.480 1
1 1170 . 18 1 1 A 104 104 LEU C C 104 177.100 179.057 -1.957 1
1 1171 . 18 1 1 A 104 104 LEU CA C 104 55.500 57.977 -2.477 1
1 1172 . 18 1 1 A 104 104 LEU CB C 104 42.500 41.544 0.956 1
1 1176 . 18 1 1 A 104 104 LEU N N 104 123.500 119.941 3.559 1
1 1177 . 18 1 1 A 105 105 GLU H H 105 8.270 7.321 0.949 1
1 1178 . 18 1 1 A 105 105 GLU CA C 105 56.700 58.349 -1.649 1
1 1179 . 18 1 1 A 105 105 GLU CB C 105 30.800 30.546 0.254 1
1 13 . 19 1 1 A 2 2 ASN HA H 2 4.980 5.207 -0.227 1
1 18 . 19 1 1 A 2 2 ASN C C 2 176.300 175.505 0.795 1
1 19 . 19 1 1 A 2 2 ASN CA C 2 52.500 51.369 1.131 1
1 20 . 19 1 1 A 2 2 ASN CB C 2 40.900 42.085 -1.185 1
1 22 . 19 1 1 A 3 3 SER H H 3 9.940 9.451 0.489 1
1 23 . 19 1 1 A 3 3 SER HA H 3 3.720 4.235 -0.515 1
1 26 . 19 1 1 A 3 3 SER C C 3 175.900 176.460 -0.560 1
1 27 . 19 1 1 A 3 3 SER CA C 3 63.300 61.089 2.211 1
1 28 . 19 1 1 A 3 3 SER CB C 3 61.700 62.619 -0.919 1
1 29 . 19 1 1 A 3 3 SER N N 3 118.200 117.192 1.008 1
1 30 . 19 1 1 A 4 4 GLU H H 4 8.450 7.680 0.770 1
1 31 . 19 1 1 A 4 4 GLU HA H 4 4.010 4.042 -0.032 1
1 36 . 19 1 1 A 4 4 GLU C C 4 178.800 179.190 -0.390 1
1 37 . 19 1 1 A 4 4 GLU CA C 4 60.300 59.202 1.098 1
1 38 . 19 1 1 A 4 4 GLU CB C 4 29.100 29.273 -0.173 1
1 40 . 19 1 1 A 4 4 GLU N N 4 123.600 121.603 1.997 1
1 41 . 19 1 1 A 5 5 VAL H H 5 7.590 7.832 -0.242 1
1 42 . 19 1 1 A 5 5 VAL HA H 5 3.850 3.587 0.263 1
1 50 . 19 1 1 A 5 5 VAL C C 5 179.100 178.475 0.625 1
1 51 . 19 1 1 A 5 5 VAL CA C 5 65.800 66.361 -0.561 1
1 52 . 19 1 1 A 5 5 VAL CB C 5 32.300 31.537 0.763 1
1 55 . 19 1 1 A 5 5 VAL N N 5 119.300 119.630 -0.330 1
1 56 . 19 1 1 A 6 6 ILE H H 6 7.240 8.089 -0.849 1
1 57 . 19 1 1 A 6 6 ILE HA H 6 3.580 3.500 0.080 1
1 67 . 19 1 1 A 6 6 ILE C C 6 177.000 178.074 -1.074 1
1 68 . 19 1 1 A 6 6 ILE CA C 6 65.300 65.862 -0.562 1
1 69 . 19 1 1 A 6 6 ILE CB C 6 37.900 37.867 0.033 1
1 73 . 19 1 1 A 6 6 ILE N N 6 120.300 120.795 -0.495 1
1 74 . 19 1 1 A 7 7 LYS H H 7 8.050 8.284 -0.234 1
1 75 . 19 1 1 A 7 7 LYS HA H 7 3.570 3.380 0.190 1
1 84 . 19 1 1 A 7 7 LYS C C 7 178.700 178.892 -0.192 1
1 85 . 19 1 1 A 7 7 LYS CA C 7 61.300 60.556 0.744 1
1 86 . 19 1 1 A 7 7 LYS CB C 7 32.200 32.202 -0.002 1
1 90 . 19 1 1 A 7 7 LYS N N 7 119.200 118.724 0.476 1
1 91 . 19 1 1 A 8 8 GLU H H 8 8.100 8.274 -0.174 1
1 92 . 19 1 1 A 8 8 GLU HA H 8 4.000 3.944 0.056 1
1 97 . 19 1 1 A 8 8 GLU C C 8 178.500 178.950 -0.450 1
1 98 . 19 1 1 A 8 8 GLU CA C 8 59.700 59.540 0.160 1
1 99 . 19 1 1 A 8 8 GLU CB C 8 29.600 29.423 0.177 1
1 101 . 19 1 1 A 8 8 GLU N N 8 119.400 119.777 -0.377 1
1 102 . 19 1 1 A 9 9 PHE H H 9 7.720 8.384 -0.664 1
1 103 . 19 1 1 A 9 9 PHE HA H 9 4.160 4.160 0.000 1
1 109 . 19 1 1 A 9 9 PHE C C 9 176.900 176.656 0.244 1
1 110 . 19 1 1 A 9 9 PHE CA C 9 61.300 61.253 0.047 1
1 111 . 19 1 1 A 9 9 PHE CB C 9 39.400 39.201 0.199 1
1 115 . 19 1 1 A 9 9 PHE N N 9 121.300 120.257 1.043 1
1 116 . 19 1 1 A 10 10 LEU H H 10 8.060 8.378 -0.318 1
1 117 . 19 1 1 A 10 10 LEU HA H 10 3.660 3.745 -0.085 1
1 127 . 19 1 1 A 10 10 LEU C C 10 179.000 179.055 -0.055 1
1 128 . 19 1 1 A 10 10 LEU CA C 10 58.000 57.593 0.407 1
1 129 . 19 1 1 A 10 10 LEU CB C 10 41.400 41.227 0.173 1
1 133 . 19 1 1 A 10 10 LEU N N 10 118.000 118.768 -0.768 1
1 134 . 19 1 1 A 11 11 GLU H H 11 7.990 8.404 -0.414 1
1 135 . 19 1 1 A 11 11 GLU HA H 11 4.110 3.949 0.161 1
1 140 . 19 1 1 A 11 11 GLU C C 11 174.200 179.062 -4.862 1
1 141 . 19 1 1 A 11 11 GLU CA C 11 59.200 59.663 -0.463 1
1 142 . 19 1 1 A 11 11 GLU CB C 11 29.300 29.031 0.269 1
1 144 . 19 1 1 A 11 11 GLU N N 11 118.300 119.439 -1.139 1
1 145 . 19 1 1 A 12 12 ASP H H 12 8.080 8.161 -0.081 1
1 146 . 19 1 1 A 12 12 ASP HA H 12 4.340 4.309 0.031 1
1 149 . 19 1 1 A 12 12 ASP C C 12 178.900 178.172 0.728 1
1 150 . 19 1 1 A 12 12 ASP CA C 12 57.600 57.848 -0.248 1
1 151 . 19 1 1 A 12 12 ASP CB C 12 41.000 41.386 -0.386 1
1 152 . 19 1 1 A 12 12 ASP N N 12 121.800 119.379 2.421 1
1 153 . 19 1 1 A 13 13 ILE H H 13 7.610 7.462 0.148 1
1 154 . 19 1 1 A 13 13 ILE HA H 13 4.240 4.019 0.221 1
1 164 . 19 1 1 A 13 13 ILE C C 13 176.800 176.835 -0.035 1
1 165 . 19 1 1 A 13 13 ILE CA C 13 62.100 61.314 0.786 1
1 166 . 19 1 1 A 13 13 ILE CB C 13 38.300 38.211 0.089 1
1 170 . 19 1 1 A 13 13 ILE N N 13 110.800 112.617 -1.817 1
1 171 . 19 1 1 A 14 14 GLY H H 14 7.640 8.028 -0.388 1
1 172 . 19 1 1 A 14 14 GLY HA2 H 14 3.810 3.926 -0.116 1
1 173 . 19 1 1 A 14 14 GLY HA3 H 14 3.880 3.927 -0.047 1
1 174 . 19 1 1 A 14 14 GLY C C 14 175.200 174.218 0.982 1
1 175 . 19 1 1 A 14 14 GLY CA C 14 46.900 46.341 0.559 1
1 176 . 19 1 1 A 14 14 GLY N N 14 111.800 112.272 -0.472 1
1 177 . 19 1 1 A 15 15 GLU H H 15 7.870 7.860 0.010 1
1 178 . 19 1 1 A 15 15 GLU HA H 15 4.680 4.752 -0.072 1
1 183 . 19 1 1 A 15 15 GLU C C 15 175.100 175.274 -0.174 1
1 184 . 19 1 1 A 15 15 GLU CA C 15 54.800 54.537 0.263 1
1 185 . 19 1 1 A 15 15 GLU CB C 15 32.200 32.755 -0.555 1
1 187 . 19 1 1 A 15 15 GLU N N 15 119.200 119.549 -0.349 1
1 188 . 19 1 1 A 16 16 ASP H H 16 8.220 8.656 -0.436 1
1 189 . 19 1 1 A 16 16 ASP HA H 16 4.680 4.910 -0.230 1
1 192 . 19 1 1 A 16 16 ASP C C 16 174.600 174.830 -0.230 1
1 193 . 19 1 1 A 16 16 ASP CA C 16 53.600 54.104 -0.504 1
1 194 . 19 1 1 A 16 16 ASP CB C 16 42.900 41.124 1.776 1
1 195 . 19 1 1 A 16 16 ASP N N 16 120.600 123.484 -2.884 1
1 196 . 19 1 1 A 17 17 TYR H H 17 7.540 8.862 -1.322 1
1 197 . 19 1 1 A 17 17 TYR HA H 17 4.910 5.549 -0.639 1
1 202 . 19 1 1 A 17 17 TYR C C 17 173.600 174.064 -0.464 1
1 203 . 19 1 1 A 17 17 TYR CA C 17 56.200 55.892 0.308 1
1 204 . 19 1 1 A 17 17 TYR CB C 17 41.100 41.747 -0.647 1
1 207 . 19 1 1 A 17 17 TYR N N 17 112.700 125.393 -12.693 1
1 208 . 19 1 1 A 18 18 ILE H H 18 7.950 8.872 -0.922 1
1 209 . 19 1 1 A 18 18 ILE HA H 18 4.330 4.643 -0.313 1
1 219 . 19 1 1 A 18 18 ILE C C 18 174.700 174.176 0.524 1
1 220 . 19 1 1 A 18 18 ILE CA C 18 60.300 60.406 -0.106 1
1 221 . 19 1 1 A 18 18 ILE CB C 18 41.000 39.772 1.228 1
1 225 . 19 1 1 A 18 18 ILE N N 18 120.400 127.968 -7.568 1
1 226 . 19 1 1 A 19 19 GLU H H 19 8.760 9.047 -0.287 1
1 227 . 19 1 1 A 19 19 GLU HA H 19 5.200 5.355 -0.155 1
1 232 . 19 1 1 A 19 19 GLU C C 19 175.200 175.766 -0.566 1
1 233 . 19 1 1 A 19 19 GLU CA C 19 55.500 54.486 1.014 1
1 234 . 19 1 1 A 19 19 GLU CB C 19 32.400 33.026 -0.626 1
1 236 . 19 1 1 A 19 19 GLU N N 19 129.000 129.696 -0.696 1
1 237 . 19 1 1 A 20 20 LEU H H 20 8.730 9.186 -0.456 1
1 238 . 19 1 1 A 20 20 LEU HA H 20 4.620 4.430 0.190 1
1 248 . 19 1 1 A 20 20 LEU C C 20 176.200 176.220 -0.020 1
1 249 . 19 1 1 A 20 20 LEU CA C 20 54.100 54.236 -0.136 1
1 250 . 19 1 1 A 20 20 LEU CB C 20 44.400 41.544 2.856 1
1 254 . 19 1 1 A 20 20 LEU N N 20 128.400 128.980 -0.580 1
1 255 . 19 1 1 A 21 21 GLU H H 21 8.700 8.588 0.112 1
1 256 . 19 1 1 A 21 21 GLU HA H 21 3.870 3.948 -0.078 1
1 261 . 19 1 1 A 21 21 GLU C C 21 176.100 175.364 0.736 1
1 262 . 19 1 1 A 21 21 GLU CA C 21 58.800 57.352 1.448 1
1 263 . 19 1 1 A 21 21 GLU CB C 21 28.200 28.766 -0.566 1
1 265 . 19 1 1 A 21 21 GLU N N 21 122.600 118.737 3.863 1
1 266 . 19 1 1 A 22 22 ASN H H 22 8.640 8.929 -0.289 1
1 267 . 19 1 1 A 22 22 ASN HA H 22 4.540 4.327 0.213 1
1 272 . 19 1 1 A 22 22 ASN C C 22 173.800 173.697 0.103 1
1 273 . 19 1 1 A 22 22 ASN CA C 22 54.600 55.076 -0.476 1
1 274 . 19 1 1 A 22 22 ASN CB C 22 38.400 37.023 1.377 1
1 275 . 19 1 1 A 22 22 ASN N N 22 118.000 114.369 3.631 1
1 277 . 19 1 1 A 23 23 GLU H H 23 7.740 7.805 -0.065 1
1 278 . 19 1 1 A 23 23 GLU HA H 23 5.430 4.700 0.730 1
1 283 . 19 1 1 A 23 23 GLU C C 23 175.400 174.924 0.476 1
1 284 . 19 1 1 A 23 23 GLU CA C 23 54.900 55.063 -0.163 1
1 285 . 19 1 1 A 23 23 GLU CB C 23 34.500 31.874 2.626 1
1 287 . 19 1 1 A 23 23 GLU N N 23 116.400 119.974 -3.574 1
1 288 . 19 1 1 A 24 24 ILE H H 24 9.050 9.336 -0.286 1
1 289 . 19 1 1 A 24 24 ILE HA H 24 4.810 4.827 -0.017 1
1 299 . 19 1 1 A 24 24 ILE C C 24 174.600 174.958 -0.358 1
1 300 . 19 1 1 A 24 24 ILE CA C 24 60.700 60.190 0.510 1
1 301 . 19 1 1 A 24 24 ILE CB C 24 41.300 39.464 1.836 1
1 305 . 19 1 1 A 24 24 ILE N N 24 122.800 127.482 -4.682 1
1 306 . 19 1 1 A 25 25 HIS H H 25 9.490 9.215 0.275 1
1 307 . 19 1 1 A 25 25 HIS HA H 25 5.090 5.357 -0.267 1
1 312 . 19 1 1 A 25 25 HIS C C 25 176.100 173.991 2.109 1
1 313 . 19 1 1 A 25 25 HIS CA C 25 56.100 54.103 1.997 1
1 314 . 19 1 1 A 25 25 HIS CB C 25 33.100 31.470 1.630 1
1 317 . 19 1 1 A 25 25 HIS N N 25 127.300 125.559 1.741 1
1 318 . 19 1 1 A 26 26 LEU H H 26 8.820 8.628 0.192 1
1 319 . 19 1 1 A 26 26 LEU HA H 26 5.160 4.774 0.386 1
1 329 . 19 1 1 A 26 26 LEU C C 26 178.000 175.834 2.166 1
1 330 . 19 1 1 A 26 26 LEU CA C 26 52.900 53.645 -0.745 1
1 331 . 19 1 1 A 26 26 LEU CB C 26 48.100 42.680 5.420 1
1 335 . 19 1 1 A 26 26 LEU N N 26 121.600 124.802 -3.202 1
1 336 . 19 1 1 A 27 27 LYS H H 27 8.990 8.491 0.499 1
1 337 . 19 1 1 A 27 27 LYS HA H 27 4.630 4.670 -0.040 1
1 345 . 19 1 1 A 27 27 LYS CA C 27 55.700 54.118 1.582 1
1 346 . 19 1 1 A 27 27 LYS CB C 27 31.900 33.996 -2.096 1
1 350 . 19 1 1 A 27 27 LYS N N 27 125.900 121.563 4.337 1
1 351 . 19 1 1 A 28 28 PRO HA H 28 4.500 4.424 0.076 1
1 358 . 19 1 1 A 28 28 PRO C C 28 177.900 178.970 -1.070 1
1 359 . 19 1 1 A 28 28 PRO CA C 28 67.400 66.284 1.116 1
1 360 . 19 1 1 A 28 28 PRO CB C 28 32.100 31.502 0.598 1
1 363 . 19 1 1 A 29 29 GLU H H 29 9.880 8.664 1.216 1
1 364 . 19 1 1 A 29 29 GLU HA H 29 4.140 4.297 -0.157 1
1 369 . 19 1 1 A 29 29 GLU C C 29 178.800 177.900 0.900 1
1 370 . 19 1 1 A 29 29 GLU CA C 29 60.600 58.519 2.081 1
1 371 . 19 1 1 A 29 29 GLU CB C 29 29.200 29.132 0.068 1
1 373 . 19 1 1 A 29 29 GLU N N 29 117.100 117.491 -0.391 1
1 374 . 19 1 1 A 30 30 VAL H H 30 7.050 7.607 -0.557 1
1 375 . 19 1 1 A 30 30 VAL HA H 30 3.850 3.980 -0.130 1
1 383 . 19 1 1 A 30 30 VAL C C 30 177.700 178.209 -0.509 1
1 384 . 19 1 1 A 30 30 VAL CA C 30 65.600 65.218 0.382 1
1 385 . 19 1 1 A 30 30 VAL CB C 30 32.100 32.136 -0.036 1
1 388 . 19 1 1 A 30 30 VAL N N 30 120.900 119.372 1.528 1
1 389 . 19 1 1 A 31 31 PHE H H 31 8.980 8.778 0.202 1
1 390 . 19 1 1 A 31 31 PHE HA H 31 3.870 4.306 -0.436 1
1 394 . 19 1 1 A 31 31 PHE C C 31 176.700 177.392 -0.692 1
1 395 . 19 1 1 A 31 31 PHE CA C 31 62.200 61.791 0.409 1
1 396 . 19 1 1 A 31 31 PHE CB C 31 39.300 39.089 0.211 1
1 398 . 19 1 1 A 31 31 PHE N N 31 121.100 120.711 0.389 1
1 399 . 19 1 1 A 32 32 TYR H H 32 8.640 8.164 0.476 1
1 400 . 19 1 1 A 32 32 TYR HA H 32 3.880 4.473 -0.593 1
1 405 . 19 1 1 A 32 32 TYR C C 32 176.000 177.684 -1.684 1
1 406 . 19 1 1 A 32 32 TYR CA C 32 63.300 61.875 1.425 1
1 407 . 19 1 1 A 32 32 TYR CB C 32 39.100 39.103 -0.003 1
1 410 . 19 1 1 A 32 32 TYR N N 32 117.400 120.580 -3.180 1
1 411 . 19 1 1 A 33 33 GLU H H 33 7.400 7.846 -0.446 1
1 412 . 19 1 1 A 33 33 GLU HA H 33 4.050 4.157 -0.107 1
1 417 . 19 1 1 A 33 33 GLU C C 33 180.200 178.987 1.213 1
1 418 . 19 1 1 A 33 33 GLU CA C 33 59.500 59.019 0.481 1
1 419 . 19 1 1 A 33 33 GLU CB C 33 29.300 29.157 0.143 1
1 421 . 19 1 1 A 33 33 GLU N N 33 116.100 119.330 -3.230 1
1 422 . 19 1 1 A 34 34 VAL H H 34 8.530 7.725 0.805 1
1 423 . 19 1 1 A 34 34 VAL HA H 34 3.350 3.545 -0.195 1
1 431 . 19 1 1 A 34 34 VAL C C 34 175.800 178.276 -2.476 1
1 432 . 19 1 1 A 34 34 VAL CA C 34 66.400 66.092 0.308 1
1 433 . 19 1 1 A 34 34 VAL CB C 34 32.200 31.584 0.616 1
1 436 . 19 1 1 A 34 34 VAL N N 34 120.600 120.341 0.259 1
1 437 . 19 1 1 A 35 35 TRP H H 35 9.100 8.465 0.635 1
1 438 . 19 1 1 A 35 35 TRP HA H 35 3.340 3.778 -0.438 1
1 447 . 19 1 1 A 35 35 TRP C C 35 178.000 178.403 -0.403 1
1 448 . 19 1 1 A 35 35 TRP CA C 35 61.800 60.625 1.175 1
1 449 . 19 1 1 A 35 35 TRP CB C 35 27.900 29.466 -1.566 1
1 455 . 19 1 1 A 35 35 TRP N N 35 121.700 121.828 -0.128 1
1 457 . 19 1 1 A 36 36 LYS H H 36 7.970 7.689 0.281 1
1 458 . 19 1 1 A 36 36 LYS HA H 36 3.330 3.517 -0.187 1
1 467 . 19 1 1 A 36 36 LYS C C 36 180.000 178.128 1.872 1
1 468 . 19 1 1 A 36 36 LYS CA C 36 59.000 58.788 0.212 1
1 469 . 19 1 1 A 36 36 LYS CB C 36 31.800 31.836 -0.036 1
1 473 . 19 1 1 A 36 36 LYS N N 36 116.300 117.686 -1.386 1
1 474 . 19 1 1 A 37 37 TYR H H 37 7.750 8.049 -0.299 1
1 475 . 19 1 1 A 37 37 TYR HA H 37 3.940 3.943 -0.003 1
1 480 . 19 1 1 A 37 37 TYR C C 37 177.600 177.625 -0.025 1
1 481 . 19 1 1 A 37 37 TYR CA C 37 61.200 61.030 0.170 1
1 482 . 19 1 1 A 37 37 TYR CB C 37 38.800 38.522 0.278 1
1 485 . 19 1 1 A 37 37 TYR N N 37 122.700 121.280 1.420 1
1 486 . 19 1 1 A 38 38 VAL H H 38 7.660 7.264 0.396 1
1 487 . 19 1 1 A 38 38 VAL HA H 38 3.870 4.176 -0.306 1
1 495 . 19 1 1 A 38 38 VAL C C 38 175.600 176.095 -0.495 1
1 496 . 19 1 1 A 38 38 VAL CA C 38 61.100 61.391 -0.291 1
1 497 . 19 1 1 A 38 38 VAL CB C 38 30.700 31.395 -0.695 1
1 500 . 19 1 1 A 38 38 VAL N N 38 108.200 112.718 -4.518 1
