data_15642_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15642
_Entry.PDB_ID 2K06
_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 2 . 1 1 1 A 2 2 SER H H 2 7.890 8.466 -0.576 1
1 3 . 1 1 1 A 2 2 SER HA H 2 4.270 4.265 0.005 1
1 4 . 1 1 1 A 2 2 SER C C 2 173.960 174.493 -0.533 1
1 5 . 1 1 1 A 2 2 SER CA C 2 60.800 61.942 -1.142 1
1 6 . 1 1 1 A 2 2 SER N N 2 111.940 117.258 -5.318 1
1 7 . 1 1 1 A 3 3 GLU H H 3 8.010 7.828 0.182 1
1 8 . 1 1 1 A 3 3 GLU HA H 3 4.360 4.819 -0.459 1
1 9 . 1 1 1 A 3 3 GLU C C 3 175.710 175.663 0.047 1
1 10 . 1 1 1 A 3 3 GLU CA C 3 56.310 55.026 1.284 1
1 11 . 1 1 1 A 3 3 GLU N N 3 121.280 120.193 1.087 1
1 12 . 1 1 1 A 4 4 ALA H H 4 8.540 8.539 0.001 1
1 13 . 1 1 1 A 4 4 ALA HA H 4 4.560 4.273 0.287 1
1 14 . 1 1 1 A 4 4 ALA CA C 4 50.630 50.854 -0.224 1
1 15 . 1 1 1 A 4 4 ALA N N 4 127.840 127.925 -0.085 1
1 16 . 1 1 1 A 5 5 PRO HA H 5 4.420 4.603 -0.183 1
1 17 . 1 1 1 A 5 5 PRO C C 5 174.240 175.399 -1.159 1
1 18 . 1 1 1 A 5 5 PRO CA C 5 62.840 62.664 0.176 1
1 19 . 1 1 1 A 6 6 LYS H H 6 8.320 8.488 -0.168 1
1 20 . 1 1 1 A 6 6 LYS HA H 6 4.290 4.688 -0.398 1
1 21 . 1 1 1 A 6 6 LYS C C 6 176.100 174.856 1.244 1
1 22 . 1 1 1 A 6 6 LYS CA C 6 55.540 54.953 0.587 1
1 23 . 1 1 1 A 6 6 LYS N N 6 121.910 121.849 0.061 1
1 24 . 1 1 1 A 7 7 LYS H H 7 8.450 8.746 -0.296 1
1 25 . 1 1 1 A 7 7 LYS HA H 7 3.940 4.682 -0.742 1
1 26 . 1 1 1 A 7 7 LYS C C 7 175.700 175.817 -0.117 1
1 27 . 1 1 1 A 7 7 LYS CA C 7 56.440 54.956 1.484 1
1 28 . 1 1 1 A 7 7 LYS N N 7 122.250 126.739 -4.489 1
1 29 . 1 1 1 A 8 8 ARG H H 8 8.210 8.737 -0.527 1
1 30 . 1 1 1 A 8 8 ARG HA H 8 4.670 4.817 -0.147 1
1 31 . 1 1 1 A 8 8 ARG C C 8 173.760 174.411 -0.651 1
1 32 . 1 1 1 A 8 8 ARG CA C 8 53.420 53.872 -0.452 1
1 33 . 1 1 1 A 8 8 ARG N N 8 122.560 123.371 -0.811 1
1 34 . 1 1 1 A 9 9 TRP H H 9 8.610 8.737 -0.127 1
1 35 . 1 1 1 A 9 9 TRP HA H 9 4.910 5.160 -0.250 1
1 44 . 1 1 1 A 9 9 TRP C C 9 174.610 175.472 -0.862 1
1 45 . 1 1 1 A 9 9 TRP CA C 9 57.630 55.696 1.934 1
1 46 . 1 1 1 A 9 9 TRP CB C 9 31.020 30.485 0.535 1
1 52 . 1 1 1 A 9 9 TRP N N 9 120.540 121.462 -0.922 1
1 54 . 1 1 1 A 10 10 TYR H H 10 9.260 9.507 -0.247 1
1 55 . 1 1 1 A 10 10 TYR HA H 10 4.820 5.227 -0.407 1
1 62 . 1 1 1 A 10 10 TYR C C 10 174.340 175.391 -1.051 1
1 63 . 1 1 1 A 10 10 TYR CA C 10 57.050 56.399 0.651 1
1 64 . 1 1 1 A 10 10 TYR CB C 10 41.920 42.511 -0.591 1
1 69 . 1 1 1 A 10 10 TYR N N 10 118.990 121.825 -2.835 1
1 70 . 1 1 1 A 11 11 VAL H H 11 9.450 9.027 0.423 1
1 71 . 1 1 1 A 11 11 VAL HA H 11 4.470 4.881 -0.411 1
1 79 . 1 1 1 A 11 11 VAL C C 11 175.030 175.458 -0.428 1
1 80 . 1 1 1 A 11 11 VAL CA C 11 62.320 61.720 0.600 1
1 81 . 1 1 1 A 11 11 VAL CB C 11 32.400 33.248 -0.848 1
1 84 . 1 1 1 A 11 11 VAL N N 11 120.930 122.610 -1.680 1
1 85 . 1 1 1 A 12 12 VAL H H 12 9.320 9.513 -0.193 1
1 86 . 1 1 1 A 12 12 VAL HA H 12 3.940 4.249 -0.309 1
1 94 . 1 1 1 A 12 12 VAL C C 12 173.870 173.761 0.109 1
1 95 . 1 1 1 A 12 12 VAL CA C 12 61.330 60.728 0.602 1
1 96 . 1 1 1 A 12 12 VAL CB C 12 33.500 34.316 -0.816 1
1 99 . 1 1 1 A 12 12 VAL N N 12 128.860 127.608 1.252 1
1 100 . 1 1 1 A 13 13 GLN H H 13 8.830 8.680 0.150 1
1 101 . 1 1 1 A 13 13 GLN HA H 13 4.710 5.013 -0.303 1
1 108 . 1 1 1 A 13 13 GLN C C 13 174.230 174.935 -0.705 1
1 109 . 1 1 1 A 13 13 GLN CA C 13 54.800 54.476 0.324 1
1 110 . 1 1 1 A 13 13 GLN CB C 13 29.450 30.339 -0.889 1
1 111 . 1 1 1 A 13 13 GLN N N 13 126.050 127.239 -1.189 1
1 113 . 1 1 1 A 14 14 ALA H H 14 9.420 8.634 0.786 1
1 114 . 1 1 1 A 14 14 ALA HA H 14 5.150 4.855 0.295 1
1 118 . 1 1 1 A 14 14 ALA C C 14 176.400 176.026 0.374 1
1 119 . 1 1 1 A 14 14 ALA CA C 14 49.660 50.675 -1.015 1
1 120 . 1 1 1 A 14 14 ALA CB C 14 22.840 23.448 -0.608 1
1 121 . 1 1 1 A 14 14 ALA N N 14 131.620 127.583 4.037 1
1 122 . 1 1 1 A 15 15 PHE H H 15 8.070 8.712 -0.642 1
1 123 . 1 1 1 A 15 15 PHE HA H 15 4.410 4.752 -0.342 1
1 128 . 1 1 1 A 15 15 PHE C C 15 176.130 175.849 0.281 1
1 129 . 1 1 1 A 15 15 PHE CA C 15 58.550 58.846 -0.296 1
1 130 . 1 1 1 A 15 15 PHE CB C 15 39.780 39.576 0.204 1
1 133 . 1 1 1 A 15 15 PHE N N 15 119.680 119.051 0.629 1
1 134 . 1 1 1 A 16 16 SER H H 16 8.370 8.902 -0.532 1
1 135 . 1 1 1 A 16 16 SER HA H 16 4.140 4.459 -0.319 1
1 138 . 1 1 1 A 16 16 SER C C 16 175.820 174.955 0.865 1
1 139 . 1 1 1 A 16 16 SER CA C 16 60.570 59.389 1.181 1
1 140 . 1 1 1 A 16 16 SER CB C 16 63.030 63.320 -0.290 1
1 141 . 1 1 1 A 16 16 SER N N 16 119.700 117.347 2.353 1
1 142 . 1 1 1 A 17 17 GLY H H 17 9.130 8.762 0.368 1