1 501 . 19 1 1 A 39 39 GLY H H 39 7.090 7.565 -0.475 1
1 502 . 19 1 1 A 39 39 GLY HA2 H 39 3.320 3.807 -0.487 1
1 503 . 19 1 1 A 39 39 GLY HA3 H 39 3.730 3.836 -0.106 1
1 504 . 19 1 1 A 39 39 GLY C C 39 173.600 174.458 -0.858 1
1 505 . 19 1 1 A 39 39 GLY CA C 39 46.100 45.008 1.092 1
1 506 . 19 1 1 A 39 39 GLY N N 39 107.600 109.991 -2.391 1
1 507 . 19 1 1 A 40 40 GLU H H 40 7.730 8.196 -0.466 1
1 508 . 19 1 1 A 40 40 GLU HA H 40 1.090 2.698 -1.608 1
1 513 . 19 1 1 A 40 40 GLU CA C 40 55.700 56.346 -0.646 1
1 514 . 19 1 1 A 40 40 GLU CB C 40 27.200 26.158 1.042 1
1 516 . 19 1 1 A 40 40 GLU N N 40 114.400 118.139 -3.739 1
1 517 . 19 1 1 A 41 41 PRO HA H 41 4.310 4.659 -0.349 1
1 524 . 19 1 1 A 41 41 PRO CA C 41 62.300 62.215 0.085 1
1 525 . 19 1 1 A 41 41 PRO CB C 41 32.700 32.704 -0.004 1
1 528 . 19 1 1 A 42 42 GLU H H 42 8.110 8.616 -0.506 1
1 529 . 19 1 1 A 42 42 GLU C C 42 175.800 176.423 -0.623 1
1 530 . 19 1 1 A 42 42 GLU CA C 42 57.800 56.649 1.151 1
1 531 . 19 1 1 A 42 42 GLU CB C 42 30.600 29.992 0.608 1
1 533 . 19 1 1 A 42 42 GLU N N 42 119.100 120.522 -1.422 1
1 534 . 19 1 1 A 43 43 LEU H H 43 8.140 8.810 -0.670 1
1 535 . 19 1 1 A 43 43 LEU HA H 43 4.840 4.408 0.432 1
1 545 . 19 1 1 A 43 43 LEU C C 43 177.300 176.489 0.811 1
1 546 . 19 1 1 A 43 43 LEU CA C 43 53.700 54.758 -1.058 1
1 547 . 19 1 1 A 43 43 LEU CB C 43 43.900 42.069 1.831 1
1 551 . 19 1 1 A 43 43 LEU N N 43 124.700 126.219 -1.519 1
1 552 . 19 1 1 A 44 44 LYS H H 44 8.640 8.639 0.001 1
1 553 . 19 1 1 A 44 44 LYS HA H 44 4.500 4.901 -0.401 1
1 562 . 19 1 1 A 44 44 LYS C C 44 174.500 175.729 -1.229 1
1 563 . 19 1 1 A 44 44 LYS CA C 44 54.700 54.400 0.300 1
1 564 . 19 1 1 A 44 44 LYS CB C 44 36.200 34.672 1.528 1
1 568 . 19 1 1 A 44 44 LYS N N 44 123.300 121.719 1.581 1
1 569 . 19 1 1 A 45 45 THR H H 45 7.990 8.762 -0.772 1
1 570 . 19 1 1 A 45 45 THR HA H 45 5.700 5.438 0.262 1
1 575 . 19 1 1 A 45 45 THR C C 45 175.100 174.096 1.004 1
1 576 . 19 1 1 A 45 45 THR CA C 45 59.600 59.787 -0.187 1
1 577 . 19 1 1 A 45 45 THR CB C 45 73.400 70.746 2.654 1
1 579 . 19 1 1 A 45 45 THR N N 45 106.900 116.634 -9.734 1
1 580 . 19 1 1 A 46 46 TYR H H 46 8.470 9.220 -0.750 1
1 581 . 19 1 1 A 46 46 TYR HA H 46 4.930 5.785 -0.855 1
1 586 . 19 1 1 A 46 46 TYR C C 46 172.400 173.498 -1.098 1
1 587 . 19 1 1 A 46 46 TYR CA C 46 57.100 55.366 1.734 1
1 588 . 19 1 1 A 46 46 TYR CB C 46 40.200 42.252 -2.052 1
1 591 . 19 1 1 A 46 46 TYR N N 46 117.100 119.099 -1.999 1
1 592 . 19 1 1 A 47 47 VAL H H 47 8.430 9.053 -0.623 1
1 593 . 19 1 1 A 47 47 VAL HA H 47 4.890 4.502 0.388 1
1 601 . 19 1 1 A 47 47 VAL C C 47 175.800 173.999 1.801 1
1 602 . 19 1 1 A 47 47 VAL CA C 47 60.800 61.710 -0.910 1
1 603 . 19 1 1 A 47 47 VAL CB C 47 34.800 32.904 1.896 1
1 606 . 19 1 1 A 47 47 VAL N N 47 119.200 121.680 -2.480 1
1 607 . 19 1 1 A 48 48 ILE H H 48 8.680 9.276 -0.596 1
1 608 . 19 1 1 A 48 48 ILE HA H 48 4.560 4.953 -0.393 1
1 618 . 19 1 1 A 48 48 ILE C C 48 174.500 174.393 0.107 1
1 619 . 19 1 1 A 48 48 ILE CA C 48 59.700 59.567 0.133 1
1 620 . 19 1 1 A 48 48 ILE CB C 48 41.500 41.136 0.364 1
1 624 . 19 1 1 A 48 48 ILE N N 48 124.400 129.604 -5.204 1
1 625 . 19 1 1 A 49 49 GLU H H 49 8.320 8.825 -0.505 1
1 626 . 19 1 1 A 49 49 GLU C C 49 175.500 175.192 0.308 1
1 627 . 19 1 1 A 49 49 GLU CA C 49 55.500 56.486 -0.986 1
1 628 . 19 1 1 A 49 49 GLU CB C 49 31.800 30.237 1.563 1
1 630 . 19 1 1 A 49 49 GLU N N 49 123.400 128.846 -5.446 1
1 631 . 19 1 1 A 50 50 ASP H H 50 8.610 9.270 -0.660 1
1 632 . 19 1 1 A 50 50 ASP C C 50 175.100 175.229 -0.129 1
1 633 . 19 1 1 A 50 50 ASP CA C 50 53.100 53.313 -0.213 1
1 634 . 19 1 1 A 50 50 ASP CB C 50 44.000 42.877 1.123 1
1 635 . 19 1 1 A 50 50 ASP N N 50 124.300 126.872 -2.572 1
1 636 . 19 1 1 A 51 51 GLU H H 51 8.450 8.824 -0.374 1
1 637 . 19 1 1 A 51 51 GLU C C 51 175.900 175.023 0.877 1
1 638 . 19 1 1 A 51 51 GLU CA C 51 56.000 55.289 0.711 1
1 639 . 19 1 1 A 51 51 GLU CB C 51 31.700 30.757 0.943 1
1 640 . 19 1 1 A 51 51 GLU N N 51 121.300 127.247 -5.947 1
1 641 . 19 1 1 A 52 52 ILE H H 52 8.480 8.817 -0.337 1
1 642 . 19 1 1 A 52 52 ILE C C 52 175.400 175.847 -0.447 1
1 643 . 19 1 1 A 52 52 ILE CA C 52 60.400 60.170 0.230 1
1 644 . 19 1 1 A 52 52 ILE CB C 52 40.000 35.449 4.551 1
1 645 . 19 1 1 A 52 52 ILE N N 52 122.700 128.123 -5.423 1
1 646 . 19 1 1 A 53 53 VAL H H 53 8.140 8.969 -0.829 1
1 647 . 19 1 1 A 53 53 VAL C C 53 175.600 173.961 1.639 1
1 648 . 19 1 1 A 53 53 VAL CA C 53 61.900 58.789 3.111 1
1 649 . 19 1 1 A 53 53 VAL CB C 53 33.200 35.582 -2.382 1
1 650 . 19 1 1 A 53 53 VAL N N 53 124.400 121.276 3.124 1
1 651 . 19 1 1 A 54 54 GLU H H 54 8.540 8.602 -0.062 1
1 652 . 19 1 1 A 54 54 GLU CA C 54 55.600 52.558 3.042 1
1 653 . 19 1 1 A 54 54 GLU CB C 54 34.300 30.469 3.831 1
1 654 . 19 1 1 A 54 54 GLU N N 54 125.900 122.779 3.121 1
1 655 . 19 1 1 A 55 55 PRO C C 55 177.500 176.181 1.319 1
1 656 . 19 1 1 A 55 55 PRO CA C 55 63.400 62.439 0.961 1
1 657 . 19 1 1 A 55 55 PRO CB C 55 32.300 33.292 -0.992 1
1 658 . 19 1 1 A 56 56 GLY H H 56 8.420 8.388 0.032 1
1 659 . 19 1 1 A 56 56 GLY HA2 H 56 3.830 4.193 -0.363 1
1 660 . 19 1 1 A 56 56 GLY HA3 H 56 4.000 4.206 -0.206 1
1 661 . 19 1 1 A 56 56 GLY C C 56 174.500 175.462 -0.962 1
1 662 . 19 1 1 A 56 56 GLY CA C 56 45.400 45.734 -0.334 1
1 663 . 19 1 1 A 56 56 GLY N N 56 109.700 107.457 2.243 1
1 664 . 19 1 1 A 57 57 GLU H H 57 8.180 8.114 0.066 1
1 665 . 19 1 1 A 57 57 GLU C C 57 176.300 176.070 0.230 1
1 666 . 19 1 1 A 57 57 GLU CA C 57 57.500 59.123 -1.623 1
1 667 . 19 1 1 A 57 57 GLU CB C 57 30.400 29.441 0.959 1
1 668 . 19 1 1 A 57 57 GLU N N 57 120.900 119.928 0.972 1
1 669 . 19 1 1 A 58 58 TYR H H 58 8.020 7.926 0.094 1
1 670 . 19 1 1 A 58 58 TYR C C 58 175.100 173.933 1.167 1
1 671 . 19 1 1 A 58 58 TYR CA C 58 57.400 56.444 0.956 1
1 672 . 19 1 1 A 58 58 TYR CB C 58 38.900 39.089 -0.189 1
1 673 . 19 1 1 A 58 58 TYR N N 58 118.800 115.882 2.918 1
1 674 . 19 1 1 A 59 59 ASP H H 59 7.950 8.887 -0.937 1
1 675 . 19 1 1 A 59 59 ASP CA C 59 52.700 50.625 2.075 1
1 676 . 19 1 1 A 59 59 ASP CB C 59 41.000 41.358 -0.358 1
1 677 . 19 1 1 A 59 59 ASP N N 59 123.500 125.534 -2.034 1
1 678 . 19 1 1 A 61 61 PRO HA H 61 4.510 4.524 -0.014 1
1 685 . 19 1 1 A 61 61 PRO C C 61 176.500 175.876 0.624 1
1 686 . 19 1 1 A 61 61 PRO CA C 61 63.700 63.062 0.638 1
1 687 . 19 1 1 A 61 61 PRO CB C 61 34.200 29.913 4.287 1
1 690 . 19 1 1 A 62 62 GLU H H 62 8.490 8.144 0.346 1
1 691 . 19 1 1 A 62 62 GLU N N 62 124.600 120.305 4.295 1
1 692 . 19 1 1 A 64 64 LYS C C 64 176.300 175.500 0.800 1
1 693 . 19 1 1 A 64 64 LYS CA C 64 57.000 55.097 1.903 1
1 694 . 19 1 1 A 64 64 LYS CB C 64 33.100 34.126 -1.026 1
1 695 . 19 1 1 A 65 65 TYR H H 65 7.960 8.964 -1.004 1
1 696 . 19 1 1 A 65 65 TYR C C 65 176.000 175.334 0.666 1
1 697 . 19 1 1 A 65 65 TYR CA C 65 57.800 56.205 1.595 1
1 698 . 19 1 1 A 65 65 TYR CB C 65 38.800 41.312 -2.512 1
1 699 . 19 1 1 A 65 65 TYR N N 65 119.300 123.633 -4.333 1
1 700 . 19 1 1 A 66 66 THR H H 66 7.820 8.861 -1.041 1
1 701 . 19 1 1 A 66 66 THR HA H 66 4.280 4.765 -0.485 1
1 706 . 19 1 1 A 66 66 THR C C 66 174.100 172.331 1.769 1
1 707 . 19 1 1 A 66 66 THR CA C 66 62.100 60.751 1.349 1
1 708 . 19 1 1 A 66 66 THR CB C 66 70.000 70.571 -0.571 1
1 710 . 19 1 1 A 66 66 THR N N 66 113.900 115.656 -1.756 1
1 711 . 19 1 1 A 67 67 ASN H H 67 8.270 8.699 -0.429 1
1 712 . 19 1 1 A 67 67 ASN C C 67 174.100 173.464 0.636 1
1 713 . 19 1 1 A 67 67 ASN CA C 67 53.400 51.236 2.164 1
1 714 . 19 1 1 A 67 67 ASN CB C 67 39.300 42.328 -3.028 1
1 715 . 19 1 1 A 67 67 ASN N N 67 121.400 122.163 -0.763 1
1 716 . 19 1 1 A 68 68 VAL H H 68 7.660 8.447 -0.787 1
1 717 . 19 1 1 A 68 68 VAL C C 68 175.500 174.166 1.334 1
1 718 . 19 1 1 A 68 68 VAL CA C 68 61.800 62.030 -0.230 1
1 719 . 19 1 1 A 68 68 VAL CB C 68 33.700 32.963 0.737 1
1 720 . 19 1 1 A 68 68 VAL N N 68 119.400 122.080 -2.680 1
1 721 . 19 1 1 A 69 69 LYS H H 69 8.690 8.811 -0.121 1
1 722 . 19 1 1 A 69 69 LYS C C 69 175.200 175.352 -0.152 1
1 723 . 19 1 1 A 69 69 LYS CA C 69 55.200 54.871 0.329 1
1 724 . 19 1 1 A 69 69 LYS CB C 69 35.200 34.348 0.852 1
1 725 . 19 1 1 A 69 69 LYS N N 69 126.500 128.568 -2.068 1
1 726 . 19 1 1 A 70 70 LYS H H 70 8.230 8.892 -0.662 1
1 727 . 19 1 1 A 70 70 LYS C C 70 176.400 176.139 0.261 1
1 728 . 19 1 1 A 70 70 LYS CA C 70 55.600 55.885 -0.285 1
1 729 . 19 1 1 A 70 70 LYS CB C 70 33.800 34.120 -0.320 1
1 730 . 19 1 1 A 70 70 LYS N N 70 122.700 124.236 -1.536 1
1 731 . 19 1 1 A 71 71 VAL H H 71 8.530 9.532 -1.002 1
1 732 . 19 1 1 A 71 71 VAL HA H 71 4.510 4.952 -0.442 1
1 733 . 19 1 1 A 71 71 VAL C C 71 174.700 174.437 0.263 1
1 734 . 19 1 1 A 71 71 VAL CA C 71 60.900 60.298 0.602 1
1 735 . 19 1 1 A 71 71 VAL CB C 71 34.800 34.556 0.244 1
1 738 . 19 1 1 A 71 71 VAL N N 71 121.200 118.826 2.374 1
1 739 . 19 1 1 A 72 72 LYS H H 72 8.210 8.829 -0.619 1
1 740 . 19 1 1 A 72 72 LYS HA H 72 4.800 4.630 0.170 1
1 747 . 19 1 1 A 72 72 LYS C C 72 176.200 175.261 0.939 1
1 748 . 19 1 1 A 72 72 LYS CA C 72 55.700 55.816 -0.116 1
1 749 . 19 1 1 A 72 72 LYS CB C 72 33.700 32.589 1.111 1
1 752 . 19 1 1 A 72 72 LYS N N 72 123.600 124.836 -1.236 1
1 753 . 19 1 1 A 73 73 ILE H H 73 8.890 8.817 0.073 1
1 754 . 19 1 1 A 73 73 ILE C C 73 174.400 174.444 -0.044 1
1 755 . 19 1 1 A 73 73 ILE CA C 73 60.400 60.032 0.368 1
1 756 . 19 1 1 A 73 73 ILE CB C 73 40.800 38.197 2.603 1
1 760 . 19 1 1 A 73 73 ILE N N 73 125.100 126.095 -0.995 1
1 761 . 19 1 1 A 74 74 LYS H H 74 8.420 8.988 -0.568 1
1 762 . 19 1 1 A 74 74 LYS HA H 74 4.800 5.038 -0.238 1
1 771 . 19 1 1 A 74 74 LYS C C 74 175.600 175.035 0.565 1
1 772 . 19 1 1 A 74 74 LYS CA C 74 56.200 54.908 1.292 1
1 773 . 19 1 1 A 74 74 LYS CB C 74 34.300 33.858 0.442 1
1 777 . 19 1 1 A 74 74 LYS N N 74 126.400 128.536 -2.136 1
1 778 . 19 1 1 A 75 75 LYS H H 75 9.090 8.338 0.752 1
1 779 . 19 1 1 A 75 75 LYS HA H 75 4.800 4.847 -0.047 1
1 788 . 19 1 1 A 75 75 LYS C C 75 174.900 174.765 0.135 1
1 789 . 19 1 1 A 75 75 LYS CA C 75 53.200 54.121 -0.921 1
1 790 . 19 1 1 A 75 75 LYS CB C 75 34.200 35.074 -0.874 1
1 794 . 19 1 1 A 75 75 LYS N N 75 127.500 126.151 1.349 1
1 795 . 19 1 1 A 76 76 VAL H H 76 8.610 8.872 -0.262 1
1 796 . 19 1 1 A 76 76 VAL HA H 76 5.340 5.056 0.284 1
1 804 . 19 1 1 A 76 76 VAL C C 76 171.400 173.936 -2.536 1
1 805 . 19 1 1 A 76 76 VAL CA C 76 58.000 59.659 -1.659 1
1 806 . 19 1 1 A 76 76 VAL CB C 76 36.400 35.391 1.009 1
1 809 . 19 1 1 A 76 76 VAL N N 76 120.100 120.938 -0.838 1
1 810 . 19 1 1 A 77 77 TYR H H 77 9.110 9.404 -0.294 1
1 811 . 19 1 1 A 77 77 TYR HA H 77 6.150 5.629 0.521 1
1 816 . 19 1 1 A 77 77 TYR C C 77 173.600 173.402 0.198 1
1 817 . 19 1 1 A 77 77 TYR CA C 77 56.200 55.893 0.307 1
1 818 . 19 1 1 A 77 77 TYR CB C 77 44.000 40.956 3.044 1
1 821 . 19 1 1 A 77 77 TYR N N 77 121.300 121.977 -0.677 1
1 822 . 19 1 1 A 78 78 PHE H H 78 8.190 8.712 -0.522 1
1 823 . 19 1 1 A 78 78 PHE HA H 78 5.130 5.321 -0.191 1
1 829 . 19 1 1 A 78 78 PHE C C 78 173.600 172.354 1.246 1
1 830 . 19 1 1 A 78 78 PHE CA C 78 55.900 55.355 0.545 1
1 831 . 19 1 1 A 78 78 PHE CB C 78 42.500 42.646 -0.146 1
1 835 . 19 1 1 A 78 78 PHE N N 78 112.700 116.509 -3.809 1
1 836 . 19 1 1 A 79 79 GLU H H 79 8.920 8.924 -0.004 1
1 837 . 19 1 1 A 79 79 GLU HA H 79 5.390 4.999 0.391 1
1 842 . 19 1 1 A 79 79 GLU C C 79 177.000 176.970 0.030 1
1 843 . 19 1 1 A 79 79 GLU CA C 79 54.900 55.380 -0.480 1
1 844 . 19 1 1 A 79 79 GLU CB C 79 33.600 31.381 2.219 1
1 846 . 19 1 1 A 79 79 GLU N N 79 120.500 119.876 0.624 1
1 847 . 19 1 1 A 80 80 THR H H 80 8.970 8.944 0.026 1
1 848 . 19 1 1 A 80 80 THR HA H 80 4.700 4.917 -0.217 1
1 854 . 19 1 1 A 80 80 THR C C 80 177.000 176.372 0.628 1
1 855 . 19 1 1 A 80 80 THR CA C 80 61.300 60.604 0.696 1
1 856 . 19 1 1 A 80 80 THR CB C 80 70.500 71.494 -0.994 1
1 858 . 19 1 1 A 80 80 THR N N 80 113.200 116.198 -2.998 1
1 859 . 19 1 1 A 81 81 LEU H H 81 8.610 8.964 -0.354 1
1 860 . 19 1 1 A 81 81 LEU HA H 81 4.230 4.100 0.130 1
1 870 . 19 1 1 A 81 81 LEU C C 81 177.400 177.195 0.205 1
1 871 . 19 1 1 A 81 81 LEU CA C 81 57.700 57.290 0.410 1
1 872 . 19 1 1 A 81 81 LEU CB C 81 42.400 41.603 0.797 1
1 876 . 19 1 1 A 81 81 LEU N N 81 120.900 122.305 -1.405 1
1 877 . 19 1 1 A 82 82 ASP H H 82 8.850 8.006 0.844 1
1 878 . 19 1 1 A 82 82 ASP HA H 82 4.670 4.559 0.111 1
1 881 . 19 1 1 A 82 82 ASP C C 82 174.100 175.693 -1.593 1
1 882 . 19 1 1 A 82 82 ASP CA C 82 52.700 52.900 -0.200 1
1 883 . 19 1 1 A 82 82 ASP CB C 82 37.900 39.489 -1.589 1
1 884 . 19 1 1 A 82 82 ASP N N 82 112.300 115.740 -3.440 1
1 885 . 19 1 1 A 83 83 ASN H H 83 7.790 8.030 -0.240 1
1 886 . 19 1 1 A 83 83 ASN HA H 83 4.270 4.407 -0.137 1
1 891 . 19 1 1 A 83 83 ASN C C 83 176.100 174.133 1.967 1