1 143 . 1 1 1 A 17 17 GLY HA2 H 17 3.640 3.708 -0.068 1
1 144 . 1 1 1 A 17 17 GLY HA3 H 17 4.200 3.795 0.405 1
1 145 . 1 1 1 A 17 17 GLY C C 17 175.520 174.718 0.802 1
1 146 . 1 1 1 A 17 17 GLY CA C 17 45.260 45.380 -0.120 1
1 147 . 1 1 1 A 17 17 GLY N N 17 115.850 112.320 3.530 1
1 148 . 1 1 1 A 18 18 PHE H H 18 8.480 7.674 0.806 1
1 149 . 1 1 1 A 18 18 PHE HA H 18 4.740 4.585 0.155 1
1 154 . 1 1 1 A 18 18 PHE C C 18 175.430 176.562 -1.132 1
1 155 . 1 1 1 A 18 18 PHE CA C 18 58.240 58.225 0.015 1
1 156 . 1 1 1 A 18 18 PHE CB C 18 39.010 38.993 0.017 1
1 159 . 1 1 1 A 18 18 PHE N N 18 118.550 119.894 -1.344 1
1 160 . 1 1 1 A 19 19 GLU H H 19 10.690 8.389 2.301 1
1 161 . 1 1 1 A 19 19 GLU HA H 19 3.490 4.059 -0.569 1
1 166 . 1 1 1 A 19 19 GLU C C 19 177.650 179.262 -1.612 1
1 167 . 1 1 1 A 19 19 GLU CA C 19 62.280 59.751 2.529 1
1 168 . 1 1 1 A 19 19 GLU CB C 19 28.380 29.330 -0.950 1
1 170 . 1 1 1 A 19 19 GLU N N 19 123.470 123.127 0.343 1
1 171 . 1 1 1 A 20 20 GLY H H 20 8.740 8.331 0.409 1
1 172 . 1 1 1 A 20 20 GLY HA2 H 20 3.840 3.826 0.014 1
1 173 . 1 1 1 A 20 20 GLY HA3 H 20 3.940 3.842 0.098 1
1 174 . 1 1 1 A 20 20 GLY C C 20 176.860 175.663 1.197 1
1 175 . 1 1 1 A 20 20 GLY CA C 20 47.140 47.249 -0.109 1
1 176 . 1 1 1 A 20 20 GLY N N 20 105.480 108.048 -2.568 1
1 177 . 1 1 1 A 21 21 ARG H H 21 7.690 8.203 -0.513 1
1 178 . 1 1 1 A 21 21 ARG HA H 21 4.180 4.131 0.049 1
1 185 . 1 1 1 A 21 21 ARG C C 21 179.490 178.514 0.976 1
1 186 . 1 1 1 A 21 21 ARG CA C 21 58.660 58.936 -0.276 1
1 187 . 1 1 1 A 21 21 ARG CB C 21 30.100 29.716 0.384 1
1 190 . 1 1 1 A 21 21 ARG N N 21 123.120 121.782 1.338 1
1 191 . 1 1 1 A 22 22 VAL H H 22 8.980 8.731 0.249 1
1 192 . 1 1 1 A 22 22 VAL HA H 22 3.560 3.667 -0.107 1
1 200 . 1 1 1 A 22 22 VAL C C 22 177.320 178.306 -0.986 1
1 201 . 1 1 1 A 22 22 VAL CA C 22 66.960 66.428 0.532 1
1 202 . 1 1 1 A 22 22 VAL CB C 22 31.050 31.654 -0.604 1
1 205 . 1 1 1 A 22 22 VAL N N 22 122.760 120.334 2.426 1
1 206 . 1 1 1 A 23 23 ALA H H 23 8.280 7.850 0.430 1
1 207 . 1 1 1 A 23 23 ALA HA H 23 3.850 4.042 -0.192 1
1 211 . 1 1 1 A 23 23 ALA C C 23 179.340 179.611 -0.271 1
1 212 . 1 1 1 A 23 23 ALA CA C 23 56.260 55.248 1.012 1
1 213 . 1 1 1 A 23 23 ALA CB C 23 18.260 18.072 0.188 1
1 214 . 1 1 1 A 23 23 ALA N N 23 122.120 121.753 0.367 1
1 215 . 1 1 1 A 24 24 THR H H 24 8.020 7.616 0.404 1
1 216 . 1 1 1 A 24 24 THR HA H 24 3.920 3.963 -0.043 1
1 221 . 1 1 1 A 24 24 THR C C 24 176.940 176.580 0.360 1
1 222 . 1 1 1 A 24 24 THR CA C 24 66.820 66.718 0.102 1
1 223 . 1 1 1 A 24 24 THR CB C 24 68.930 68.159 0.771 1
1 225 . 1 1 1 A 24 24 THR N N 24 113.410 115.557 -2.147 1
1 226 . 1 1 1 A 25 25 SER H H 25 8.570 8.021 0.549 1
1 227 . 1 1 1 A 25 25 SER HA H 25 4.400 3.950 0.450 1
1 230 . 1 1 1 A 25 25 SER C C 25 177.610 176.083 1.527 1
1 231 . 1 1 1 A 25 25 SER CA C 25 61.920 62.330 -0.410 1
1 232 . 1 1 1 A 25 25 SER CB C 25 63.540 62.986 0.554 1
1 233 . 1 1 1 A 25 25 SER N N 25 118.260 117.659 0.601 1
1 234 . 1 1 1 A 26 26 LEU H H 26 9.430 8.004 1.426 1
1 235 . 1 1 1 A 26 26 LEU HA H 26 3.900 3.958 -0.058 1
1 245 . 1 1 1 A 26 26 LEU C C 26 177.710 178.668 -0.958 1
1 246 . 1 1 1 A 26 26 LEU CA C 26 58.910 58.064 0.846 1
1 247 . 1 1 1 A 26 26 LEU CB C 26 41.300 41.481 -0.181 1
1 251 . 1 1 1 A 26 26 LEU N N 26 124.120 121.023 3.097 1
1 252 . 1 1 1 A 27 27 ARG H H 27 7.790 7.609 0.181 1
1 253 . 1 1 1 A 27 27 ARG HA H 27 3.880 3.703 0.177 1
1 260 . 1 1 1 A 27 27 ARG C C 27 179.380 178.717 0.663 1
1 261 . 1 1 1 A 27 27 ARG CA C 27 60.510 59.581 0.929 1
1 262 . 1 1 1 A 27 27 ARG CB C 27 29.670 29.723 -0.053 1
1 265 . 1 1 1 A 27 27 ARG N N 27 116.710 119.214 -2.504 1
1 266 . 1 1 1 A 28 28 GLU H H 28 7.900 7.522 0.378 1
1 267 . 1 1 1 A 28 28 GLU HA H 28 4.070 3.929 0.141 1
1 272 . 1 1 1 A 28 28 GLU C C 28 179.450 178.981 0.469 1
1 273 . 1 1 1 A 28 28 GLU CA C 28 59.450 58.820 0.630 1
1 274 . 1 1 1 A 28 28 GLU CB C 28 29.610 29.266 0.344 1
1 276 . 1 1 1 A 28 28 GLU N N 28 118.340 118.461 -0.121 1
1 277 . 1 1 1 A 29 29 HIS H H 29 8.940 7.699 1.241 1
1 278 . 1 1 1 A 29 29 HIS HA H 29 4.160 4.478 -0.318 1
1 283 . 1 1 1 A 29 29 HIS C C 29 177.750 177.776 -0.026 1
1 284 . 1 1 1 A 29 29 HIS CA C 29 61.260 58.943 2.317 1
1 285 . 1 1 1 A 29 29 HIS CB C 29 29.870 30.099 -0.229 1
1 287 . 1 1 1 A 29 29 HIS N N 29 120.440 118.536 1.904 1
1 288 . 1 1 1 A 30 30 ILE H H 30 8.580 9.023 -0.443 1
1 289 . 1 1 1 A 30 30 ILE HA H 30 3.160 3.628 -0.468 1
1 299 . 1 1 1 A 30 30 ILE C C 30 177.230 178.065 -0.835 1
1 300 . 1 1 1 A 30 30 ILE CA C 30 66.460 65.272 1.188 1