1 892 . 19 1 1 A 83 83 ASN CA C 83 55.300 54.530 0.770 1
1 893 . 19 1 1 A 83 83 ASN CB C 83 36.900 37.016 -0.116 1
1 894 . 19 1 1 A 83 83 ASN N N 83 113.000 112.002 0.998 1
1 896 . 19 1 1 A 84 84 VAL H H 84 7.660 7.285 0.375 1
1 897 . 19 1 1 A 84 84 VAL HA H 84 4.270 4.260 0.010 1
1 905 . 19 1 1 A 84 84 VAL C C 84 175.800 175.061 0.739 1
1 906 . 19 1 1 A 84 84 VAL CA C 84 61.500 61.506 -0.006 1
1 907 . 19 1 1 A 84 84 VAL CB C 84 33.500 33.065 0.435 1
1 910 . 19 1 1 A 84 84 VAL N N 84 119.700 119.405 0.295 1
1 911 . 19 1 1 A 85 85 ARG H H 85 8.180 8.872 -0.692 1
1 912 . 19 1 1 A 85 85 ARG HA H 85 4.870 4.779 0.091 1
1 920 . 19 1 1 A 85 85 ARG C C 85 174.000 175.113 -1.113 1
1 921 . 19 1 1 A 85 85 ARG CA C 85 55.700 55.332 0.368 1
1 922 . 19 1 1 A 85 85 ARG CB C 85 32.600 30.975 1.625 1
1 925 . 19 1 1 A 85 85 ARG N N 85 124.800 127.312 -2.512 1
1 927 . 19 1 1 A 86 86 VAL H H 86 8.570 8.719 -0.149 1
1 928 . 19 1 1 A 86 86 VAL HA H 86 4.580 4.386 0.194 1
1 936 . 19 1 1 A 86 86 VAL C C 86 175.700 175.096 0.604 1
1 937 . 19 1 1 A 86 86 VAL CA C 86 61.700 61.596 0.104 1
1 938 . 19 1 1 A 86 86 VAL CB C 86 30.900 31.039 -0.139 1
1 941 . 19 1 1 A 86 86 VAL N N 86 127.300 125.453 1.847 1
1 942 . 19 1 1 A 87 87 VAL H H 87 8.790 9.328 -0.538 1
1 943 . 19 1 1 A 87 87 VAL HA H 87 5.010 4.845 0.165 1
1 951 . 19 1 1 A 87 87 VAL C C 87 175.500 174.576 0.924 1
1 952 . 19 1 1 A 87 87 VAL CA C 87 61.900 60.900 1.000 1
1 953 . 19 1 1 A 87 87 VAL CB C 87 36.300 33.067 3.233 1
1 956 . 19 1 1 A 87 87 VAL N N 87 125.700 128.766 -3.066 1
1 957 . 19 1 1 A 88 88 THR H H 88 8.350 8.976 -0.626 1
1 958 . 19 1 1 A 88 88 THR HA H 88 4.620 4.559 0.061 1
1 964 . 19 1 1 A 88 88 THR C C 88 173.300 172.047 1.253 1
1 965 . 19 1 1 A 88 88 THR CA C 88 61.700 60.802 0.898 1
1 966 . 19 1 1 A 88 88 THR CB C 88 70.400 72.158 -1.758 1
1 968 . 19 1 1 A 88 88 THR N N 88 117.500 119.877 -2.377 1
1 969 . 19 1 1 A 89 89 ASP H H 89 7.700 8.553 -0.853 1
1 970 . 19 1 1 A 89 89 ASP HA H 89 4.480 4.637 -0.157 1
1 973 . 19 1 1 A 89 89 ASP C C 89 175.900 176.979 -1.079 1
1 974 . 19 1 1 A 89 89 ASP CA C 89 55.900 54.244 1.656 1
1 975 . 19 1 1 A 89 89 ASP CB C 89 43.900 41.955 1.945 1
1 976 . 19 1 1 A 89 89 ASP N N 89 120.800 124.204 -3.404 1
1 977 . 19 1 1 A 90 90 TYR H H 90 8.240 8.934 -0.694 1
1 978 . 19 1 1 A 90 90 TYR HA H 90 3.920 4.144 -0.224 1
1 983 . 19 1 1 A 90 90 TYR C C 90 176.400 177.601 -1.201 1
1 984 . 19 1 1 A 90 90 TYR CA C 90 62.300 61.863 0.437 1
1 985 . 19 1 1 A 90 90 TYR CB C 90 39.500 38.623 0.877 1
1 988 . 19 1 1 A 90 90 TYR N N 90 126.100 128.487 -2.387 1
1 989 . 19 1 1 A 91 91 SER H H 91 9.160 8.377 0.783 1
1 990 . 19 1 1 A 91 91 SER HA H 91 4.000 4.130 -0.130 1
1 993 . 19 1 1 A 91 91 SER C C 91 178.000 175.781 2.219 1
1 994 . 19 1 1 A 91 91 SER CA C 91 62.600 61.648 0.952 1
1 995 . 19 1 1 A 91 91 SER CB C 91 62.200 62.987 -0.787 1
1 996 . 19 1 1 A 91 91 SER N N 91 116.600 115.836 0.764 1
1 997 . 19 1 1 A 92 92 GLU H H 92 8.590 7.683 0.907 1
1 998 . 19 1 1 A 92 92 GLU HA H 92 4.050 4.084 -0.034 1
1 1003 . 19 1 1 A 92 92 GLU C C 92 179.400 178.824 0.576 1
1 1004 . 19 1 1 A 92 92 GLU CA C 92 58.900 59.067 -0.167 1
1 1005 . 19 1 1 A 92 92 GLU CB C 92 30.600 29.124 1.476 1
1 1007 . 19 1 1 A 92 92 GLU N N 92 120.200 122.343 -2.143 1
1 1008 . 19 1 1 A 93 93 PHE H H 93 7.870 8.262 -0.392 1
1 1009 . 19 1 1 A 93 93 PHE HA H 93 4.050 4.155 -0.105 1
1 1015 . 19 1 1 A 93 93 PHE C C 93 176.500 177.790 -1.290 1
1 1016 . 19 1 1 A 93 93 PHE CA C 93 62.200 61.238 0.962 1
1 1017 . 19 1 1 A 93 93 PHE CB C 93 39.700 39.070 0.630 1
1 1021 . 19 1 1 A 93 93 PHE N N 93 120.200 120.531 -0.331 1
1 1022 . 19 1 1 A 94 94 GLN H H 94 8.190 8.127 0.063 1
1 1023 . 19 1 1 A 94 94 GLN HA H 94 3.390 3.620 -0.230 1
1 1030 . 19 1 1 A 94 94 GLN C C 94 178.600 177.994 0.606 1
1 1031 . 19 1 1 A 94 94 GLN CA C 94 58.800 59.020 -0.220 1
1 1032 . 19 1 1 A 94 94 GLN CB C 94 28.400 27.908 0.492 1
1 1034 . 19 1 1 A 94 94 GLN N N 94 116.800 118.232 -1.432 1
1 1036 . 19 1 1 A 95 95 LYS H H 95 7.060 7.818 -0.758 1
1 1037 . 19 1 1 A 95 95 LYS HA H 95 3.780 3.979 -0.199 1
1 1046 . 19 1 1 A 95 95 LYS C C 95 179.300 179.064 0.236 1
1 1047 . 19 1 1 A 95 95 LYS CA C 95 59.900 59.191 0.709 1
1 1048 . 19 1 1 A 95 95 LYS CB C 95 32.700 32.087 0.613 1
1 1052 . 19 1 1 A 95 95 LYS N N 95 117.500 120.936 -3.436 1
1 1053 . 19 1 1 A 96 96 ILE H H 96 7.240 7.405 -0.165 1
1 1054 . 19 1 1 A 96 96 ILE HA H 96 3.420 3.473 -0.053 1
1 1064 . 19 1 1 A 96 96 ILE C C 96 177.800 178.222 -0.422 1
1 1065 . 19 1 1 A 96 96 ILE CA C 96 64.300 64.915 -0.615 1
1 1066 . 19 1 1 A 96 96 ILE CB C 96 37.400 37.496 -0.096 1
1 1070 . 19 1 1 A 96 96 ILE N N 96 120.700 119.523 1.177 1
1 1071 . 19 1 1 A 97 97 LEU H H 97 7.690 7.794 -0.104 1
1 1072 . 19 1 1 A 97 97 LEU HA H 97 3.580 3.698 -0.118 1
1 1082 . 19 1 1 A 97 97 LEU C C 97 179.900 178.994 0.906 1
1 1083 . 19 1 1 A 97 97 LEU CA C 97 58.100 57.972 0.128 1
1 1084 . 19 1 1 A 97 97 LEU CB C 97 41.500 41.099 0.401 1
1 1088 . 19 1 1 A 97 97 LEU N N 97 120.000 120.629 -0.629 1
1 1089 . 19 1 1 A 98 98 LYS H H 98 7.510 7.829 -0.319 1
1 1090 . 19 1 1 A 98 98 LYS HA H 98 3.950 3.899 0.051 1
1 1099 . 19 1 1 A 98 98 LYS C C 98 178.700 178.071 0.629 1
1 1100 . 19 1 1 A 98 98 LYS CA C 98 58.700 59.115 -0.415 1
1 1101 . 19 1 1 A 98 98 LYS CB C 98 32.500 31.496 1.004 1
1 1105 . 19 1 1 A 98 98 LYS N N 98 117.300 119.011 -1.711 1
1 1106 . 19 1 1 A 99 99 LYS H H 99 7.470 7.860 -0.390 1
1 1107 . 19 1 1 A 99 99 LYS HA H 99 4.080 3.894 0.186 1
1 1116 . 19 1 1 A 99 99 LYS C C 99 178.100 178.155 -0.055 1
1 1117 . 19 1 1 A 99 99 LYS CA C 99 58.400 59.544 -1.144 1
1 1118 . 19 1 1 A 99 99 LYS CB C 99 33.000 32.434 0.566 1
1 1122 . 19 1 1 A 99 99 LYS N N 99 119.000 119.174 -0.174 1
1 1123 . 19 1 1 A 100 100 ARG H H 100 8.020 7.553 0.467 1
1 1124 . 19 1 1 A 100 100 ARG HA H 100 4.210 4.456 -0.246 1
1 1131 . 19 1 1 A 100 100 ARG C C 100 177.500 176.507 0.993 1
1 1132 . 19 1 1 A 100 100 ARG CA C 100 56.700 55.965 0.735 1
1 1133 . 19 1 1 A 100 100 ARG CB C 100 30.500 31.215 -0.715 1
1 1136 . 19 1 1 A 100 100 ARG N N 100 117.300 118.588 -1.288 1
1 1137 . 19 1 1 A 101 101 GLY H H 101 7.910 7.615 0.295 1
1 1138 . 19 1 1 A 101 101 GLY HA2 H 101 3.980 3.945 0.035 1
1 1139 . 19 1 1 A 101 101 GLY HA3 H 101 4.020 3.952 0.068 1
1 1140 . 19 1 1 A 101 101 GLY C C 101 174.400 175.170 -0.770 1
1 1141 . 19 1 1 A 101 101 GLY CA C 101 46.000 46.608 -0.608 1
1 1142 . 19 1 1 A 101 101 GLY N N 101 108.000 108.223 -0.223 1
1 1143 . 19 1 1 A 102 102 THR H H 102 7.880 7.957 -0.077 1
1 1144 . 19 1 1 A 102 102 THR HA H 102 4.360 4.193 0.167 1
1 1149 . 19 1 1 A 102 102 THR C C 102 174.400 174.431 -0.031 1
1 1150 . 19 1 1 A 102 102 THR CA C 102 62.100 66.059 -3.959 1
1 1151 . 19 1 1 A 102 102 THR CB C 102 70.500 69.121 1.379 1
1 1153 . 19 1 1 A 102 102 THR N N 102 113.900 111.460 2.440 1
1 1154 . 19 1 1 A 103 103 LYS H H 103 8.440 7.530 0.910 1
1 1155 . 19 1 1 A 103 103 LYS C C 103 176.400 175.106 1.294 1
1 1156 . 19 1 1 A 103 103 LYS CA C 103 56.600 55.663 0.937 1
1 1157 . 19 1 1 A 103 103 LYS CB C 103 33.300 31.025 2.275 1
1 1158 . 19 1 1 A 103 103 LYS N N 103 124.000 117.675 6.325 1
1 1159 . 19 1 1 A 104 104 LEU H H 104 8.180 8.021 0.159 1
1 1160 . 19 1 1 A 104 104 LEU HA H 104 4.270 4.813 -0.543 1
1 1170 . 19 1 1 A 104 104 LEU C C 104 177.100 173.929 3.171 1
1 1171 . 19 1 1 A 104 104 LEU CA C 104 55.500 54.572 0.928 1
1 1172 . 19 1 1 A 104 104 LEU CB C 104 42.500 45.796 -3.296 1
1 1176 . 19 1 1 A 104 104 LEU N N 104 123.500 125.468 -1.968 1
1 1177 . 19 1 1 A 105 105 GLU H H 105 8.270 8.973 -0.703 1
1 1178 . 19 1 1 A 105 105 GLU CA C 105 56.700 55.009 1.691 1
1 1179 . 19 1 1 A 105 105 GLU CB C 105 30.800 31.451 -0.651 1
1 13 . 20 1 1 A 2 2 ASN HA H 2 4.980 5.147 -0.167 1
1 18 . 20 1 1 A 2 2 ASN C C 2 176.300 176.017 0.283 1
1 19 . 20 1 1 A 2 2 ASN CA C 2 52.500 51.336 1.164 1
1 20 . 20 1 1 A 2 2 ASN CB C 2 40.900 41.658 -0.758 1
1 22 . 20 1 1 A 3 3 SER H H 3 9.940 8.530 1.410 1
1 23 . 20 1 1 A 3 3 SER HA H 3 3.720 4.123 -0.403 1
1 26 . 20 1 1 A 3 3 SER C C 3 175.900 176.706 -0.806 1
1 27 . 20 1 1 A 3 3 SER CA C 3 63.300 61.812 1.488 1
1 28 . 20 1 1 A 3 3 SER CB C 3 61.700 62.409 -0.709 1
1 29 . 20 1 1 A 3 3 SER N N 3 118.200 116.241 1.959 1
1 30 . 20 1 1 A 4 4 GLU H H 4 8.450 8.111 0.339 1
1 31 . 20 1 1 A 4 4 GLU HA H 4 4.010 4.002 0.008 1
1 36 . 20 1 1 A 4 4 GLU C C 4 178.800 178.920 -0.120 1
1 37 . 20 1 1 A 4 4 GLU CA C 4 60.300 59.233 1.067 1
1 38 . 20 1 1 A 4 4 GLU CB C 4 29.100 29.478 -0.378 1
1 40 . 20 1 1 A 4 4 GLU N N 4 123.600 122.392 1.208 1
1 41 . 20 1 1 A 5 5 VAL H H 5 7.590 7.951 -0.361 1
1 42 . 20 1 1 A 5 5 VAL HA H 5 3.850 3.683 0.167 1
1 50 . 20 1 1 A 5 5 VAL C C 5 179.100 177.902 1.198 1
1 51 . 20 1 1 A 5 5 VAL CA C 5 65.800 66.684 -0.884 1
1 52 . 20 1 1 A 5 5 VAL CB C 5 32.300 31.410 0.890 1
1 55 . 20 1 1 A 5 5 VAL N N 5 119.300 118.906 0.394 1
1 56 . 20 1 1 A 6 6 ILE H H 6 7.240 8.385 -1.145 1
1 57 . 20 1 1 A 6 6 ILE HA H 6 3.580 3.526 0.054 1
1 67 . 20 1 1 A 6 6 ILE C C 6 177.000 178.168 -1.168 1
1 68 . 20 1 1 A 6 6 ILE CA C 6 65.300 65.850 -0.550 1
1 69 . 20 1 1 A 6 6 ILE CB C 6 37.900 37.725 0.175 1
1 73 . 20 1 1 A 6 6 ILE N N 6 120.300 120.437 -0.137 1
1 74 . 20 1 1 A 7 7 LYS H H 7 8.050 7.982 0.068 1
1 75 . 20 1 1 A 7 7 LYS HA H 7 3.570 3.615 -0.045 1
1 84 . 20 1 1 A 7 7 LYS C C 7 178.700 180.062 -1.362 1
1 85 . 20 1 1 A 7 7 LYS CA C 7 61.300 60.292 1.008 1
1 86 . 20 1 1 A 7 7 LYS CB C 7 32.200 31.855 0.345 1
1 90 . 20 1 1 A 7 7 LYS N N 7 119.200 118.604 0.596 1
1 91 . 20 1 1 A 8 8 GLU H H 8 8.100 7.932 0.168 1
1 92 . 20 1 1 A 8 8 GLU HA H 8 4.000 4.053 -0.053 1
1 97 . 20 1 1 A 8 8 GLU C C 8 178.500 179.215 -0.715 1
1 98 . 20 1 1 A 8 8 GLU CA C 8 59.700 59.334 0.366 1
1 99 . 20 1 1 A 8 8 GLU CB C 8 29.600 29.656 -0.056 1
1 101 . 20 1 1 A 8 8 GLU N N 8 119.400 120.434 -1.034 1
1 102 . 20 1 1 A 9 9 PHE H H 9 7.720 8.128 -0.408 1
1 103 . 20 1 1 A 9 9 PHE HA H 9 4.160 4.060 0.100 1
1 109 . 20 1 1 A 9 9 PHE C C 9 176.900 176.931 -0.031 1
1 110 . 20 1 1 A 9 9 PHE CA C 9 61.300 61.144 0.156 1
1 111 . 20 1 1 A 9 9 PHE CB C 9 39.400 39.166 0.234 1
1 115 . 20 1 1 A 9 9 PHE N N 9 121.300 121.853 -0.553 1
1 116 . 20 1 1 A 10 10 LEU H H 10 8.060 8.658 -0.598 1
1 117 . 20 1 1 A 10 10 LEU HA H 10 3.660 3.740 -0.080 1
1 127 . 20 1 1 A 10 10 LEU C C 10 179.000 179.251 -0.251 1
1 128 . 20 1 1 A 10 10 LEU CA C 10 58.000 57.801 0.199 1
1 129 . 20 1 1 A 10 10 LEU CB C 10 41.400 41.243 0.157 1
1 133 . 20 1 1 A 10 10 LEU N N 10 118.000 119.020 -1.020 1
1 134 . 20 1 1 A 11 11 GLU H H 11 7.990 8.583 -0.593 1
1 135 . 20 1 1 A 11 11 GLU HA H 11 4.110 3.974 0.136 1
1 140 . 20 1 1 A 11 11 GLU C C 11 174.200 178.362 -4.162 1
1 141 . 20 1 1 A 11 11 GLU CA C 11 59.200 59.248 -0.048 1
1 142 . 20 1 1 A 11 11 GLU CB C 11 29.300 29.297 0.003 1
1 144 . 20 1 1 A 11 11 GLU N N 11 118.300 120.960 -2.660 1
1 145 . 20 1 1 A 12 12 ASP H H 12 8.080 8.281 -0.201 1
1 146 . 20 1 1 A 12 12 ASP HA H 12 4.340 4.327 0.013 1
1 149 . 20 1 1 A 12 12 ASP C C 12 178.900 178.705 0.195 1
1 150 . 20 1 1 A 12 12 ASP CA C 12 57.600 57.874 -0.274 1
1 151 . 20 1 1 A 12 12 ASP CB C 12 41.000 41.771 -0.771 1
1 152 . 20 1 1 A 12 12 ASP N N 12 121.800 120.247 1.553 1
1 153 . 20 1 1 A 13 13 ILE H H 13 7.610 7.450 0.160 1
1 154 . 20 1 1 A 13 13 ILE HA H 13 4.240 3.793 0.447 1
1 164 . 20 1 1 A 13 13 ILE C C 13 176.800 176.500 0.300 1
1 165 . 20 1 1 A 13 13 ILE CA C 13 62.100 62.825 -0.725 1
1 166 . 20 1 1 A 13 13 ILE CB C 13 38.300 38.320 -0.020 1
1 170 . 20 1 1 A 13 13 ILE N N 13 110.800 117.131 -6.331 1
1 171 . 20 1 1 A 14 14 GLY H H 14 7.640 8.316 -0.676 1
1 172 . 20 1 1 A 14 14 GLY HA2 H 14 3.810 3.936 -0.126 1
1 173 . 20 1 1 A 14 14 GLY HA3 H 14 3.880 3.945 -0.065 1
1 174 . 20 1 1 A 14 14 GLY C C 14 175.200 174.153 1.047 1
1 175 . 20 1 1 A 14 14 GLY CA C 14 46.900 45.852 1.048 1
1 176 . 20 1 1 A 14 14 GLY N N 14 111.800 108.929 2.871 1
1 177 . 20 1 1 A 15 15 GLU H H 15 7.870 7.880 -0.010 1
1 178 . 20 1 1 A 15 15 GLU HA H 15 4.680 4.733 -0.053 1
1 183 . 20 1 1 A 15 15 GLU C C 15 175.100 175.585 -0.485 1
1 184 . 20 1 1 A 15 15 GLU CA C 15 54.800 55.228 -0.428 1
1 185 . 20 1 1 A 15 15 GLU CB C 15 32.200 31.877 0.323 1
1 187 . 20 1 1 A 15 15 GLU N N 15 119.200 119.088 0.112 1
1 188 . 20 1 1 A 16 16 ASP H H 16 8.220 8.645 -0.425 1
1 189 . 20 1 1 A 16 16 ASP HA H 16 4.680 5.505 -0.825 1
1 192 . 20 1 1 A 16 16 ASP C C 16 174.600 175.311 -0.711 1
1 193 . 20 1 1 A 16 16 ASP CA C 16 53.600 52.748 0.852 1
1 194 . 20 1 1 A 16 16 ASP CB C 16 42.900 43.590 -0.690 1
1 195 . 20 1 1 A 16 16 ASP N N 16 120.600 119.657 0.943 1
1 196 . 20 1 1 A 17 17 TYR H H 17 7.540 8.787 -1.247 1
1 197 . 20 1 1 A 17 17 TYR HA H 17 4.910 5.434 -0.524 1
1 202 . 20 1 1 A 17 17 TYR C C 17 173.600 172.927 0.673 1
1 203 . 20 1 1 A 17 17 TYR CA C 17 56.200 56.240 -0.040 1
1 204 . 20 1 1 A 17 17 TYR CB C 17 41.100 42.010 -0.910 1
1 207 . 20 1 1 A 17 17 TYR N N 17 112.700 117.784 -5.084 1
1 208 . 20 1 1 A 18 18 ILE H H 18 7.950 9.380 -1.430 1
1 209 . 20 1 1 A 18 18 ILE HA H 18 4.330 4.539 -0.209 1
1 219 . 20 1 1 A 18 18 ILE C C 18 174.700 174.328 0.372 1
1 220 . 20 1 1 A 18 18 ILE CA C 18 60.300 60.398 -0.098 1
1 221 . 20 1 1 A 18 18 ILE CB C 18 41.000 38.742 2.258 1
1 225 . 20 1 1 A 18 18 ILE N N 18 120.400 121.649 -1.249 1
1 226 . 20 1 1 A 19 19 GLU H H 19 8.760 9.082 -0.322 1
1 227 . 20 1 1 A 19 19 GLU HA H 19 5.200 5.231 -0.031 1
1 232 . 20 1 1 A 19 19 GLU C C 19 175.200 175.262 -0.062 1
1 233 . 20 1 1 A 19 19 GLU CA C 19 55.500 55.580 -0.080 1
1 234 . 20 1 1 A 19 19 GLU CB C 19 32.400 31.628 0.772 1
1 236 . 20 1 1 A 19 19 GLU N N 19 129.000 128.803 0.197 1
1 237 . 20 1 1 A 20 20 LEU H H 20 8.730 9.492 -0.762 1
1 238 . 20 1 1 A 20 20 LEU HA H 20 4.620 4.831 -0.211 1
1 248 . 20 1 1 A 20 20 LEU C C 20 176.200 176.436 -0.236 1
1 249 . 20 1 1 A 20 20 LEU CA C 20 54.100 53.342 0.758 1
1 250 . 20 1 1 A 20 20 LEU CB C 20 44.400 44.045 0.355 1
1 254 . 20 1 1 A 20 20 LEU N N 20 128.400 126.376 2.024 1
1 255 . 20 1 1 A 21 21 GLU H H 21 8.700 8.712 -0.012 1
1 256 . 20 1 1 A 21 21 GLU HA H 21 3.870 4.118 -0.248 1
1 261 . 20 1 1 A 21 21 GLU C C 21 176.100 176.858 -0.758 1
1 262 . 20 1 1 A 21 21 GLU CA C 21 58.800 56.939 1.861 1
1 263 . 20 1 1 A 21 21 GLU CB C 21 28.200 29.212 -1.012 1
1 265 . 20 1 1 A 21 21 GLU N N 21 122.600 119.506 3.094 1
1 266 . 20 1 1 A 22 22 ASN H H 22 8.640 8.546 0.094 1
1 267 . 20 1 1 A 22 22 ASN HA H 22 4.540 4.329 0.211 1
1 272 . 20 1 1 A 22 22 ASN C C 22 173.800 173.867 -0.067 1
1 273 . 20 1 1 A 22 22 ASN CA C 22 54.600 54.600 0.000 1
1 274 . 20 1 1 A 22 22 ASN CB C 22 38.400 36.771 1.629 1
1 275 . 20 1 1 A 22 22 ASN N N 22 118.000 120.385 -2.385 1
1 277 . 20 1 1 A 23 23 GLU H H 23 7.740 7.664 0.076 1
1 278 . 20 1 1 A 23 23 GLU HA H 23 5.430 5.171 0.259 1
1 283 . 20 1 1 A 23 23 GLU C C 23 175.400 175.101 0.299 1
1 284 . 20 1 1 A 23 23 GLU CA C 23 54.900 54.762 0.138 1
1 285 . 20 1 1 A 23 23 GLU CB C 23 34.500 33.103 1.397 1
1 287 . 20 1 1 A 23 23 GLU N N 23 116.400 117.199 -0.799 1
1 288 . 20 1 1 A 24 24 ILE H H 24 9.050 9.250 -0.200 1
1 289 . 20 1 1 A 24 24 ILE HA H 24 4.810 4.862 -0.052 1
1 299 . 20 1 1 A 24 24 ILE C C 24 174.600 175.077 -0.477 1
1 300 . 20 1 1 A 24 24 ILE CA C 24 60.700 60.442 0.258 1
1 301 . 20 1 1 A 24 24 ILE CB C 24 41.300 40.185 1.115 1
1 305 . 20 1 1 A 24 24 ILE N N 24 122.800 123.462 -0.662 1
1 306 . 20 1 1 A 25 25 HIS H H 25 9.490 9.592 -0.102 1
1 307 . 20 1 1 A 25 25 HIS HA H 25 5.090 5.669 -0.579 1
1 312 . 20 1 1 A 25 25 HIS C C 25 176.100 174.998 1.102 1
1 313 . 20 1 1 A 25 25 HIS CA C 25 56.100 55.177 0.923 1
1 314 . 20 1 1 A 25 25 HIS CB C 25 33.100 31.373 1.727 1
1 317 . 20 1 1 A 25 25 HIS N N 25 127.300 125.834 1.466 1
1 318 . 20 1 1 A 26 26 LEU H H 26 8.820 8.640 0.180 1
1 319 . 20 1 1 A 26 26 LEU HA H 26 5.160 4.951 0.209 1
1 329 . 20 1 1 A 26 26 LEU C C 26 178.000 175.813 2.187 1
1 330 . 20 1 1 A 26 26 LEU CA C 26 52.900 53.407 -0.507 1
1 331 . 20 1 1 A 26 26 LEU CB C 26 48.100 43.578 4.522 1
1 335 . 20 1 1 A 26 26 LEU N N 26 121.600 124.777 -3.177 1
1 336 . 20 1 1 A 27 27 LYS H H 27 8.990 8.751 0.239 1
1 337 . 20 1 1 A 27 27 LYS HA H 27 4.630 4.672 -0.042 1
1 345 . 20 1 1 A 27 27 LYS CA C 27 55.700 53.843 1.857 1
1 346 . 20 1 1 A 27 27 LYS CB C 27 31.900 32.093 -0.193 1
1 350 . 20 1 1 A 27 27 LYS N N 27 125.900 120.704 5.196 1
1 351 . 20 1 1 A 28 28 PRO HA H 28 4.500 4.433 0.067 1
1 358 . 20 1 1 A 28 28 PRO C C 28 177.900 178.299 -0.399 1
1 359 . 20 1 1 A 28 28 PRO CA C 28 67.400 65.871 1.529 1
1 360 . 20 1 1 A 28 28 PRO CB C 28 32.100 31.860 0.240 1
1 363 . 20 1 1 A 29 29 GLU H H 29 9.880 8.357 1.523 1
1 364 . 20 1 1 A 29 29 GLU HA H 29 4.140 4.294 -0.154 1
1 369 . 20 1 1 A 29 29 GLU C C 29 178.800 178.707 0.093 1
1 370 . 20 1 1 A 29 29 GLU CA C 29 60.600 59.520 1.080 1
1 371 . 20 1 1 A 29 29 GLU CB C 29 29.200 29.248 -0.048 1
1 373 . 20 1 1 A 29 29 GLU N N 29 117.100 118.163 -1.063 1
1 374 . 20 1 1 A 30 30 VAL H H 30 7.050 7.628 -0.578 1
1 375 . 20 1 1 A 30 30 VAL HA H 30 3.850 3.919 -0.069 1
1 383 . 20 1 1 A 30 30 VAL C C 30 177.700 178.140 -0.440 1
1 384 . 20 1 1 A 30 30 VAL CA C 30 65.600 65.505 0.095 1
1 385 . 20 1 1 A 30 30 VAL CB C 30 32.100 31.848 0.252 1
1 388 . 20 1 1 A 30 30 VAL N N 30 120.900 120.372 0.528 1
1 389 . 20 1 1 A 31 31 PHE H H 31 8.980 8.938 0.042 1
1 390 . 20 1 1 A 31 31 PHE HA H 31 3.870 4.318 -0.448 1
1 394 . 20 1 1 A 31 31 PHE C C 31 176.700 177.399 -0.699 1
1 395 . 20 1 1 A 31 31 PHE CA C 31 62.200 61.450 0.750 1
1 396 . 20 1 1 A 31 31 PHE CB C 31 39.300 39.177 0.123 1
1 398 . 20 1 1 A 31 31 PHE N N 31 121.100 120.751 0.349 1
1 399 . 20 1 1 A 32 32 TYR H H 32 8.640 8.133 0.507 1
1 400 . 20 1 1 A 32 32 TYR HA H 32 3.880 4.620 -0.740 1
1 405 . 20 1 1 A 32 32 TYR C C 32 176.000 177.701 -1.701 1
1 406 . 20 1 1 A 32 32 TYR CA C 32 63.300 62.094 1.206 1
1 407 . 20 1 1 A 32 32 TYR CB C 32 39.100 38.904 0.196 1
1 410 . 20 1 1 A 32 32 TYR N N 32 117.400 120.572 -3.172 1
1 411 . 20 1 1 A 33 33 GLU H H 33 7.400 7.999 -0.599 1
1 412 . 20 1 1 A 33 33 GLU HA H 33 4.050 4.187 -0.137 1
1 417 . 20 1 1 A 33 33 GLU C C 33 180.200 179.049 1.151 1
1 418 . 20 1 1 A 33 33 GLU CA C 33 59.500 59.073 0.427 1
1 419 . 20 1 1 A 33 33 GLU CB C 33 29.300 29.149 0.151 1
1 421 . 20 1 1 A 33 33 GLU N N 33 116.100 119.362 -3.262 1
1 422 . 20 1 1 A 34 34 VAL H H 34 8.530 7.739 0.791 1
1 423 . 20 1 1 A 34 34 VAL HA H 34 3.350 3.635 -0.285 1
1 431 . 20 1 1 A 34 34 VAL C C 34 175.800 178.240 -2.440 1
1 432 . 20 1 1 A 34 34 VAL CA C 34 66.400 66.254 0.146 1
1 433 . 20 1 1 A 34 34 VAL CB C 34 32.200 31.893 0.307 1
1 436 . 20 1 1 A 34 34 VAL N N 34 120.600 120.367 0.233 1
1 437 . 20 1 1 A 35 35 TRP H H 35 9.100 8.504 0.596 1
1 438 . 20 1 1 A 35 35 TRP HA H 35 3.340 3.723 -0.383 1
1 447 . 20 1 1 A 35 35 TRP C C 35 178.000 177.765 0.235 1
1 448 . 20 1 1 A 35 35 TRP CA C 35 61.800 60.242 1.558 1
1 449 . 20 1 1 A 35 35 TRP CB C 35 27.900 29.244 -1.344 1
1 455 . 20 1 1 A 35 35 TRP N N 35 121.700 121.331 0.369 1
1 457 . 20 1 1 A 36 36 LYS H H 36 7.970 7.581 0.389 1
1 458 . 20 1 1 A 36 36 LYS HA H 36 3.330 3.702 -0.372 1
1 467 . 20 1 1 A 36 36 LYS C C 36 180.000 178.435 1.565 1
1 468 . 20 1 1 A 36 36 LYS CA C 36 59.000 58.460 0.540 1
1 469 . 20 1 1 A 36 36 LYS CB C 36 31.800 31.874 -0.074 1
1 473 . 20 1 1 A 36 36 LYS N N 36 116.300 118.052 -1.752 1
1 474 . 20 1 1 A 37 37 TYR H H 37 7.750 7.884 -0.134 1
1 475 . 20 1 1 A 37 37 TYR HA H 37 3.940 3.856 0.084 1
1 480 . 20 1 1 A 37 37 TYR C C 37 177.600 177.428 0.172 1
1 481 . 20 1 1 A 37 37 TYR CA C 37 61.200 60.770 0.430 1
1 482 . 20 1 1 A 37 37 TYR CB C 37 38.800 38.402 0.398 1
1 485 . 20 1 1 A 37 37 TYR N N 37 122.700 121.636 1.064 1
1 486 . 20 1 1 A 38 38 VAL H H 38 7.660 7.034 0.626 1
1 487 . 20 1 1 A 38 38 VAL HA H 38 3.870 4.041 -0.171 1
1 495 . 20 1 1 A 38 38 VAL C C 38 175.600 175.507 0.093 1
1 496 . 20 1 1 A 38 38 VAL CA C 38 61.100 60.910 0.190 1
1 497 . 20 1 1 A 38 38 VAL CB C 38 30.700 31.060 -0.360 1
1 500 . 20 1 1 A 38 38 VAL N N 38 108.200 112.525 -4.325 1
1 501 . 20 1 1 A 39 39 GLY H H 39 7.090 7.424 -0.334 1
1 502 . 20 1 1 A 39 39 GLY HA2 H 39 3.320 3.629 -0.309 1
1 503 . 20 1 1 A 39 39 GLY HA3 H 39 3.730 3.664 0.066 1
1 504 . 20 1 1 A 39 39 GLY C C 39 173.600 174.329 -0.729 1
1 505 . 20 1 1 A 39 39 GLY CA C 39 46.100 45.612 0.488 1
1 506 . 20 1 1 A 39 39 GLY N N 39 107.600 110.030 -2.430 1
1 507 . 20 1 1 A 40 40 GLU H H 40 7.730 8.242 -0.512 1
1 508 . 20 1 1 A 40 40 GLU HA H 40 1.090 2.682 -1.592 1
1 513 . 20 1 1 A 40 40 GLU CA C 40 55.700 56.349 -0.649 1
1 514 . 20 1 1 A 40 40 GLU CB C 40 27.200 26.198 1.002 1
1 516 . 20 1 1 A 40 40 GLU N N 40 114.400 118.495 -4.095 1
1 517 . 20 1 1 A 41 41 PRO HA H 41 4.310 4.561 -0.251 1
1 524 . 20 1 1 A 41 41 PRO CA C 41 62.300 62.207 0.093 1
1 525 . 20 1 1 A 41 41 PRO CB C 41 32.700 32.978 -0.278 1
1 528 . 20 1 1 A 42 42 GLU H H 42 8.110 8.692 -0.582 1
1 529 . 20 1 1 A 42 42 GLU C C 42 175.800 176.236 -0.436 1
1 530 . 20 1 1 A 42 42 GLU CA C 42 57.800 56.778 1.022 1
1 531 . 20 1 1 A 42 42 GLU CB C 42 30.600 30.225 0.375 1
1 533 . 20 1 1 A 42 42 GLU N N 42 119.100 120.092 -0.992 1
1 534 . 20 1 1 A 43 43 LEU H H 43 8.140 8.797 -0.657 1
1 535 . 20 1 1 A 43 43 LEU HA H 43 4.840 4.792 0.048 1
1 545 . 20 1 1 A 43 43 LEU C C 43 177.300 176.057 1.243 1
1 546 . 20 1 1 A 43 43 LEU CA C 43 53.700 54.061 -0.361 1
1 547 . 20 1 1 A 43 43 LEU CB C 43 43.900 41.886 2.014 1
1 551 . 20 1 1 A 43 43 LEU N N 43 124.700 126.285 -1.585 1
1 552 . 20 1 1 A 44 44 LYS H H 44 8.640 8.794 -0.154 1
1 553 . 20 1 1 A 44 44 LYS HA H 44 4.500 4.701 -0.201 1
1 562 . 20 1 1 A 44 44 LYS C C 44 174.500 175.615 -1.115 1
1 563 . 20 1 1 A 44 44 LYS CA C 44 54.700 55.491 -0.791 1
1 564 . 20 1 1 A 44 44 LYS CB C 44 36.200 33.058 3.142 1
1 568 . 20 1 1 A 44 44 LYS N N 44 123.300 124.920 -1.620 1
1 569 . 20 1 1 A 45 45 THR H H 45 7.990 8.733 -0.743 1
1 570 . 20 1 1 A 45 45 THR HA H 45 5.700 5.795 -0.095 1
1 575 . 20 1 1 A 45 45 THR C C 45 175.100 173.944 1.156 1
1 576 . 20 1 1 A 45 45 THR CA C 45 59.600 60.318 -0.718 1
1 577 . 20 1 1 A 45 45 THR CB C 45 73.400 70.415 2.985 1
1 579 . 20 1 1 A 45 45 THR N N 45 106.900 115.621 -8.721 1
1 580 . 20 1 1 A 46 46 TYR H H 46 8.470 9.233 -0.763 1
1 581 . 20 1 1 A 46 46 TYR HA H 46 4.930 5.840 -0.910 1
1 586 . 20 1 1 A 46 46 TYR C C 46 172.400 173.446 -1.046 1
1 587 . 20 1 1 A 46 46 TYR CA C 46 57.100 55.243 1.857 1
1 588 . 20 1 1 A 46 46 TYR CB C 46 40.200 42.182 -1.982 1
1 591 . 20 1 1 A 46 46 TYR N N 46 117.100 119.338 -2.238 1
1 592 . 20 1 1 A 47 47 VAL H H 47 8.430 9.054 -0.624 1
1 593 . 20 1 1 A 47 47 VAL HA H 47 4.890 4.521 0.369 1
1 601 . 20 1 1 A 47 47 VAL C C 47 175.800 174.042 1.758 1
1 602 . 20 1 1 A 47 47 VAL CA C 47 60.800 62.001 -1.201 1
1 603 . 20 1 1 A 47 47 VAL CB C 47 34.800 32.544 2.256 1
1 606 . 20 1 1 A 47 47 VAL N N 47 119.200 122.286 -3.086 1
1 607 . 20 1 1 A 48 48 ILE H H 48 8.680 9.252 -0.572 1
1 608 . 20 1 1 A 48 48 ILE HA H 48 4.560 4.895 -0.335 1
1 618 . 20 1 1 A 48 48 ILE C C 48 174.500 174.678 -0.178 1
1 619 . 20 1 1 A 48 48 ILE CA C 48 59.700 60.082 -0.382 1
1 620 . 20 1 1 A 48 48 ILE CB C 48 41.500 40.684 0.816 1
1 624 . 20 1 1 A 48 48 ILE N N 48 124.400 129.367 -4.967 1
1 625 . 20 1 1 A 49 49 GLU H H 49 8.320 8.867 -0.547 1
1 626 . 20 1 1 A 49 49 GLU C C 49 175.500 174.769 0.731 1
1 627 . 20 1 1 A 49 49 GLU CA C 49 55.500 55.964 -0.464 1
1 628 . 20 1 1 A 49 49 GLU CB C 49 31.800 30.292 1.508 1
1 630 . 20 1 1 A 49 49 GLU N N 49 123.400 130.842 -7.442 1
1 631 . 20 1 1 A 50 50 ASP H H 50 8.610 8.925 -0.315 1
1 632 . 20 1 1 A 50 50 ASP C C 50 175.100 175.132 -0.032 1
1 633 . 20 1 1 A 50 50 ASP CA C 50 53.100 53.311 -0.211 1
1 634 . 20 1 1 A 50 50 ASP CB C 50 44.000 43.334 0.666 1
1 635 . 20 1 1 A 50 50 ASP N N 50 124.300 127.767 -3.467 1
1 636 . 20 1 1 A 51 51 GLU H H 51 8.450 8.882 -0.432 1
1 637 . 20 1 1 A 51 51 GLU C C 51 175.900 176.277 -0.377 1
1 638 . 20 1 1 A 51 51 GLU CA C 51 56.000 55.744 0.256 1
1 639 . 20 1 1 A 51 51 GLU CB C 51 31.700 30.858 0.842 1
1 640 . 20 1 1 A 51 51 GLU N N 51 121.300 123.637 -2.337 1
1 641 . 20 1 1 A 52 52 ILE H H 52 8.480 8.747 -0.267 1
1 642 . 20 1 1 A 52 52 ILE C C 52 175.400 174.977 0.423 1
1 643 . 20 1 1 A 52 52 ILE CA C 52 60.400 61.704 -1.304 1
1 644 . 20 1 1 A 52 52 ILE CB C 52 40.000 36.697 3.303 1
1 645 . 20 1 1 A 52 52 ILE N N 52 122.700 120.138 2.562 1
1 646 . 20 1 1 A 53 53 VAL H H 53 8.140 8.066 0.074 1
1 647 . 20 1 1 A 53 53 VAL C C 53 175.600 175.481 0.119 1
1 648 . 20 1 1 A 53 53 VAL CA C 53 61.900 61.587 0.313 1
1 649 . 20 1 1 A 53 53 VAL CB C 53 33.200 31.698 1.502 1
1 650 . 20 1 1 A 53 53 VAL N N 53 124.400 123.136 1.264 1
1 651 . 20 1 1 A 54 54 GLU H H 54 8.540 8.834 -0.294 1
1 652 . 20 1 1 A 54 54 GLU CA C 54 55.600 54.182 1.418 1
1 653 . 20 1 1 A 54 54 GLU CB C 54 34.300 29.899 4.401 1
1 654 . 20 1 1 A 54 54 GLU N N 54 125.900 128.324 -2.424 1
1 655 . 20 1 1 A 55 55 PRO C C 55 177.500 177.509 -0.009 1
1 656 . 20 1 1 A 55 55 PRO CA C 55 63.400 64.754 -1.354 1
1 657 . 20 1 1 A 55 55 PRO CB C 55 32.300 31.792 0.508 1
1 658 . 20 1 1 A 56 56 GLY H H 56 8.420 7.410 1.010 1
1 659 . 20 1 1 A 56 56 GLY HA2 H 56 3.830 3.870 -0.040 1
1 660 . 20 1 1 A 56 56 GLY HA3 H 56 4.000 3.907 0.093 1
1 661 . 20 1 1 A 56 56 GLY C C 56 174.500 173.929 0.571 1
1 662 . 20 1 1 A 56 56 GLY CA C 56 45.400 45.417 -0.017 1
1 663 . 20 1 1 A 56 56 GLY N N 56 109.700 106.335 3.365 1
1 664 . 20 1 1 A 57 57 GLU H H 57 8.180 7.799 0.381 1
1 665 . 20 1 1 A 57 57 GLU C C 57 176.300 174.447 1.853 1
1 666 . 20 1 1 A 57 57 GLU CA C 57 57.500 54.694 2.806 1