1 301 . 1 1 1 A 30 30 ILE CB C 30 38.630 37.342 1.288 1
1 305 . 1 1 1 A 30 30 ILE N N 30 121.010 119.829 1.181 1
1 306 . 1 1 1 A 31 31 LYS H H 31 7.020 8.571 -1.551 1
1 307 . 1 1 1 A 31 31 LYS HA H 31 4.170 4.023 0.147 1
1 316 . 1 1 1 A 31 31 LYS C C 31 180.570 178.476 2.094 1
1 317 . 1 1 1 A 31 31 LYS CA C 31 58.920 59.918 -0.998 1
1 318 . 1 1 1 A 31 31 LYS CB C 31 32.490 31.853 0.637 1
1 322 . 1 1 1 A 31 31 LYS N N 31 117.400 121.245 -3.845 1
1 323 . 1 1 1 A 32 32 LEU H H 32 8.400 8.561 -0.161 1
1 324 . 1 1 1 A 32 32 LEU HA H 32 3.990 3.934 0.056 1
1 334 . 1 1 1 A 32 32 LEU C C 32 178.230 178.302 -0.072 1
1 335 . 1 1 1 A 32 32 LEU CA C 32 57.700 57.843 -0.143 1
1 336 . 1 1 1 A 32 32 LEU CB C 32 42.540 41.587 0.953 1
1 340 . 1 1 1 A 32 32 LEU N N 32 121.180 119.444 1.736 1
1 341 . 1 1 1 A 33 33 HIS H H 33 7.620 8.090 -0.470 1
1 342 . 1 1 1 A 33 33 HIS HA H 33 4.600 4.656 -0.056 1
1 347 . 1 1 1 A 33 33 HIS C C 33 177.090 174.512 2.578 1
1 348 . 1 1 1 A 33 33 HIS CA C 33 55.840 55.481 0.359 1
1 349 . 1 1 1 A 33 33 HIS CB C 33 29.330 30.039 -0.709 1
1 351 . 1 1 1 A 33 33 HIS N N 33 112.220 115.673 -3.453 1
1 352 . 1 1 1 A 34 34 ASN H H 34 8.030 8.016 0.014 1
1 353 . 1 1 1 A 34 34 ASN HA H 34 4.890 4.387 0.503 1
1 358 . 1 1 1 A 34 34 ASN C C 34 175.910 175.858 0.052 1
1 359 . 1 1 1 A 34 34 ASN CA C 34 54.530 54.107 0.423 1
1 360 . 1 1 1 A 34 34 ASN CB C 34 37.380 37.199 0.181 1
1 361 . 1 1 1 A 34 34 ASN N N 34 117.600 116.696 0.904 1
1 363 . 1 1 1 A 35 35 MET H H 35 8.330 8.953 -0.623 1
1 364 . 1 1 1 A 35 35 MET HA H 35 4.940 4.759 0.181 1
1 372 . 1 1 1 A 35 35 MET C C 35 176.880 176.920 -0.040 1
1 373 . 1 1 1 A 35 35 MET CA C 35 55.600 54.626 0.974 1
1 374 . 1 1 1 A 35 35 MET CB C 35 33.790 32.659 1.131 1
1 377 . 1 1 1 A 35 35 MET N N 35 116.190 116.929 -0.739 1
1 378 . 1 1 1 A 36 36 GLU H H 36 9.730 8.205 1.525 1
1 379 . 1 1 1 A 36 36 GLU HA H 36 3.850 4.170 -0.320 1
1 384 . 1 1 1 A 36 36 GLU C C 36 178.290 179.052 -0.762 1
1 385 . 1 1 1 A 36 36 GLU CA C 36 61.280 59.672 1.608 1
1 386 . 1 1 1 A 36 36 GLU CB C 36 29.270 29.096 0.174 1
1 388 . 1 1 1 A 36 36 GLU N N 36 121.630 120.484 1.146 1
1 389 . 1 1 1 A 37 37 ASP H H 37 8.850 8.156 0.694 1
1 390 . 1 1 1 A 37 37 ASP HA H 37 4.470 4.414 0.056 1