1 667 . 20 1 1 A 57 57 GLU CB C 57 30.400 32.615 -2.215 1
1 668 . 20 1 1 A 57 57 GLU N N 57 120.900 121.008 -0.108 1
1 669 . 20 1 1 A 58 58 TYR H H 58 8.020 8.848 -0.828 1
1 670 . 20 1 1 A 58 58 TYR C C 58 175.100 175.282 -0.182 1
1 671 . 20 1 1 A 58 58 TYR CA C 58 57.400 57.335 0.065 1
1 672 . 20 1 1 A 58 58 TYR CB C 58 38.900 41.729 -2.829 1
1 673 . 20 1 1 A 58 58 TYR N N 58 118.800 124.934 -6.134 1
1 674 . 20 1 1 A 59 59 ASP H H 59 7.950 8.685 -0.735 1
1 675 . 20 1 1 A 59 59 ASP CA C 59 52.700 52.577 0.123 1
1 676 . 20 1 1 A 59 59 ASP CB C 59 41.000 40.977 0.023 1
1 677 . 20 1 1 A 59 59 ASP N N 59 123.500 121.777 1.723 1
1 678 . 20 1 1 A 61 61 PRO HA H 61 4.510 4.704 -0.194 1
1 685 . 20 1 1 A 61 61 PRO C C 61 176.500 175.904 0.596 1
1 686 . 20 1 1 A 61 61 PRO CA C 61 63.700 62.347 1.353 1
1 687 . 20 1 1 A 61 61 PRO CB C 61 34.200 29.771 4.429 1
1 690 . 20 1 1 A 62 62 GLU H H 62 8.490 8.596 -0.106 1
1 691 . 20 1 1 A 62 62 GLU N N 62 124.600 123.488 1.112 1
1 692 . 20 1 1 A 64 64 LYS C C 64 176.300 173.874 2.426 1
1 693 . 20 1 1 A 64 64 LYS CA C 64 57.000 55.725 1.275 1
1 694 . 20 1 1 A 64 64 LYS CB C 64 33.100 36.271 -3.171 1
1 695 . 20 1 1 A 65 65 TYR H H 65 7.960 9.045 -1.085 1
1 696 . 20 1 1 A 65 65 TYR C C 65 176.000 174.335 1.665 1
1 697 . 20 1 1 A 65 65 TYR CA C 65 57.800 56.584 1.216 1
1 698 . 20 1 1 A 65 65 TYR CB C 65 38.800 38.937 -0.137 1
1 699 . 20 1 1 A 65 65 TYR N N 65 119.300 127.433 -8.133 1
1 700 . 20 1 1 A 66 66 THR H H 66 7.820 8.384 -0.564 1
1 701 . 20 1 1 A 66 66 THR HA H 66 4.280 4.200 0.080 1
1 706 . 20 1 1 A 66 66 THR C C 66 174.100 173.969 0.131 1
1 707 . 20 1 1 A 66 66 THR CA C 66 62.100 63.494 -1.394 1
1 708 . 20 1 1 A 66 66 THR CB C 66 70.000 68.844 1.156 1
1 710 . 20 1 1 A 66 66 THR N N 66 113.900 122.912 -9.012 1
1 711 . 20 1 1 A 67 67 ASN H H 67 8.270 8.428 -0.158 1
1 712 . 20 1 1 A 67 67 ASN C C 67 174.100 174.881 -0.781 1
1 713 . 20 1 1 A 67 67 ASN CA C 67 53.400 53.836 -0.436 1
1 714 . 20 1 1 A 67 67 ASN CB C 67 39.300 38.173 1.127 1
1 715 . 20 1 1 A 67 67 ASN N N 67 121.400 124.922 -3.522 1
1 716 . 20 1 1 A 68 68 VAL H H 68 7.660 8.483 -0.823 1
1 717 . 20 1 1 A 68 68 VAL C C 68 175.500 174.817 0.683 1
1 718 . 20 1 1 A 68 68 VAL CA C 68 61.800 62.649 -0.849 1
1 719 . 20 1 1 A 68 68 VAL CB C 68 33.700 30.454 3.246 1
1 720 . 20 1 1 A 68 68 VAL N N 68 119.400 125.614 -6.214 1
1 721 . 20 1 1 A 69 69 LYS H H 69 8.690 8.429 0.261 1
1 722 . 20 1 1 A 69 69 LYS C C 69 175.200 175.732 -0.532 1
1 723 . 20 1 1 A 69 69 LYS CA C 69 55.200 54.814 0.386 1
1 724 . 20 1 1 A 69 69 LYS CB C 69 35.200 34.280 0.920 1
1 725 . 20 1 1 A 69 69 LYS N N 69 126.500 128.574 -2.074 1
1 726 . 20 1 1 A 70 70 LYS H H 70 8.230 8.574 -0.344 1
1 727 . 20 1 1 A 70 70 LYS C C 70 176.400 176.186 0.214 1
1 728 . 20 1 1 A 70 70 LYS CA C 70 55.600 56.281 -0.681 1
1 729 . 20 1 1 A 70 70 LYS CB C 70 33.800 33.010 0.790 1
1 730 . 20 1 1 A 70 70 LYS N N 70 122.700 126.238 -3.538 1
1 731 . 20 1 1 A 71 71 VAL H H 71 8.530 9.495 -0.965 1
1 732 . 20 1 1 A 71 71 VAL HA H 71 4.510 4.526 -0.016 1
1 733 . 20 1 1 A 71 71 VAL C C 71 174.700 175.173 -0.473 1
1 734 . 20 1 1 A 71 71 VAL CA C 71 60.900 61.248 -0.348 1
1 735 . 20 1 1 A 71 71 VAL CB C 71 34.800 33.294 1.506 1
1 738 . 20 1 1 A 71 71 VAL N N 71 121.200 124.201 -3.001 1
1 739 . 20 1 1 A 72 72 LYS H H 72 8.210 8.842 -0.632 1
1 740 . 20 1 1 A 72 72 LYS HA H 72 4.800 4.590 0.210 1
1 747 . 20 1 1 A 72 72 LYS C C 72 176.200 175.365 0.835 1
1 748 . 20 1 1 A 72 72 LYS CA C 72 55.700 56.045 -0.345 1
1 749 . 20 1 1 A 72 72 LYS CB C 72 33.700 32.551 1.149 1
1 752 . 20 1 1 A 72 72 LYS N N 72 123.600 127.639 -4.039 1
1 753 . 20 1 1 A 73 73 ILE H H 73 8.890 8.943 -0.053 1
1 754 . 20 1 1 A 73 73 ILE C C 73 174.400 174.413 -0.013 1
1 755 . 20 1 1 A 73 73 ILE CA C 73 60.400 60.393 0.007 1
1 756 . 20 1 1 A 73 73 ILE CB C 73 40.800 37.649 3.151 1
1 760 . 20 1 1 A 73 73 ILE N N 73 125.100 126.160 -1.060 1
1 761 . 20 1 1 A 74 74 LYS H H 74 8.420 8.831 -0.411 1
1 762 . 20 1 1 A 74 74 LYS HA H 74 4.800 4.830 -0.030 1
1 771 . 20 1 1 A 74 74 LYS C C 74 175.600 175.091 0.509 1
1 772 . 20 1 1 A 74 74 LYS CA C 74 56.200 55.237 0.963 1
1 773 . 20 1 1 A 74 74 LYS CB C 74 34.300 33.481 0.819 1
1 777 . 20 1 1 A 74 74 LYS N N 74 126.400 128.440 -2.040 1
1 778 . 20 1 1 A 75 75 LYS H H 75 9.090 8.585 0.505 1
1 779 . 20 1 1 A 75 75 LYS HA H 75 4.800 4.932 -0.132 1
1 788 . 20 1 1 A 75 75 LYS C C 75 174.900 175.151 -0.251 1
1 789 . 20 1 1 A 75 75 LYS CA C 75 53.200 54.294 -1.094 1
1 790 . 20 1 1 A 75 75 LYS CB C 75 34.200 34.967 -0.767 1
1 794 . 20 1 1 A 75 75 LYS N N 75 127.500 127.342 0.158 1
1 795 . 20 1 1 A 76 76 VAL H H 76 8.610 8.567 0.043 1
1 796 . 20 1 1 A 76 76 VAL HA H 76 5.340 5.325 0.015 1
1 804 . 20 1 1 A 76 76 VAL C C 76 171.400 174.004 -2.604 1
1 805 . 20 1 1 A 76 76 VAL CA C 76 58.000 59.782 -1.782 1
1 806 . 20 1 1 A 76 76 VAL CB C 76 36.400 35.309 1.091 1
1 809 . 20 1 1 A 76 76 VAL N N 76 120.100 120.838 -0.738 1
1 810 . 20 1 1 A 77 77 TYR H H 77 9.110 9.212 -0.102 1
1 811 . 20 1 1 A 77 77 TYR HA H 77 6.150 5.865 0.285 1
1 816 . 20 1 1 A 77 77 TYR C C 77 173.600 173.257 0.343 1
1 817 . 20 1 1 A 77 77 TYR CA C 77 56.200 55.834 0.366 1
1 818 . 20 1 1 A 77 77 TYR CB C 77 44.000 40.924 3.076 1
1 821 . 20 1 1 A 77 77 TYR N N 77 121.300 122.016 -0.716 1
1 822 . 20 1 1 A 78 78 PHE H H 78 8.190 8.688 -0.498 1
1 823 . 20 1 1 A 78 78 PHE HA H 78 5.130 5.624 -0.494 1
1 829 . 20 1 1 A 78 78 PHE C C 78 173.600 172.558 1.042 1
1 830 . 20 1 1 A 78 78 PHE CA C 78 55.900 55.129 0.771 1
1 831 . 20 1 1 A 78 78 PHE CB C 78 42.500 42.862 -0.362 1
1 835 . 20 1 1 A 78 78 PHE N N 78 112.700 116.813 -4.113 1
1 836 . 20 1 1 A 79 79 GLU H H 79 8.920 8.944 -0.024 1
1 837 . 20 1 1 A 79 79 GLU HA H 79 5.390 4.987 0.403 1
1 842 . 20 1 1 A 79 79 GLU C C 79 177.000 177.011 -0.011 1
1 843 . 20 1 1 A 79 79 GLU CA C 79 54.900 55.388 -0.488 1
1 844 . 20 1 1 A 79 79 GLU CB C 79 33.600 31.337 2.263 1
1 846 . 20 1 1 A 79 79 GLU N N 79 120.500 119.951 0.549 1
1 847 . 20 1 1 A 80 80 THR H H 80 8.970 8.898 0.072 1
1 848 . 20 1 1 A 80 80 THR HA H 80 4.700 4.816 -0.116 1
1 854 . 20 1 1 A 80 80 THR C C 80 177.000 175.862 1.138 1
1 855 . 20 1 1 A 80 80 THR CA C 80 61.300 60.786 0.514 1
1 856 . 20 1 1 A 80 80 THR CB C 80 70.500 71.700 -1.200 1
1 858 . 20 1 1 A 80 80 THR N N 80 113.200 115.944 -2.744 1
1 859 . 20 1 1 A 81 81 LEU H H 81 8.610 8.915 -0.305 1
1 860 . 20 1 1 A 81 81 LEU HA H 81 4.230 4.026 0.204 1
1 870 . 20 1 1 A 81 81 LEU C C 81 177.400 177.593 -0.193 1
1 871 . 20 1 1 A 81 81 LEU CA C 81 57.700 57.946 -0.246 1
1 872 . 20 1 1 A 81 81 LEU CB C 81 42.400 41.709 0.691 1
1 876 . 20 1 1 A 81 81 LEU N N 81 120.900 122.241 -1.341 1
1 877 . 20 1 1 A 82 82 ASP H H 82 8.850 8.050 0.800 1
1 878 . 20 1 1 A 82 82 ASP HA H 82 4.670 4.542 0.128 1
1 881 . 20 1 1 A 82 82 ASP C C 82 174.100 175.650 -1.550 1
1 882 . 20 1 1 A 82 82 ASP CA C 82 52.700 53.056 -0.356 1
1 883 . 20 1 1 A 82 82 ASP CB C 82 37.900 39.529 -1.629 1
1 884 . 20 1 1 A 82 82 ASP N N 82 112.300 115.170 -2.870 1
1 885 . 20 1 1 A 83 83 ASN H H 83 7.790 8.127 -0.337 1
1 886 . 20 1 1 A 83 83 ASN HA H 83 4.270 4.431 -0.161 1
1 891 . 20 1 1 A 83 83 ASN C C 83 176.100 174.392 1.708 1
1 892 . 20 1 1 A 83 83 ASN CA C 83 55.300 54.548 0.752 1
1 893 . 20 1 1 A 83 83 ASN CB C 83 36.900 36.938 -0.038 1
1 894 . 20 1 1 A 83 83 ASN N N 83 113.000 112.286 0.714 1
1 896 . 20 1 1 A 84 84 VAL H H 84 7.660 7.736 -0.076 1
1 897 . 20 1 1 A 84 84 VAL HA H 84 4.270 4.081 0.189 1
1 905 . 20 1 1 A 84 84 VAL C C 84 175.800 175.077 0.723 1
1 906 . 20 1 1 A 84 84 VAL CA C 84 61.500 62.302 -0.802 1
1 907 . 20 1 1 A 84 84 VAL CB C 84 33.500 32.478 1.022 1
1 910 . 20 1 1 A 84 84 VAL N N 84 119.700 119.576 0.124 1
1 911 . 20 1 1 A 85 85 ARG H H 85 8.180 9.199 -1.019 1
1 912 . 20 1 1 A 85 85 ARG HA H 85 4.870 4.789 0.081 1
1 920 . 20 1 1 A 85 85 ARG C C 85 174.000 175.162 -1.162 1
1 921 . 20 1 1 A 85 85 ARG CA C 85 55.700 55.753 -0.053 1
1 922 . 20 1 1 A 85 85 ARG CB C 85 32.600 30.608 1.992 1
1 925 . 20 1 1 A 85 85 ARG N N 85 124.800 127.959 -3.159 1
1 927 . 20 1 1 A 86 86 VAL H H 86 8.570 8.407 0.163 1
1 928 . 20 1 1 A 86 86 VAL HA H 86 4.580 4.437 0.143 1
1 936 . 20 1 1 A 86 86 VAL C C 86 175.700 175.306 0.394 1
1 937 . 20 1 1 A 86 86 VAL CA C 86 61.700 62.546 -0.846 1
1 938 . 20 1 1 A 86 86 VAL CB C 86 30.900 30.806 0.094 1
1 941 . 20 1 1 A 86 86 VAL N N 86 127.300 125.273 2.027 1
1 942 . 20 1 1 A 87 87 VAL H H 87 8.790 8.762 0.028 1
1 943 . 20 1 1 A 87 87 VAL HA H 87 5.010 4.840 0.170 1
1 951 . 20 1 1 A 87 87 VAL C C 87 175.500 174.613 0.887 1
1 952 . 20 1 1 A 87 87 VAL CA C 87 61.900 60.859 1.041 1
1 953 . 20 1 1 A 87 87 VAL CB C 87 36.300 32.839 3.461 1
1 956 . 20 1 1 A 87 87 VAL N N 87 125.700 128.494 -2.794 1
1 957 . 20 1 1 A 88 88 THR H H 88 8.350 8.798 -0.448 1
1 958 . 20 1 1 A 88 88 THR HA H 88 4.620 4.636 -0.016 1
1 964 . 20 1 1 A 88 88 THR C C 88 173.300 172.382 0.918 1
1 965 . 20 1 1 A 88 88 THR CA C 88 61.700 60.502 1.198 1
1 966 . 20 1 1 A 88 88 THR CB C 88 70.400 72.234 -1.834 1
1 968 . 20 1 1 A 88 88 THR N N 88 117.500 121.437 -3.937 1
1 969 . 20 1 1 A 89 89 ASP H H 89 7.700 8.592 -0.892 1
1 970 . 20 1 1 A 89 89 ASP HA H 89 4.480 4.594 -0.114 1
1 973 . 20 1 1 A 89 89 ASP C C 89 175.900 177.149 -1.249 1
1 974 . 20 1 1 A 89 89 ASP CA C 89 55.900 54.304 1.596 1
1 975 . 20 1 1 A 89 89 ASP CB C 89 43.900 41.803 2.097 1
1 976 . 20 1 1 A 89 89 ASP N N 89 120.800 125.051 -4.251 1
1 977 . 20 1 1 A 90 90 TYR H H 90 8.240 9.044 -0.804 1
1 978 . 20 1 1 A 90 90 TYR HA H 90 3.920 4.155 -0.235 1
1 983 . 20 1 1 A 90 90 TYR C C 90 176.400 177.614 -1.214 1
1 984 . 20 1 1 A 90 90 TYR CA C 90 62.300 61.934 0.366 1
1 985 . 20 1 1 A 90 90 TYR CB C 90 39.500 38.692 0.808 1
1 988 . 20 1 1 A 90 90 TYR N N 90 126.100 128.289 -2.189 1
1 989 . 20 1 1 A 91 91 SER H H 91 9.160 8.147 1.013 1
1 990 . 20 1 1 A 91 91 SER HA H 91 4.000 4.112 -0.112 1
1 993 . 20 1 1 A 91 91 SER C C 91 178.000 177.563 0.437 1
1 994 . 20 1 1 A 91 91 SER CA C 91 62.600 61.722 0.878 1
1 995 . 20 1 1 A 91 91 SER CB C 91 62.200 63.184 -0.984 1
1 996 . 20 1 1 A 91 91 SER N N 91 116.600 114.410 2.190 1
1 997 . 20 1 1 A 92 92 GLU H H 92 8.590 8.458 0.132 1
1 998 . 20 1 1 A 92 92 GLU HA H 92 4.050 4.126 -0.076 1
1 1003 . 20 1 1 A 92 92 GLU C C 92 179.400 178.656 0.744 1
1 1004 . 20 1 1 A 92 92 GLU CA C 92 58.900 58.741 0.159 1
1 1005 . 20 1 1 A 92 92 GLU CB C 92 30.600 29.488 1.112 1
1 1007 . 20 1 1 A 92 92 GLU N N 92 120.200 120.289 -0.089 1
1 1008 . 20 1 1 A 93 93 PHE H H 93 7.870 8.052 -0.182 1
1 1009 . 20 1 1 A 93 93 PHE HA H 93 4.050 4.126 -0.076 1
1 1015 . 20 1 1 A 93 93 PHE C C 93 176.500 177.744 -1.244 1
1 1016 . 20 1 1 A 93 93 PHE CA C 93 62.200 61.254 0.946 1
1 1017 . 20 1 1 A 93 93 PHE CB C 93 39.700 39.319 0.381 1
1 1021 . 20 1 1 A 93 93 PHE N N 93 120.200 122.039 -1.839 1
1 1022 . 20 1 1 A 94 94 GLN H H 94 8.190 7.893 0.297 1
1 1023 . 20 1 1 A 94 94 GLN HA H 94 3.390 3.474 -0.084 1
1 1030 . 20 1 1 A 94 94 GLN C C 94 178.600 178.763 -0.163 1
1 1031 . 20 1 1 A 94 94 GLN CA C 94 58.800 59.188 -0.388 1
1 1032 . 20 1 1 A 94 94 GLN CB C 94 28.400 27.926 0.474 1
1 1034 . 20 1 1 A 94 94 GLN N N 94 116.800 118.653 -1.853 1
1 1036 . 20 1 1 A 95 95 LYS H H 95 7.060 7.407 -0.347 1
1 1037 . 20 1 1 A 95 95 LYS HA H 95 3.780 4.039 -0.259 1
1 1046 . 20 1 1 A 95 95 LYS C C 95 179.300 179.368 -0.068 1
1 1047 . 20 1 1 A 95 95 LYS CA C 95 59.900 59.290 0.610 1
1 1048 . 20 1 1 A 95 95 LYS CB C 95 32.700 32.418 0.282 1
1 1052 . 20 1 1 A 95 95 LYS N N 95 117.500 119.937 -2.437 1
1 1053 . 20 1 1 A 96 96 ILE H H 96 7.240 7.676 -0.436 1
1 1054 . 20 1 1 A 96 96 ILE HA H 96 3.420 3.546 -0.126 1
1 1064 . 20 1 1 A 96 96 ILE C C 96 177.800 178.306 -0.506 1
1 1065 . 20 1 1 A 96 96 ILE CA C 96 64.300 64.935 -0.635 1
1 1066 . 20 1 1 A 96 96 ILE CB C 96 37.400 37.142 0.258 1
1 1070 . 20 1 1 A 96 96 ILE N N 96 120.700 120.283 0.417 1
1 1071 . 20 1 1 A 97 97 LEU H H 97 7.690 7.897 -0.207 1
1 1072 . 20 1 1 A 97 97 LEU HA H 97 3.580 3.540 0.040 1
1 1082 . 20 1 1 A 97 97 LEU C C 97 179.900 179.235 0.665 1
1 1083 . 20 1 1 A 97 97 LEU CA C 97 58.100 58.215 -0.115 1
1 1084 . 20 1 1 A 97 97 LEU CB C 97 41.500 41.517 -0.017 1
1 1088 . 20 1 1 A 97 97 LEU N N 97 120.000 120.939 -0.939 1
1 1089 . 20 1 1 A 98 98 LYS H H 98 7.510 7.971 -0.461 1
1 1090 . 20 1 1 A 98 98 LYS HA H 98 3.950 3.868 0.082 1
1 1099 . 20 1 1 A 98 98 LYS C C 98 178.700 178.962 -0.262 1
1 1100 . 20 1 1 A 98 98 LYS CA C 98 58.700 60.189 -1.489 1
1 1101 . 20 1 1 A 98 98 LYS CB C 98 32.500 31.962 0.538 1
1 1105 . 20 1 1 A 98 98 LYS N N 98 117.300 117.049 0.251 1
1 1106 . 20 1 1 A 99 99 LYS H H 99 7.470 8.414 -0.944 1
1 1107 . 20 1 1 A 99 99 LYS HA H 99 4.080 3.942 0.138 1
1 1116 . 20 1 1 A 99 99 LYS C C 99 178.100 178.854 -0.754 1
1 1117 . 20 1 1 A 99 99 LYS CA C 99 58.400 59.728 -1.328 1
1 1118 . 20 1 1 A 99 99 LYS CB C 99 33.000 32.396 0.604 1
1 1122 . 20 1 1 A 99 99 LYS N N 99 119.000 120.573 -1.573 1
1 1123 . 20 1 1 A 100 100 ARG H H 100 8.020 7.889 0.131 1
1 1124 . 20 1 1 A 100 100 ARG HA H 100 4.210 4.296 -0.086 1
1 1131 . 20 1 1 A 100 100 ARG C C 100 177.500 176.417 1.083 1
1 1132 . 20 1 1 A 100 100 ARG CA C 100 56.700 55.761 0.939 1
1 1133 . 20 1 1 A 100 100 ARG CB C 100 30.500 30.532 -0.032 1
1 1136 . 20 1 1 A 100 100 ARG N N 100 117.300 115.975 1.325 1
1 1137 . 20 1 1 A 101 101 GLY H H 101 7.910 7.683 0.227 1
1 1138 . 20 1 1 A 101 101 GLY HA2 H 101 3.980 3.922 0.058 1
1 1139 . 20 1 1 A 101 101 GLY HA3 H 101 4.020 3.930 0.090 1
1 1140 . 20 1 1 A 101 101 GLY C C 101 174.400 174.898 -0.498 1
1 1141 . 20 1 1 A 101 101 GLY CA C 101 46.000 46.470 -0.470 1
1 1142 . 20 1 1 A 101 101 GLY N N 101 108.000 108.087 -0.087 1
1 1143 . 20 1 1 A 102 102 THR H H 102 7.880 8.471 -0.591 1
1 1144 . 20 1 1 A 102 102 THR HA H 102 4.360 4.180 0.180 1
1 1149 . 20 1 1 A 102 102 THR C C 102 174.400 173.988 0.412 1
1 1150 . 20 1 1 A 102 102 THR CA C 102 62.100 63.575 -1.475 1
1 1151 . 20 1 1 A 102 102 THR CB C 102 70.500 69.401 1.099 1
1 1153 . 20 1 1 A 102 102 THR N N 102 113.900 115.845 -1.945 1
1 1154 . 20 1 1 A 103 103 LYS H H 103 8.440 8.495 -0.055 1
1 1155 . 20 1 1 A 103 103 LYS C C 103 176.400 175.657 0.743 1
1 1156 . 20 1 1 A 103 103 LYS CA C 103 56.600 55.855 0.745 1
1 1157 . 20 1 1 A 103 103 LYS CB C 103 33.300 33.488 -0.188 1
1 1158 . 20 1 1 A 103 103 LYS N N 103 124.000 127.587 -3.587 1
1 1159 . 20 1 1 A 104 104 LEU H H 104 8.180 9.024 -0.844 1
1 1160 . 20 1 1 A 104 104 LEU HA H 104 4.270 5.006 -0.736 1
1 1170 . 20 1 1 A 104 104 LEU C C 104 177.100 176.935 0.165 1
1 1171 . 20 1 1 A 104 104 LEU CA C 104 55.500 53.490 2.010 1
1 1172 . 20 1 1 A 104 104 LEU CB C 104 42.500 43.424 -0.924 1
1 1176 . 20 1 1 A 104 104 LEU N N 104 123.500 126.781 -3.281 1
1 1177 . 20 1 1 A 105 105 GLU H H 105 8.270 8.665 -0.395 1
1 1178 . 20 1 1 A 105 105 GLU CA C 105 56.700 56.685 0.015 1
1 1179 . 20 1 1 A 105 105 GLU CB C 105 30.800 30.225 0.575 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 95 0.981 1
2 1 1 1 "RMS(OBS, PRED)" CA 101 0.879 1
3 1 1 1 "RMS(OBS, PRED)" CB 97 1.561 1
4 1 1 1 "RMS(OBS, PRED)" H 96 0.539 1
5 1 1 1 "RMS(OBS, PRED)" HA 85 0.357 1
6 1 1 1 "RMS(OBS, PRED)" N 95 3.062 1
7 1 2 1 "RMS(OBS, PRED)" C 95 1.018 1
8 1 2 1 "RMS(OBS, PRED)" CA 101 0.955 1
9 1 2 1 "RMS(OBS, PRED)" CB 97 1.439 1
10 1 2 1 "RMS(OBS, PRED)" H 96 0.518 1
11 1 2 1 "RMS(OBS, PRED)" HA 85 0.357 1
12 1 2 1 "RMS(OBS, PRED)" N 95 2.946 1
13 1 3 1 "RMS(OBS, PRED)" C 95 1.089 1
14 1 3 1 "RMS(OBS, PRED)" CA 101 1.201 1
15 1 3 1 "RMS(OBS, PRED)" CB 97 1.336 1
16 1 3 1 "RMS(OBS, PRED)" H 96 0.559 1
17 1 3 1 "RMS(OBS, PRED)" HA 85 0.342 1
18 1 3 1 "RMS(OBS, PRED)" N 95 2.804 1
19 1 4 1 "RMS(OBS, PRED)" C 95 1.044 1
20 1 4 1 "RMS(OBS, PRED)" CA 101 1.064 1
21 1 4 1 "RMS(OBS, PRED)" CB 97 1.436 1
22 1 4 1 "RMS(OBS, PRED)" H 96 0.523 1
23 1 4 1 "RMS(OBS, PRED)" HA 85 0.365 1
24 1 4 1 "RMS(OBS, PRED)" N 95 2.750 1
25 1 5 1 "RMS(OBS, PRED)" C 95 1.054 1
26 1 5 1 "RMS(OBS, PRED)" CA 101 1.103 1
27 1 5 1 "RMS(OBS, PRED)" CB 97 1.409 1
28 1 5 1 "RMS(OBS, PRED)" H 96 0.549 1
29 1 5 1 "RMS(OBS, PRED)" HA 85 0.338 1
30 1 5 1 "RMS(OBS, PRED)" N 95 3.253 1
31 1 6 1 "RMS(OBS, PRED)" C 95 0.980 1
32 1 6 1 "RMS(OBS, PRED)" CA 101 1.058 1
33 1 6 1 "RMS(OBS, PRED)" CB 97 1.580 1
34 1 6 1 "RMS(OBS, PRED)" H 96 0.532 1
35 1 6 1 "RMS(OBS, PRED)" HA 85 0.379 1
36 1 6 1 "RMS(OBS, PRED)" N 95 3.098 1
37 1 7 1 "RMS(OBS, PRED)" C 95 1.050 1
38 1 7 1 "RMS(OBS, PRED)" CA 101 0.922 1
39 1 7 1 "RMS(OBS, PRED)" CB 97 1.427 1
40 1 7 1 "RMS(OBS, PRED)" H 96 0.567 1
41 1 7 1 "RMS(OBS, PRED)" HA 85 0.315 1
42 1 7 1 "RMS(OBS, PRED)" N 95 3.141 1
43 1 8 1 "RMS(OBS, PRED)" C 95 1.096 1
44 1 8 1 "RMS(OBS, PRED)" CA 101 0.948 1
45 1 8 1 "RMS(OBS, PRED)" CB 97 1.454 1
46 1 8 1 "RMS(OBS, PRED)" H 96 0.578 1
47 1 8 1 "RMS(OBS, PRED)" HA 85 0.337 1
48 1 8 1 "RMS(OBS, PRED)" N 95 2.670 1
49 1 9 1 "RMS(OBS, PRED)" C 95 1.075 1
50 1 9 1 "RMS(OBS, PRED)" CA 101 0.920 1
51 1 9 1 "RMS(OBS, PRED)" CB 97 1.479 1
52 1 9 1 "RMS(OBS, PRED)" H 96 0.563 1
53 1 9 1 "RMS(OBS, PRED)" HA 85 0.339 1
54 1 9 1 "RMS(OBS, PRED)" N 95 2.866 1
55 1 10 1 "RMS(OBS, PRED)" C 95 1.073 1
56 1 10 1 "RMS(OBS, PRED)" CA 101 1.025 1
57 1 10 1 "RMS(OBS, PRED)" CB 97 1.527 1
58 1 10 1 "RMS(OBS, PRED)" H 96 0.511 1
59 1 10 1 "RMS(OBS, PRED)" HA 85 0.342 1
60 1 10 1 "RMS(OBS, PRED)" N 95 3.138 1
61 1 11 1 "RMS(OBS, PRED)" C 95 1.092 1
62 1 11 1 "RMS(OBS, PRED)" CA 101 1.186 1
63 1 11 1 "RMS(OBS, PRED)" CB 97 1.529 1
64 1 11 1 "RMS(OBS, PRED)" H 96 0.542 1
65 1 11 1 "RMS(OBS, PRED)" HA 85 0.380 1
66 1 11 1 "RMS(OBS, PRED)" N 95 3.028 1
67 1 12 1 "RMS(OBS, PRED)" C 95 1.052 1
68 1 12 1 "RMS(OBS, PRED)" CA 101 0.938 1
69 1 12 1 "RMS(OBS, PRED)" CB 97 1.499 1
70 1 12 1 "RMS(OBS, PRED)" H 96 0.525 1
71 1 12 1 "RMS(OBS, PRED)" HA 85 0.303 1
72 1 12 1 "RMS(OBS, PRED)" N 95 2.793 1
73 1 13 1 "RMS(OBS, PRED)" C 95 1.010 1
74 1 13 1 "RMS(OBS, PRED)" CA 101 1.107 1
75 1 13 1 "RMS(OBS, PRED)" CB 97 1.576 1
76 1 13 1 "RMS(OBS, PRED)" H 96 0.570 1
77 1 13 1 "RMS(OBS, PRED)" HA 85 0.314 1
78 1 13 1 "RMS(OBS, PRED)" N 95 2.884 1
79 1 14 1 "RMS(OBS, PRED)" C 95 1.075 1
80 1 14 1 "RMS(OBS, PRED)" CA 101 1.029 1
81 1 14 1 "RMS(OBS, PRED)" CB 97 1.408 1
82 1 14 1 "RMS(OBS, PRED)" H 96 0.550 1
83 1 14 1 "RMS(OBS, PRED)" HA 85 0.333 1
84 1 14 1 "RMS(OBS, PRED)" N 95 2.965 1
85 1 15 1 "RMS(OBS, PRED)" C 95 1.050 1
86 1 15 1 "RMS(OBS, PRED)" CA 101 0.939 1
87 1 15 1 "RMS(OBS, PRED)" CB 97 1.461 1
88 1 15 1 "RMS(OBS, PRED)" H 96 0.558 1
89 1 15 1 "RMS(OBS, PRED)" HA 85 0.318 1
90 1 15 1 "RMS(OBS, PRED)" N 95 3.007 1
91 1 16 1 "RMS(OBS, PRED)" C 95 1.074 1
92 1 16 1 "RMS(OBS, PRED)" CA 101 0.994 1
93 1 16 1 "RMS(OBS, PRED)" CB 97 1.525 1
94 1 16 1 "RMS(OBS, PRED)" H 96 0.547 1
95 1 16 1 "RMS(OBS, PRED)" HA 85 0.381 1
96 1 16 1 "RMS(OBS, PRED)" N 95 2.941 1
97 1 17 1 "RMS(OBS, PRED)" C 95 1.022 1
98 1 17 1 "RMS(OBS, PRED)" CA 101 0.956 1
99 1 17 1 "RMS(OBS, PRED)" CB 97 1.595 1
100 1 17 1 "RMS(OBS, PRED)" H 96 0.561 1
101 1 17 1 "RMS(OBS, PRED)" HA 85 0.350 1
102 1 17 1 "RMS(OBS, PRED)" N 95 3.147 1
103 1 18 1 "RMS(OBS, PRED)" C 95 1.110 1
104 1 18 1 "RMS(OBS, PRED)" CA 101 1.158 1
105 1 18 1 "RMS(OBS, PRED)" CB 97 1.529 1
106 1 18 1 "RMS(OBS, PRED)" H 96 0.516 1
107 1 18 1 "RMS(OBS, PRED)" HA 85 0.376 1
108 1 18 1 "RMS(OBS, PRED)" N 95 2.760 1
109 1 19 1 "RMS(OBS, PRED)" C 95 1.153 1
110 1 19 1 "RMS(OBS, PRED)" CA 101 1.094 1
111 1 19 1 "RMS(OBS, PRED)" CB 97 1.613 1
112 1 19 1 "RMS(OBS, PRED)" H 96 0.554 1
113 1 19 1 "RMS(OBS, PRED)" HA 85 0.334 1
114 1 19 1 "RMS(OBS, PRED)" N 95 3.116 1
115 1 20 1 "RMS(OBS, PRED)" C 95 1.026 1
116 1 20 1 "RMS(OBS, PRED)" CA 101 0.926 1
117 1 20 1 "RMS(OBS, PRED)" CB 97 1.569 1
118 1 20 1 "RMS(OBS, PRED)" H 96 0.585 1
119 1 20 1 "RMS(OBS, PRED)" HA 85 0.322 1
120 1 20 1 "RMS(OBS, PRED)" N 95 3.053 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 13 . 1 1 A 2 2 ASN HA H 2 4.980 5.098 -0.118 2
1 18 . 1 1 A 2 2 ASN C C 2 176.300 176.322 -0.022 2
1 19 . 1 1 A 2 2 ASN CA C 2 52.500 51.833 0.667 2
1 20 . 1 1 A 2 2 ASN CB C 2 40.900 40.845 0.055 2
1 22 . 1 1 A 3 3 SER H H 3 9.940 9.240 0.700 2
1 23 . 1 1 A 3 3 SER HA H 3 3.720 4.138 -0.417 2
1 26 . 1 1 A 3 3 SER C C 3 175.900 176.673 -0.773 2
1 27 . 1 1 A 3 3 SER CA C 3 63.300 61.546 1.754 2
1 28 . 1 1 A 3 3 SER CB C 3 61.700 62.746 -1.046 2
1 29 . 1 1 A 3 3 SER N N 3 118.200 116.741 1.459 2
1 30 . 1 1 A 4 4 GLU H H 4 8.450 8.107 0.343 2
1 31 . 1 1 A 4 4 GLU HA H 4 4.010 4.037 -0.027 2
1 36 . 1 1 A 4 4 GLU C C 4 178.800 179.119 -0.319 2
1 37 . 1 1 A 4 4 GLU CA C 4 60.300 59.176 1.124 2
1 38 . 1 1 A 4 4 GLU CB C 4 29.100 29.488 -0.388 2
1 40 . 1 1 A 4 4 GLU N N 4 123.600 122.296 1.304 2
1 41 . 1 1 A 5 5 VAL H H 5 7.590 7.818 -0.228 2
1 42 . 1 1 A 5 5 VAL HA H 5 3.850 3.695 0.155 2
1 50 . 1 1 A 5 5 VAL C C 5 179.100 178.414 0.686 2
1 51 . 1 1 A 5 5 VAL CA C 5 65.800 66.447 -0.647 2
1 52 . 1 1 A 5 5 VAL CB C 5 32.300 31.525 0.775 2
1 55 . 1 1 A 5 5 VAL N N 5 119.300 119.571 -0.271 2
1 56 . 1 1 A 6 6 ILE H H 6 7.240 8.160 -0.920 2
1 57 . 1 1 A 6 6 ILE HA H 6 3.580 3.614 -0.034 2
1 67 . 1 1 A 6 6 ILE C C 6 177.000 177.921 -0.921 2
1 68 . 1 1 A 6 6 ILE CA C 6 65.300 65.656 -0.356 2
1 69 . 1 1 A 6 6 ILE CB C 6 37.900 37.741 0.159 2
1 73 . 1 1 A 6 6 ILE N N 6 120.300 120.795 -0.495 2
1 74 . 1 1 A 7 7 LYS H H 7 8.050 8.078 -0.028 2
1 75 . 1 1 A 7 7 LYS HA H 7 3.570 3.607 -0.037 2
1 84 . 1 1 A 7 7 LYS C C 7 178.700 179.768 -1.068 2
1 85 . 1 1 A 7 7 LYS CA C 7 61.300 60.409 0.891 2
1 86 . 1 1 A 7 7 LYS CB C 7 32.200 32.112 0.088 2
1 90 . 1 1 A 7 7 LYS N N 7 119.200 118.907 0.293 2
1 91 . 1 1 A 8 8 GLU H H 8 8.100 8.050 0.050 2
1 92 . 1 1 A 8 8 GLU HA H 8 4.000 4.073 -0.073 2
1 97 . 1 1 A 8 8 GLU C C 8 178.500 179.117 -0.617 2
1 98 . 1 1 A 8 8 GLU CA C 8 59.700 59.335 0.365 2
1 99 . 1 1 A 8 8 GLU CB C 8 29.600 29.664 -0.064 2
1 101 . 1 1 A 8 8 GLU N N 8 119.400 120.143 -0.743 2
1 102 . 1 1 A 9 9 PHE H H 9 7.720 8.165 -0.444 2
1 103 . 1 1 A 9 9 PHE HA H 9 4.160 4.097 0.063 2
1 109 . 1 1 A 9 9 PHE C C 9 176.900 176.976 -0.076 2
1 110 . 1 1 A 9 9 PHE CA C 9 61.300 61.296 0.004 2
1 111 . 1 1 A 9 9 PHE CB C 9 39.400 39.121 0.279 2
1 115 . 1 1 A 9 9 PHE N N 9 121.300 121.649 -0.349 2
1 116 . 1 1 A 10 10 LEU H H 10 8.060 8.645 -0.585 2
1 117 . 1 1 A 10 10 LEU HA H 10 3.660 3.781 -0.121 2
1 127 . 1 1 A 10 10 LEU C C 10 179.000 179.197 -0.197 2
1 128 . 1 1 A 10 10 LEU CA C 10 58.000 57.818 0.182 2
1 129 . 1 1 A 10 10 LEU CB C 10 41.400 41.295 0.105 2
1 133 . 1 1 A 10 10 LEU N N 10 118.000 119.158 -1.158 2
1 134 . 1 1 A 11 11 GLU H H 11 7.990 8.492 -0.502 2
1 135 . 1 1 A 11 11 GLU HA H 11 4.110 4.035 0.075 2
1 140 . 1 1 A 11 11 GLU C C 11 174.200 178.570 -4.370 2
1 141 . 1 1 A 11 11 GLU CA C 11 59.200 59.470 -0.270 2
1 142 . 1 1 A 11 11 GLU CB C 11 29.300 29.159 0.141 2
1 144 . 1 1 A 11 11 GLU N N 11 118.300 119.607 -1.307 2
1 145 . 1 1 A 12 12 ASP H H 12 8.080 8.089 -0.009 2
1 146 . 1 1 A 12 12 ASP HA H 12 4.340 4.342 -0.002 2
1 149 . 1 1 A 12 12 ASP C C 12 178.900 178.229 0.671 2
1 150 . 1 1 A 12 12 ASP CA C 12 57.600 57.440 0.160 2
1 151 . 1 1 A 12 12 ASP CB C 12 41.000 41.248 -0.247 2
1 152 . 1 1 A 12 12 ASP N N 12 121.800 119.944 1.856 2
1 153 . 1 1 A 13 13 ILE H H 13 7.610 7.454 0.156 2
1 154 . 1 1 A 13 13 ILE HA H 13 4.240 3.961 0.279 2
1 164 . 1 1 A 13 13 ILE C C 13 176.800 176.647 0.153 2
1 165 . 1 1 A 13 13 ILE CA C 13 62.100 61.462 0.638 2
1 166 . 1 1 A 13 13 ILE CB C 13 38.300 38.126 0.174 2
1 170 . 1 1 A 13 13 ILE N N 13 110.800 112.909 -2.109 2
1 171 . 1 1 A 14 14 GLY H H 14 7.640 7.983 -0.343 2
1 172 . 1 1 A 14 14 GLY HA2 H 14 3.810 3.925 -0.115 2
1 173 . 1 1 A 14 14 GLY HA3 H 14 3.880 3.933 -0.054 2
1 174 . 1 1 A 14 14 GLY C C 14 175.200 174.281 0.919 2
1 175 . 1 1 A 14 14 GLY CA C 14 46.900 46.092 0.808 2
1 176 . 1 1 A 14 14 GLY N N 14 111.800 111.767 0.033 2
1 177 . 1 1 A 15 15 GLU H H 15 7.870 8.051 -0.181 2
1 178 . 1 1 A 15 15 GLU HA H 15 4.680 4.734 -0.054 2
1 183 . 1 1 A 15 15 GLU C C 15 175.100 175.007 0.093 2
1 184 . 1 1 A 15 15 GLU CA C 15 54.800 55.020 -0.220 2
1 185 . 1 1 A 15 15 GLU CB C 15 32.200 32.124 0.076 2
1 187 . 1 1 A 15 15 GLU N N 15 119.200 119.909 -0.709 2
1 188 . 1 1 A 16 16 ASP H H 16 8.220 8.747 -0.527 2
1 189 . 1 1 A 16 16 ASP HA H 16 4.680 5.145 -0.465 2
1 192 . 1 1 A 16 16 ASP C C 16 174.600 175.031 -0.431 2
1 193 . 1 1 A 16 16 ASP CA C 16 53.600 53.131 0.469 2
1 194 . 1 1 A 16 16 ASP CB C 16 42.900 42.745 0.155 2
1 195 . 1 1 A 16 16 ASP N N 16 120.600 123.386 -2.786 2
1 196 . 1 1 A 17 17 TYR H H 17 7.540 8.691 -1.151 2
1 197 . 1 1 A 17 17 TYR HA H 17 4.910 5.658 -0.748 2
1 202 . 1 1 A 17 17 TYR C C 17 173.600 173.871 -0.271 2
1 203 . 1 1 A 17 17 TYR CA C 17 56.200 55.576 0.624 2
1 204 . 1 1 A 17 17 TYR CB C 17 41.100 41.668 -0.568 2
1 207 . 1 1 A 17 17 TYR N N 17 112.700 121.050 -8.350 2
1 208 . 1 1 A 18 18 ILE H H 18 7.950 9.034 -1.084 2
1 209 . 1 1 A 18 18 ILE HA H 18 4.330 4.561 -0.231 2
1 219 . 1 1 A 18 18 ILE C C 18 174.700 174.505 0.195 2
1 220 . 1 1 A 18 18 ILE CA C 18 60.300 60.811 -0.511 2
1 221 . 1 1 A 18 18 ILE CB C 18 41.000 37.797 3.203 2
1 225 . 1 1 A 18 18 ILE N N 18 120.400 123.500 -3.100 2
1 226 . 1 1 A 19 19 GLU H H 19 8.760 8.981 -0.221 2
1 227 . 1 1 A 19 19 GLU HA H 19 5.200 5.159 0.042 2
1 232 . 1 1 A 19 19 GLU C C 19 175.200 175.559 -0.359 2
1 233 . 1 1 A 19 19 GLU CA C 19 55.500 55.497 0.003 2
1 234 . 1 1 A 19 19 GLU CB C 19 32.400 31.312 1.088 2
1 236 . 1 1 A 19 19 GLU N N 19 129.000 128.864 0.136 2
1 237 . 1 1 A 20 20 LEU H H 20 8.730 9.315 -0.585 2
1 238 . 1 1 A 20 20 LEU HA H 20 4.620 4.774 -0.154 2
1 248 . 1 1 A 20 20 LEU C C 20 176.200 176.275 -0.075 2
1 249 . 1 1 A 20 20 LEU CA C 20 54.100 53.514 0.586 2
1 250 . 1 1 A 20 20 LEU CB C 20 44.400 43.178 1.222 2
1 254 . 1 1 A 20 20 LEU N N 20 128.400 128.087 0.313 2
1 255 . 1 1 A 21 21 GLU H H 21 8.700 8.720 -0.020 2
1 256 . 1 1 A 21 21 GLU HA H 21 3.870 4.054 -0.184 2
1 261 . 1 1 A 21 21 GLU C C 21 176.100 176.577 -0.477 2
1 262 . 1 1 A 21 21 GLU CA C 21 58.800 57.261 1.539 2
1 263 . 1 1 A 21 21 GLU CB C 21 28.200 29.104 -0.904 2
1 265 . 1 1 A 21 21 GLU N N 21 122.600 121.017 1.583 2
1 266 . 1 1 A 22 22 ASN H H 22 8.640 8.827 -0.187 2
1 267 . 1 1 A 22 22 ASN HA H 22 4.540 4.325 0.215 2
1 272 . 1 1 A 22 22 ASN C C 22 173.800 173.911 -0.111 2
1 273 . 1 1 A 22 22 ASN CA C 22 54.600 54.746 -0.146 2
1 274 . 1 1 A 22 22 ASN CB C 22 38.400 36.960 1.440 2
1 275 . 1 1 A 22 22 ASN N N 22 118.000 118.073 -0.073 2
1 277 . 1 1 A 23 23 GLU H H 23 7.740 7.652 0.088 2
1 278 . 1 1 A 23 23 GLU HA H 23 5.430 5.012 0.418 2
1 283 . 1 1 A 23 23 GLU C C 23 175.400 175.237 0.163 2
1 284 . 1 1 A 23 23 GLU CA C 23 54.900 55.023 -0.123 2
1 285 . 1 1 A 23 23 GLU CB C 23 34.500 32.108 2.392 2
1 287 . 1 1 A 23 23 GLU N N 23 116.400 117.654 -1.254 2
1 288 . 1 1 A 24 24 ILE H H 24 9.050 9.147 -0.097 2
1 289 . 1 1 A 24 24 ILE HA H 24 4.810 4.774 0.036 2
1 299 . 1 1 A 24 24 ILE C C 24 174.600 174.998 -0.398 2
1 300 . 1 1 A 24 24 ILE CA C 24 60.700 60.396 0.304 2
1 301 . 1 1 A 24 24 ILE CB C 24 41.300 38.850 2.450 2
1 305 . 1 1 A 24 24 ILE N N 24 122.800 125.355 -2.555 2
1 306 . 1 1 A 25 25 HIS H H 25 9.490 9.530 -0.040 2
1 307 . 1 1 A 25 25 HIS HA H 25 5.090 5.494 -0.404 2
1 312 . 1 1 A 25 25 HIS C C 25 176.100 174.755 1.345 2
1 313 . 1 1 A 25 25 HIS CA C 25 56.100 55.225 0.875 2
1 314 . 1 1 A 25 25 HIS CB C 25 33.100 30.959 2.141 2
1 317 . 1 1 A 25 25 HIS N N 25 127.300 126.429 0.871 2
1 318 . 1 1 A 26 26 LEU H H 26 8.820 8.812 0.008 2
1 319 . 1 1 A 26 26 LEU HA H 26 5.160 4.985 0.175 2
1 329 . 1 1 A 26 26 LEU C C 26 178.000 176.206 1.794 2
1 330 . 1 1 A 26 26 LEU CA C 26 52.900 53.474 -0.574 2
1 331 . 1 1 A 26 26 LEU CB C 26 48.100 43.994 4.106 2
1 335 . 1 1 A 26 26 LEU N N 26 121.600 125.241 -3.641 2
1 336 . 1 1 A 27 27 LYS H H 27 8.990 8.800 0.190 2
1 337 . 1 1 A 27 27 LYS HA H 27 4.630 4.601 0.029 2
1 345 . 1 1 A 27 27 LYS CA C 27 55.700 54.283 1.417 2
1 346 . 1 1 A 27 27 LYS CB C 27 31.900 32.450 -0.550 2
1 350 . 1 1 A 27 27 LYS N N 27 125.900 121.052 4.848 2
1 351 . 1 1 A 28 28 PRO HA H 28 4.500 4.452 0.048 2
1 358 . 1 1 A 28 28 PRO C C 28 177.900 178.567 -0.667 2
1 359 . 1 1 A 28 28 PRO CA C 28 67.400 65.933 1.467 2
1 360 . 1 1 A 28 28 PRO CB C 28 32.100 31.871 0.229 2
1 363 . 1 1 A 29 29 GLU H H 29 9.880 8.411 1.469 2
1 364 . 1 1 A 29 29 GLU HA H 29 4.140 4.264 -0.124 2
1 369 . 1 1 A 29 29 GLU C C 29 178.800 179.298 -0.498 2
1 370 . 1 1 A 29 29 GLU CA C 29 60.600 59.647 0.953 2
1 371 . 1 1 A 29 29 GLU CB C 29 29.200 29.402 -0.202 2
1 373 . 1 1 A 29 29 GLU N N 29 117.100 118.126 -1.026 2
1 374 . 1 1 A 30 30 VAL H H 30 7.050 7.841 -0.791 2
1 375 . 1 1 A 30 30 VAL HA H 30 3.850 3.850 -0.000 2
1 383 . 1 1 A 30 30 VAL C C 30 177.700 178.331 -0.631 2
1 384 . 1 1 A 30 30 VAL CA C 30 65.600 66.061 -0.461 2
1 385 . 1 1 A 30 30 VAL CB C 30 32.100 31.893 0.207 2
1 388 . 1 1 A 30 30 VAL N N 30 120.900 120.468 0.432 2
1 389 . 1 1 A 31 31 PHE H H 31 8.980 8.868 0.112 2
1 390 . 1 1 A 31 31 PHE HA H 31 3.870 4.285 -0.415 2
1 394 . 1 1 A 31 31 PHE C C 31 176.700 177.286 -0.586 2
1 395 . 1 1 A 31 31 PHE CA C 31 62.200 61.937 0.263 2
1 396 . 1 1 A 31 31 PHE CB C 31 39.300 39.095 0.205 2
1 398 . 1 1 A 31 31 PHE N N 31 121.100 120.653 0.447 2
1 399 . 1 1 A 32 32 TYR H H 32 8.640 8.447 0.193 2
1 400 . 1 1 A 32 32 TYR HA H 32 3.880 4.624 -0.744 2
1 405 . 1 1 A 32 32 TYR C C 32 176.000 178.121 -2.121 2
1 406 . 1 1 A 32 32 TYR CA C 32 63.300 62.051 1.249 2
1 407 . 1 1 A 32 32 TYR CB C 32 39.100 39.008 0.092 2
1 410 . 1 1 A 32 32 TYR N N 32 117.400 120.795 -3.395 2
1 411 . 1 1 A 33 33 GLU H H 33 7.400 8.029 -0.629 2
1 412 . 1 1 A 33 33 GLU HA H 33 4.050 4.130 -0.080 2
1 417 . 1 1 A 33 33 GLU C C 33 180.200 179.119 1.081 2
1 418 . 1 1 A 33 33 GLU CA C 33 59.500 58.965 0.534 2
1 419 . 1 1 A 33 33 GLU CB C 33 29.300 29.620 -0.320 2
1 421 . 1 1 A 33 33 GLU N N 33 116.100 118.932 -2.832 2
1 422 . 1 1 A 34 34 VAL H H 34 8.530 7.883 0.647 2
1 423 . 1 1 A 34 34 VAL HA H 34 3.350 3.516 -0.166 2
1 431 . 1 1 A 34 34 VAL C C 34 175.800 178.188 -2.388 2
1 432 . 1 1 A 34 34 VAL CA C 34 66.400 66.097 0.303 2
1 433 . 1 1 A 34 34 VAL CB C 34 32.200 31.630 0.571 2
1 436 . 1 1 A 34 34 VAL N N 34 120.600 120.171 0.429 2
1 437 . 1 1 A 35 35 TRP H H 35 9.100 8.344 0.756 2
1 438 . 1 1 A 35 35 TRP HA H 35 3.340 3.684 -0.344 2
1 447 . 1 1 A 35 35 TRP C C 35 178.000 178.170 -0.170 2
1 448 . 1 1 A 35 35 TRP CA C 35 61.800 60.411 1.389 2
1 449 . 1 1 A 35 35 TRP CB C 35 27.900 29.483 -1.583 2
1 455 . 1 1 A 35 35 TRP N N 35 121.700 121.604 0.096 2
1 457 . 1 1 A 36 36 LYS H H 36 7.970 7.765 0.205 2
1 458 . 1 1 A 36 36 LYS HA H 36 3.330 3.646 -0.316 2
1 467 . 1 1 A 36 36 LYS C C 36 180.000 178.146 1.854 2
1 468 . 1 1 A 36 36 LYS CA C 36 59.000 58.444 0.556 2
1 469 . 1 1 A 36 36 LYS CB C 36 31.800 32.046 -0.246 2
1 473 . 1 1 A 36 36 LYS N N 36 116.300 118.312 -2.012 2
1 474 . 1 1 A 37 37 TYR H H 37 7.750 7.931 -0.181 2
1 475 . 1 1 A 37 37 TYR HA H 37 3.940 3.941 -0.001 2
1 480 . 1 1 A 37 37 TYR C C 37 177.600 177.602 -0.002 2
1 481 . 1 1 A 37 37 TYR CA C 37 61.200 60.924 0.276 2
1 482 . 1 1 A 37 37 TYR CB C 37 38.800 38.444 0.356 2
1 485 . 1 1 A 37 37 TYR N N 37 122.700 121.386 1.314 2
1 486 . 1 1 A 38 38 VAL H H 38 7.660 7.349 0.311 2
1 487 . 1 1 A 38 38 VAL HA H 38 3.870 3.914 -0.044 2
1 495 . 1 1 A 38 38 VAL C C 38 175.600 175.877 -0.277 2
1 496 . 1 1 A 38 38 VAL CA C 38 61.100 61.522 -0.422 2
1 497 . 1 1 A 38 38 VAL CB C 38 30.700 31.368 -0.668 2
1 500 . 1 1 A 38 38 VAL N N 38 108.200 112.915 -4.715 2
1 501 . 1 1 A 39 39 GLY H H 39 7.090 7.534 -0.444 2
1 502 . 1 1 A 39 39 GLY HA2 H 39 3.320 3.728 -0.408 2
1 503 . 1 1 A 39 39 GLY HA3 H 39 3.730 3.758 -0.028 2
1 504 . 1 1 A 39 39 GLY C C 39 173.600 174.289 -0.689 2
1 505 . 1 1 A 39 39 GLY CA C 39 46.100 45.167 0.933 2
1 506 . 1 1 A 39 39 GLY N N 39 107.600 110.208 -2.608 2
1 507 . 1 1 A 40 40 GLU H H 40 7.730 8.005 -0.275 2
1 508 . 1 1 A 40 40 GLU HA H 40 1.090 2.994 -1.903 2
1 513 . 1 1 A 40 40 GLU CA C 40 55.700 56.357 -0.657 2
1 514 . 1 1 A 40 40 GLU CB C 40 27.200 27.323 -0.123 2
1 516 . 1 1 A 40 40 GLU N N 40 114.400 116.556 -2.156 2
1 517 . 1 1 A 41 41 PRO HA H 41 4.310 4.559 -0.249 2
1 524 . 1 1 A 41 41 PRO CA C 41 62.300 62.335 -0.035 2
1 525 . 1 1 A 41 41 PRO CB C 41 32.700 32.639 0.061 2
1 528 . 1 1 A 42 42 GLU H H 42 8.110 8.605 -0.495 2
1 529 . 1 1 A 42 42 GLU C C 42 175.800 176.375 -0.575 2
1 530 . 1 1 A 42 42 GLU CA C 42 57.800 56.770 1.030 2
1 531 . 1 1 A 42 42 GLU CB C 42 30.600 30.300 0.300 2
1 533 . 1 1 A 42 42 GLU N N 42 119.100 121.063 -1.963 2
1 534 . 1 1 A 43 43 LEU H H 43 8.140 8.795 -0.655 2
1 535 . 1 1 A 43 43 LEU HA H 43 4.840 4.761 0.079 2
1 545 . 1 1 A 43 43 LEU C C 43 177.300 176.108 1.192 2
1 546 . 1 1 A 43 43 LEU CA C 43 53.700 53.994 -0.294 2
1 547 . 1 1 A 43 43 LEU CB C 43 43.900 42.912 0.988 2
1 551 . 1 1 A 43 43 LEU N N 43 124.700 125.892 -1.192 2
1 552 . 1 1 A 44 44 LYS H H 44 8.640 8.460 0.180 2
1 553 . 1 1 A 44 44 LYS HA H 44 4.500 4.737 -0.237 2
1 562 . 1 1 A 44 44 LYS C C 44 174.500 175.686 -1.186 2
1 563 . 1 1 A 44 44 LYS CA C 44 54.700 54.965 -0.265 2
1 564 . 1 1 A 44 44 LYS CB C 44 36.200 34.043 2.157 2
1 568 . 1 1 A 44 44 LYS N N 44 123.300 123.240 0.060 2
1 569 . 1 1 A 45 45 THR H H 45 7.990 8.707 -0.717 2
1 570 . 1 1 A 45 45 THR HA H 45 5.700 5.509 0.191 2
1 575 . 1 1 A 45 45 THR C C 45 175.100 173.803 1.297 2
1 576 . 1 1 A 45 45 THR CA C 45 59.600 59.704 -0.104 2
1 577 . 1 1 A 45 45 THR CB C 45 73.400 71.145 2.255 2
1 579 . 1 1 A 45 45 THR N N 45 106.900 114.641 -7.741 2
1 580 . 1 1 A 46 46 TYR H H 46 8.470 9.194 -0.724 2
1 581 . 1 1 A 46 46 TYR HA H 46 4.930 5.741 -0.811 2
1 586 . 1 1 A 46 46 TYR C C 46 172.400 173.460 -1.060 2
1 587 . 1 1 A 46 46 TYR CA C 46 57.100 55.374 1.726 2
1 588 . 1 1 A 46 46 TYR CB C 46 40.200 42.030 -1.830 2
1 591 . 1 1 A 46 46 TYR N N 46 117.100 119.380 -2.280 2
1 592 . 1 1 A 47 47 VAL H H 47 8.430 8.992 -0.562 2
1 593 . 1 1 A 47 47 VAL HA H 47 4.890 4.513 0.377 2
1 601 . 1 1 A 47 47 VAL C C 47 175.800 174.436 1.364 2
1 602 . 1 1 A 47 47 VAL CA C 47 60.800 61.797 -0.997 2
1 603 . 1 1 A 47 47 VAL CB C 47 34.800 32.652 2.148 2
1 606 . 1 1 A 47 47 VAL N N 47 119.200 122.008 -2.808 2
1 607 . 1 1 A 48 48 ILE H H 48 8.680 9.096 -0.416 2
1 608 . 1 1 A 48 48 ILE HA H 48 4.560 4.921 -0.361 2
1 618 . 1 1 A 48 48 ILE C C 48 174.500 174.401 0.099 2
1 619 . 1 1 A 48 48 ILE CA C 48 59.700 59.608 0.092 2
1 620 . 1 1 A 48 48 ILE CB C 48 41.500 40.530 0.970 2
1 624 . 1 1 A 48 48 ILE N N 48 124.400 128.529 -4.129 2
1 625 . 1 1 A 49 49 GLU H H 49 8.320 8.895 -0.574 2
1 626 . 1 1 A 49 49 GLU C C 49 175.500 174.931 0.569 2
1 627 . 1 1 A 49 49 GLU CA C 49 55.500 55.796 -0.296 2
1 628 . 1 1 A 49 49 GLU CB C 49 31.800 30.331 1.469 2
1 630 . 1 1 A 49 49 GLU N N 49 123.400 128.566 -5.166 2
1 631 . 1 1 A 50 50 ASP H H 50 8.610 8.909 -0.299 2
1 632 . 1 1 A 50 50 ASP C C 50 175.100 174.976 0.124 2
1 633 . 1 1 A 50 50 ASP CA C 50 53.100 53.090 0.010 2
1 634 . 1 1 A 50 50 ASP CB C 50 44.000 42.892 1.108 2
1 635 . 1 1 A 50 50 ASP N N 50 124.300 126.741 -2.441 2
1 636 . 1 1 A 51 51 GLU H H 51 8.450 8.821 -0.371 2
1 637 . 1 1 A 51 51 GLU C C 51 175.900 175.861 0.039 2
1 638 . 1 1 A 51 51 GLU CA C 51 56.000 56.130 -0.130 2
1 639 . 1 1 A 51 51 GLU CB C 51 31.700 30.537 1.163 2
1 640 . 1 1 A 51 51 GLU N N 51 121.300 124.391 -3.090 2
1 641 . 1 1 A 52 52 ILE H H 52 8.480 8.600 -0.120 2
1 642 . 1 1 A 52 52 ILE C C 52 175.400 174.945 0.455 2
1 643 . 1 1 A 52 52 ILE CA C 52 60.400 61.199 -0.799 2
1 644 . 1 1 A 52 52 ILE CB C 52 40.000 38.047 1.953 2
1 645 . 1 1 A 52 52 ILE N N 52 122.700 123.883 -1.183 2
1 646 . 1 1 A 53 53 VAL H H 53 8.140 8.550 -0.410 2
1 647 . 1 1 A 53 53 VAL C C 53 175.600 174.868 0.732 2
1 648 . 1 1 A 53 53 VAL CA C 53 61.900 60.765 1.135 2
1 649 . 1 1 A 53 53 VAL CB C 53 33.200 33.494 -0.294 2
1 650 . 1 1 A 53 53 VAL N N 53 124.400 124.927 -0.526 2
1 651 . 1 1 A 54 54 GLU H H 54 8.540 8.668 -0.128 2
1 652 . 1 1 A 54 54 GLU CA C 54 55.600 53.756 1.844 2
1 653 . 1 1 A 54 54 GLU CB C 54 34.300 30.469 3.831 2
1 654 . 1 1 A 54 54 GLU N N 54 125.900 125.621 0.279 2
1 655 . 1 1 A 55 55 PRO C C 55 177.500 176.807 0.693 2
1 656 . 1 1 A 55 55 PRO CA C 55 63.400 63.370 0.030 2
1 657 . 1 1 A 55 55 PRO CB C 55 32.300 32.185 0.115 2
1 658 . 1 1 A 56 56 GLY H H 56 8.420 8.158 0.262 2
1 659 . 1 1 A 56 56 GLY HA2 H 56 3.830 4.108 -0.278 2
1 660 . 1 1 A 56 56 GLY HA3 H 56 4.000 4.130 -0.130 2
1 661 . 1 1 A 56 56 GLY C C 56 174.500 174.789 -0.289 2
1 662 . 1 1 A 56 56 GLY CA C 56 45.400 45.562 -0.162 2
1 663 . 1 1 A 56 56 GLY N N 56 109.700 107.947 1.753 2
1 664 . 1 1 A 57 57 GLU H H 57 8.180 7.985 0.195 2
1 665 . 1 1 A 57 57 GLU C C 57 176.300 176.281 0.019 2
1 666 . 1 1 A 57 57 GLU CA C 57 57.500 57.235 0.265 2
1 667 . 1 1 A 57 57 GLU CB C 57 30.400 30.236 0.164 2
1 668 . 1 1 A 57 57 GLU N N 57 120.900 119.977 0.923 2
1 669 . 1 1 A 58 58 TYR H H 58 8.020 8.157 -0.137 2
1 670 . 1 1 A 58 58 TYR C C 58 175.100 174.935 0.165 2
1 671 . 1 1 A 58 58 TYR CA C 58 57.400 58.152 -0.752 2
1 672 . 1 1 A 58 58 TYR CB C 58 38.900 40.127 -1.227 2
1 673 . 1 1 A 58 58 TYR N N 58 118.800 120.186 -1.386 2
1 674 . 1 1 A 59 59 ASP H H 59 7.950 8.450 -0.500 2
1 675 . 1 1 A 59 59 ASP CA C 59 52.700 51.696 1.004 2
1 676 . 1 1 A 59 59 ASP CB C 59 41.000 41.875 -0.875 2
1 677 . 1 1 A 59 59 ASP N N 59 123.500 121.615 1.885 2
1 678 . 1 1 A 61 61 PRO HA H 61 4.510 4.487 0.023 2
1 685 . 1 1 A 61 61 PRO C C 61 176.500 176.758 -0.258 2
1 686 . 1 1 A 61 61 PRO CA C 61 63.700 63.660 0.040 2
1 687 . 1 1 A 61 61 PRO CB C 61 34.200 31.636 2.564 2
1 690 . 1 1 A 62 62 GLU H H 62 8.490 8.324 0.166 2
1 691 . 1 1 A 62 62 GLU N N 62 124.600 120.763 3.837 2
1 692 . 1 1 A 64 64 LYS C C 64 176.300 175.172 1.128 2
1 693 . 1 1 A 64 64 LYS CA C 64 57.000 56.131 0.869 2
1 694 . 1 1 A 64 64 LYS CB C 64 33.100 33.261 -0.161 2
1 695 . 1 1 A 65 65 TYR H H 65 7.960 8.475 -0.515 2
1 696 . 1 1 A 65 65 TYR C C 65 176.000 175.141 0.859 2
1 697 . 1 1 A 65 65 TYR CA C 65 57.800 57.183 0.617 2
1 698 . 1 1 A 65 65 TYR CB C 65 38.800 39.520 -0.720 2
1 699 . 1 1 A 65 65 TYR N N 65 119.300 122.382 -3.082 2
1 700 . 1 1 A 66 66 THR H H 66 7.820 8.491 -0.671 2
1 701 . 1 1 A 66 66 THR HA H 66 4.280 4.584 -0.304 2
1 706 . 1 1 A 66 66 THR C C 66 174.100 174.203 -0.103 2
1 707 . 1 1 A 66 66 THR CA C 66 62.100 61.650 0.450 2
1 708 . 1 1 A 66 66 THR CB C 66 70.000 70.265 -0.265 2
1 710 . 1 1 A 66 66 THR N N 66 113.900 116.997 -3.097 2
1 711 . 1 1 A 67 67 ASN H H 67 8.270 8.609 -0.339 2
1 712 . 1 1 A 67 67 ASN C C 67 174.100 174.975 -0.875 2
1 713 . 1 1 A 67 67 ASN CA C 67 53.400 53.485 -0.085 2
1 714 . 1 1 A 67 67 ASN CB C 67 39.300 39.345 -0.045 2
1 715 . 1 1 A 67 67 ASN N N 67 121.400 122.971 -1.571 2
1 716 . 1 1 A 68 68 VAL H H 68 7.660 8.323 -0.663 2
1 717 . 1 1 A 68 68 VAL C C 68 175.500 174.744 0.756 2
1 718 . 1 1 A 68 68 VAL CA C 68 61.800 61.643 0.157 2
1 719 . 1 1 A 68 68 VAL CB C 68 33.700 32.607 1.093 2
1 720 . 1 1 A 68 68 VAL N N 68 119.400 121.936 -2.536 2
1 721 . 1 1 A 69 69 LYS H H 69 8.690 8.652 0.038 2
1 722 . 1 1 A 69 69 LYS C C 69 175.200 175.183 0.017 2
1 723 . 1 1 A 69 69 LYS CA C 69 55.200 54.930 0.270 2
1 724 . 1 1 A 69 69 LYS CB C 69 35.200 34.377 0.823 2
1 725 . 1 1 A 69 69 LYS N N 69 126.500 126.635 -0.135 2
1 726 . 1 1 A 70 70 LYS H H 70 8.230 8.823 -0.593 2
1 727 . 1 1 A 70 70 LYS C C 70 176.400 175.625 0.775 2
1 728 . 1 1 A 70 70 LYS CA C 70 55.600 55.733 -0.133 2
1 729 . 1 1 A 70 70 LYS CB C 70 33.800 33.578 0.222 2
1 730 . 1 1 A 70 70 LYS N N 70 122.700 125.981 -3.281 2
1 731 . 1 1 A 71 71 VAL H H 71 8.530 9.106 -0.576 2
1 732 . 1 1 A 71 71 VAL HA H 71 4.510 4.665 -0.155 2
1 733 . 1 1 A 71 71 VAL C C 71 174.700 174.806 -0.106 2
1 734 . 1 1 A 71 71 VAL CA C 71 60.900 60.941 -0.041 2
1 735 . 1 1 A 71 71 VAL CB C 71 34.800 33.271 1.529 2
1 738 . 1 1 A 71 71 VAL N N 71 121.200 123.260 -2.060 2
1 739 . 1 1 A 72 72 LYS H H 72 8.210 8.797 -0.587 2
1 740 . 1 1 A 72 72 LYS HA H 72 4.800 4.638 0.162 2
1 747 . 1 1 A 72 72 LYS C C 72 176.200 175.337 0.863 2
1 748 . 1 1 A 72 72 LYS CA C 72 55.700 55.902 -0.202 2
1 749 . 1 1 A 72 72 LYS CB C 72 33.700 32.610 1.090 2
1 752 . 1 1 A 72 72 LYS N N 72 123.600 126.440 -2.840 2
1 753 . 1 1 A 73 73 ILE H H 73 8.890 8.918 -0.028 2
1 754 . 1 1 A 73 73 ILE C C 73 174.400 174.419 -0.019 2
1 755 . 1 1 A 73 73 ILE CA C 73 60.400 60.090 0.310 2
1 756 . 1 1 A 73 73 ILE CB C 73 40.800 38.657 2.143 2
1 760 . 1 1 A 73 73 ILE N N 73 125.100 125.905 -0.805 2
1 761 . 1 1 A 74 74 LYS H H 74 8.420 8.855 -0.435 2
1 762 . 1 1 A 74 74 LYS HA H 74 4.800 4.824 -0.024 2
1 771 . 1 1 A 74 74 LYS C C 74 175.600 175.122 0.478 2
1 772 . 1 1 A 74 74 LYS CA C 74 56.200 55.193 1.007 2
1 773 . 1 1 A 74 74 LYS CB C 74 34.300 33.767 0.533 2
1 777 . 1 1 A 74 74 LYS N N 74 126.400 128.492 -2.092 2
1 778 . 1 1 A 75 75 LYS H H 75 9.090 8.627 0.463 2
1 779 . 1 1 A 75 75 LYS HA H 75 4.800 4.920 -0.120 2
1 788 . 1 1 A 75 75 LYS C C 75 174.900 174.886 0.014 2
1 789 . 1 1 A 75 75 LYS CA C 75 53.200 54.449 -1.249 2
1 790 . 1 1 A 75 75 LYS CB C 75 34.200 35.275 -1.075 2
1 794 . 1 1 A 75 75 LYS N N 75 127.500 126.439 1.061 2
1 795 . 1 1 A 76 76 VAL H H 76 8.610 8.764 -0.154 2
1 796 . 1 1 A 76 76 VAL HA H 76 5.340 5.109 0.231 2
1 804 . 1 1 A 76 76 VAL C C 76 171.400 173.877 -2.477 2
1 805 . 1 1 A 76 76 VAL CA C 76 58.000 59.581 -1.581 2
1 806 . 1 1 A 76 76 VAL CB C 76 36.400 35.286 1.114 2
1 809 . 1 1 A 76 76 VAL N N 76 120.100 120.993 -0.893 2
1 810 . 1 1 A 77 77 TYR H H 77 9.110 9.167 -0.057 2
1 811 . 1 1 A 77 77 TYR HA H 77 6.150 5.813 0.337 2
1 816 . 1 1 A 77 77 TYR C C 77 173.600 173.106 0.494 2
1 817 . 1 1 A 77 77 TYR CA C 77 56.200 55.806 0.394 2
1 818 . 1 1 A 77 77 TYR CB C 77 44.000 41.254 2.746 2
1 821 . 1 1 A 77 77 TYR N N 77 121.300 121.922 -0.622 2
1 822 . 1 1 A 78 78 PHE H H 78 8.190 8.696 -0.506 2
1 823 . 1 1 A 78 78 PHE HA H 78 5.130 5.678 -0.548 2
1 829 . 1 1 A 78 78 PHE C C 78 173.600 172.896 0.704 2
1 830 . 1 1 A 78 78 PHE CA C 78 55.900 55.232 0.668 2
1 831 . 1 1 A 78 78 PHE CB C 78 42.500 42.761 -0.261 2
1 835 . 1 1 A 78 78 PHE N N 78 112.700 117.096 -4.396 2
1 836 . 1 1 A 79 79 GLU H H 79 8.920 9.014 -0.094 2
1 837 . 1 1 A 79 79 GLU HA H 79 5.390 5.135 0.255 2
1 842 . 1 1 A 79 79 GLU C C 79 177.000 176.750 0.250 2
1 843 . 1 1 A 79 79 GLU CA C 79 54.900 55.210 -0.310 2
1 844 . 1 1 A 79 79 GLU CB C 79 33.600 32.069 1.531 2
1 846 . 1 1 A 79 79 GLU N N 79 120.500 120.205 0.295 2
1 847 . 1 1 A 80 80 THR H H 80 8.970 8.899 0.071 2
1 848 . 1 1 A 80 80 THR HA H 80 4.700 4.882 -0.182 2
1 854 . 1 1 A 80 80 THR C C 80 177.000 176.041 0.959 2
1 855 . 1 1 A 80 80 THR CA C 80 61.300 60.518 0.782 2
1 856 . 1 1 A 80 80 THR CB C 80 70.500 71.633 -1.133 2
1 858 . 1 1 A 80 80 THR N N 80 113.200 115.729 -2.529 2
1 859 . 1 1 A 81 81 LEU H H 81 8.610 8.818 -0.208 2
1 860 . 1 1 A 81 81 LEU HA H 81 4.230 4.105 0.125 2
1 870 . 1 1 A 81 81 LEU C C 81 177.400 177.763 -0.363 2
1 871 . 1 1 A 81 81 LEU CA C 81 57.700 57.333 0.367 2
1 872 . 1 1 A 81 81 LEU CB C 81 42.400 41.569 0.831 2
1 876 . 1 1 A 81 81 LEU N N 81 120.900 122.193 -1.293 2
1 877 . 1 1 A 82 82 ASP H H 82 8.850 7.859 0.991 2
1 878 . 1 1 A 82 82 ASP HA H 82 4.670 4.684 -0.014 2
1 881 . 1 1 A 82 82 ASP C C 82 174.100 175.519 -1.419 2
1 882 . 1 1 A 82 82 ASP CA C 82 52.700 53.603 -0.903 2
1 883 . 1 1 A 82 82 ASP CB C 82 37.900 40.576 -2.676 2
1 884 . 1 1 A 82 82 ASP N N 82 112.300 117.203 -4.903 2
1 885 . 1 1 A 83 83 ASN H H 83 7.790 8.037 -0.247 2
1 886 . 1 1 A 83 83 ASN HA H 83 4.270 4.406 -0.136 2
1 891 . 1 1 A 83 83 ASN C C 83 176.100 174.340 1.760 2
1 892 . 1 1 A 83 83 ASN CA C 83 55.300 54.552 0.748 2
1 893 . 1 1 A 83 83 ASN CB C 83 36.900 37.356 -0.456 2
1 894 . 1 1 A 83 83 ASN N N 83 113.000 114.794 -1.794 2
1 896 . 1 1 A 84 84 VAL H H 84 7.660 7.600 0.060 2
1 897 . 1 1 A 84 84 VAL HA H 84 4.270 4.140 0.130 2
1 905 . 1 1 A 84 84 VAL C C 84 175.800 175.122 0.678 2
1 906 . 1 1 A 84 84 VAL CA C 84 61.500 62.321 -0.821 2
1 907 . 1 1 A 84 84 VAL CB C 84 33.500 32.327 1.173 2
1 910 . 1 1 A 84 84 VAL N N 84 119.700 119.701 -0.001 2
1 911 . 1 1 A 85 85 ARG H H 85 8.180 8.965 -0.785 2
1 912 . 1 1 A 85 85 ARG HA H 85 4.870 4.786 0.084 2
1 920 . 1 1 A 85 85 ARG C C 85 174.000 174.982 -0.982 2
1 921 . 1 1 A 85 85 ARG CA C 85 55.700 55.265 0.435 2
1 922 . 1 1 A 85 85 ARG CB C 85 32.600 31.042 1.558 2
1 925 . 1 1 A 85 85 ARG N N 85 124.800 127.445 -2.645 2
1 927 . 1 1 A 86 86 VAL H H 86 8.570 8.403 0.167 2
1 928 . 1 1 A 86 86 VAL HA H 86 4.580 4.600 -0.020 2
1 936 . 1 1 A 86 86 VAL C C 86 175.700 175.190 0.510 2
1 937 . 1 1 A 86 86 VAL CA C 86 61.700 62.096 -0.396 2
1 938 . 1 1 A 86 86 VAL CB C 86 30.900 31.023 -0.123 2
1 941 . 1 1 A 86 86 VAL N N 86 127.300 125.136 2.164 2
1 942 . 1 1 A 87 87 VAL H H 87 8.790 8.923 -0.133 2
1 943 . 1 1 A 87 87 VAL HA H 87 5.010 4.884 0.126 2
1 951 . 1 1 A 87 87 VAL C C 87 175.500 174.790 0.710 2
1 952 . 1 1 A 87 87 VAL CA C 87 61.900 60.899 1.001 2
1 953 . 1 1 A 87 87 VAL CB C 87 36.300 33.242 3.058 2
1 956 . 1 1 A 87 87 VAL N N 87 125.700 128.706 -3.006 2
1 957 . 1 1 A 88 88 THR H H 88 8.350 8.849 -0.499 2
1 958 . 1 1 A 88 88 THR HA H 88 4.620 4.613 0.007 2
1 964 . 1 1 A 88 88 THR C C 88 173.300 172.266 1.034 2
1 965 . 1 1 A 88 88 THR CA C 88 61.700 60.453 1.247 2
1 966 . 1 1 A 88 88 THR CB C 88 70.400 71.710 -1.310 2
1 968 . 1 1 A 88 88 THR N N 88 117.500 120.509 -3.009 2
1 969 . 1 1 A 89 89 ASP H H 89 7.700 8.565 -0.865 2
1 970 . 1 1 A 89 89 ASP HA H 89 4.480 4.645 -0.165 2
1 973 . 1 1 A 89 89 ASP C C 89 175.900 176.936 -1.036 2
1 974 . 1 1 A 89 89 ASP CA C 89 55.900 54.276 1.624 2
1 975 . 1 1 A 89 89 ASP CB C 89 43.900 41.605 2.295 2
1 976 . 1 1 A 89 89 ASP N N 89 120.800 124.760 -3.960 2
1 977 . 1 1 A 90 90 TYR H H 90 8.240 8.946 -0.706 2
1 978 . 1 1 A 90 90 TYR HA H 90 3.920 4.138 -0.218 2
1 983 . 1 1 A 90 90 TYR C C 90 176.400 177.544 -1.144 2
1 984 . 1 1 A 90 90 TYR CA C 90 62.300 61.472 0.828 2
1 985 . 1 1 A 90 90 TYR CB C 90 39.500 38.914 0.586 2
1 988 . 1 1 A 90 90 TYR N N 90 126.100 127.860 -1.760 2
1 989 . 1 1 A 91 91 SER H H 91 9.160 8.150 1.010 2
1 990 . 1 1 A 91 91 SER HA H 91 4.000 4.077 -0.076 2
1 993 . 1 1 A 91 91 SER C C 91 178.000 176.903 1.097 2
1 994 . 1 1 A 91 91 SER CA C 91 62.600 61.692 0.908 2
1 995 . 1 1 A 91 91 SER CB C 91 62.200 62.840 -0.640 2
1 996 . 1 1 A 91 91 SER N N 91 116.600 115.409 1.192 2
1 997 . 1 1 A 92 92 GLU H H 92 8.590 8.201 0.389 2
1 998 . 1 1 A 92 92 GLU HA H 92 4.050 4.120 -0.070 2
1 1003 . 1 1 A 92 92 GLU C C 92 179.400 178.688 0.712 2
1 1004 . 1 1 A 92 92 GLU CA C 92 58.900 58.781 0.119 2
1 1005 . 1 1 A 92 92 GLU CB C 92 30.600 29.344 1.256 2
1 1007 . 1 1 A 92 92 GLU N N 92 120.200 121.619 -1.419 2
1 1008 . 1 1 A 93 93 PHE H H 93 7.870 8.132 -0.262 2
1 1009 . 1 1 A 93 93 PHE HA H 93 4.050 4.115 -0.065 2
1 1015 . 1 1 A 93 93 PHE C C 93 176.500 177.782 -1.282 2
1 1016 . 1 1 A 93 93 PHE CA C 93 62.200 61.197 1.003 2
1 1017 . 1 1 A 93 93 PHE CB C 93 39.700 39.162 0.538 2
1 1021 . 1 1 A 93 93 PHE N N 93 120.200 121.643 -1.443 2
1 1022 . 1 1 A 94 94 GLN H H 94 8.190 8.191 -0.001 2
1 1023 . 1 1 A 94 94 GLN HA H 94 3.390 3.577 -0.187 2
1 1030 . 1 1 A 94 94 GLN C C 94 178.600 178.331 0.269 2
1 1031 . 1 1 A 94 94 GLN CA C 94 58.800 58.903 -0.103 2
1 1032 . 1 1 A 94 94 GLN CB C 94 28.400 28.028 0.372 2
1 1034 . 1 1 A 94 94 GLN N N 94 116.800 118.221 -1.421 2
1 1036 . 1 1 A 95 95 LYS H H 95 7.060 7.594 -0.534 2
1 1037 . 1 1 A 95 95 LYS HA H 95 3.780 4.016 -0.236 2
1 1046 . 1 1 A 95 95 LYS C C 95 179.300 179.104 0.196 2
1 1047 . 1 1 A 95 95 LYS CA C 95 59.900 59.045 0.855 2
1 1048 . 1 1 A 95 95 LYS CB C 95 32.700 32.170 0.530 2
1 1052 . 1 1 A 95 95 LYS N N 95 117.500 120.376 -2.876 2
1 1053 . 1 1 A 96 96 ILE H H 96 7.240 7.647 -0.407 2
1 1054 . 1 1 A 96 96 ILE HA H 96 3.420 3.533 -0.113 2
1 1064 . 1 1 A 96 96 ILE C C 96 177.800 178.150 -0.350 2
1 1065 . 1 1 A 96 96 ILE CA C 96 64.300 64.972 -0.672 2
1 1066 . 1 1 A 96 96 ILE CB C 96 37.400 37.157 0.243 2
1 1070 . 1 1 A 96 96 ILE N N 96 120.700 120.185 0.515 2
1 1071 . 1 1 A 97 97 LEU H H 97 7.690 7.887 -0.197 2
1 1072 . 1 1 A 97 97 LEU HA H 97 3.580 3.671 -0.091 2
1 1082 . 1 1 A 97 97 LEU C C 97 179.900 179.094 0.806 2
1 1083 . 1 1 A 97 97 LEU CA C 97 58.100 57.773 0.327 2
1 1084 . 1 1 A 97 97 LEU CB C 97 41.500 41.084 0.416 2
1 1088 . 1 1 A 97 97 LEU N N 97 120.000 120.441 -0.441 2
1 1089 . 1 1 A 98 98 LYS H H 98 7.510 8.019 -0.509 2
1 1090 . 1 1 A 98 98 LYS HA H 98 3.950 3.942 0.008 2
1 1099 . 1 1 A 98 98 LYS C C 98 178.700 179.036 -0.336 2
1 1100 . 1 1 A 98 98 LYS CA C 98 58.700 59.518 -0.818 2
1 1101 . 1 1 A 98 98 LYS CB C 98 32.500 32.034 0.466 2
1 1105 . 1 1 A 98 98 LYS N N 98 117.300 118.596 -1.296 2
1 1106 . 1 1 A 99 99 LYS H H 99 7.470 7.944 -0.474 2
1 1107 . 1 1 A 99 99 LYS HA H 99 4.080 3.959 0.121 2
1 1116 . 1 1 A 99 99 LYS C C 99 178.100 178.780 -0.680 2
1 1117 . 1 1 A 99 99 LYS CA C 99 58.400 59.623 -1.223 2
1 1118 . 1 1 A 99 99 LYS CB C 99 33.000 32.294 0.706 2
1 1122 . 1 1 A 99 99 LYS N N 99 119.000 119.983 -0.983 2
1 1123 . 1 1 A 100 100 ARG H H 100 8.020 7.748 0.272 2
1 1124 . 1 1 A 100 100 ARG HA H 100 4.210 4.283 -0.073 2
1 1131 . 1 1 A 100 100 ARG C C 100 177.500 176.530 0.970 2
1 1132 . 1 1 A 100 100 ARG CA C 100 56.700 56.657 0.043 2
1 1133 . 1 1 A 100 100 ARG CB C 100 30.500 30.874 -0.374 2
1 1136 . 1 1 A 100 100 ARG N N 100 117.300 117.295 0.005 2
1 1137 . 1 1 A 101 101 GLY H H 101 7.910 7.810 0.100 2
1 1138 . 1 1 A 101 101 GLY HA2 H 101 3.980 3.965 0.015 2
1 1139 . 1 1 A 101 101 GLY HA3 H 101 4.020 3.979 0.041 2
1 1140 . 1 1 A 101 101 GLY C C 101 174.400 174.773 -0.373 2
1 1141 . 1 1 A 101 101 GLY CA C 101 46.000 46.073 -0.073 2
1 1142 . 1 1 A 101 101 GLY N N 101 108.000 107.929 0.071 2
1 1143 . 1 1 A 102 102 THR H H 102 7.880 8.030 -0.150 2
1 1144 . 1 1 A 102 102 THR HA H 102 4.360 4.297 0.063 2
1 1149 . 1 1 A 102 102 THR C C 102 174.400 174.230 0.170 2
1 1150 . 1 1 A 102 102 THR CA C 102 62.100 63.566 -1.466 2
1 1151 . 1 1 A 102 102 THR CB C 102 70.500 69.302 1.198 2
1 1153 . 1 1 A 102 102 THR N N 102 113.900 114.742 -0.842 2
1 1154 . 1 1 A 103 103 LYS H H 103 8.440 8.363 0.077 2
1 1155 . 1 1 A 103 103 LYS C C 103 176.400 176.083 0.317 2
1 1156 . 1 1 A 103 103 LYS CA C 103 56.600 55.606 0.994 2
1 1157 . 1 1 A 103 103 LYS CB C 103 33.300 33.535 -0.235 2
1 1158 . 1 1 A 103 103 LYS N N 103 124.000 123.825 0.175 2
1 1159 . 1 1 A 104 104 LEU H H 104 8.180 8.519 -0.339 2
1 1160 . 1 1 A 104 104 LEU HA H 104 4.270 4.463 -0.193 2
1 1170 . 1 1 A 104 104 LEU C C 104 177.100 177.054 0.046 2
1 1171 . 1 1 A 104 104 LEU CA C 104 55.500 55.011 0.489 2
1 1172 . 1 1 A 104 104 LEU CB C 104 42.500 42.426 0.074 2
1 1176 . 1 1 A 104 104 LEU N N 104 123.500 124.623 -1.123 2
1 1177 . 1 1 A 105 105 GLU H H 105 8.270 8.363 -0.093 2
1 1178 . 1 1 A 105 105 GLU CA C 105 56.700 57.056 -0.356 2
1 1179 . 1 1 A 105 105 GLU CB C 105 30.800 30.357 0.443 2
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