1 393 . 1 1 1 A 37 37 ASP C C 37 177.190 178.707 -1.517 1
1 394 . 1 1 1 A 37 37 ASP CA C 37 56.140 57.428 -1.288 1
1 395 . 1 1 1 A 37 37 ASP CB C 37 40.050 40.736 -0.686 1
1 396 . 1 1 1 A 37 37 ASP N N 37 114.390 119.771 -5.381 1
1 397 . 1 1 1 A 38 38 LEU H H 38 7.880 7.790 0.090 1
1 398 . 1 1 1 A 38 38 LEU HA H 38 4.290 4.163 0.127 1
1 408 . 1 1 1 A 38 38 LEU C C 38 175.090 177.633 -2.543 1
1 409 . 1 1 1 A 38 38 LEU CA C 38 54.670 57.752 -3.082 1
1 410 . 1 1 1 A 38 38 LEU CB C 38 42.940 42.126 0.814 1
1 414 . 1 1 1 A 38 38 LEU N N 38 116.550 119.352 -2.802 1
1 415 . 1 1 1 A 39 39 PHE H H 39 7.500 7.611 -0.111 1
1 416 . 1 1 1 A 39 39 PHE HA H 39 4.970 4.632 0.338 1
1 424 . 1 1 1 A 39 39 PHE C C 39 175.380 175.781 -0.401 1
1 425 . 1 1 1 A 39 39 PHE CA C 39 57.580 58.912 -1.332 1
1 426 . 1 1 1 A 39 39 PHE CB C 39 44.990 39.081 5.909 1
1 432 . 1 1 1 A 39 39 PHE N N 39 115.370 117.068 -1.698 1
1 433 . 1 1 1 A 40 40 GLY H H 40 8.680 8.781 -0.101 1
1 434 . 1 1 1 A 40 40 GLY HA2 H 40 3.370 3.922 -0.552 1
1 435 . 1 1 1 A 40 40 GLY HA3 H 40 4.550 4.010 0.540 1
1 436 . 1 1 1 A 40 40 GLY C C 40 173.090 174.278 -1.188 1
1 437 . 1 1 1 A 40 40 GLY CA C 40 44.180 46.460 -2.280 1
1 438 . 1 1 1 A 40 40 GLY N N 40 110.930 111.879 -0.949 1
1 439 . 1 1 1 A 41 41 GLU H H 41 8.320 7.845 0.475 1
1 440 . 1 1 1 A 41 41 GLU HA H 41 4.280 4.930 -0.650 1
1 445 . 1 1 1 A 41 41 GLU C C 41 173.900 174.678 -0.778 1
1 446 . 1 1 1 A 41 41 GLU CA C 41 56.900 55.307 1.593 1
1 447 . 1 1 1 A 41 41 GLU CB C 41 32.110 32.840 -0.730 1
1 449 . 1 1 1 A 41 41 GLU N N 41 126.730 118.859 7.871 1
1 450 . 1 1 1 A 42 42 VAL H H 42 8.100 8.839 -0.739 1
1 451 . 1 1 1 A 42 42 VAL HA H 42 5.160 4.836 0.324 1
1 459 . 1 1 1 A 42 42 VAL C C 42 176.340 174.529 1.811 1
1 460 . 1 1 1 A 42 42 VAL CA C 42 61.200 61.297 -0.097 1
1 461 . 1 1 1 A 42 42 VAL CB C 42 34.770 33.521 1.249 1
1 464 . 1 1 1 A 42 42 VAL N N 42 119.360 126.665 -7.305 1
1 465 . 1 1 1 A 43 43 MET H H 43 9.870 9.730 0.140 1
1 466 . 1 1 1 A 43 43 MET HA H 43 5.070 5.297 -0.227 1
1 474 . 1 1 1 A 43 43 MET C C 43 173.890 175.426 -1.536 1
1 475 . 1 1 1 A 43 43 MET CA C 43 54.740 53.932 0.808 1
1 476 . 1 1 1 A 43 43 MET CB C 43 37.500 35.905 1.595 1
1 479 . 1 1 1 A 43 43 MET N N 43 125.720 126.660 -0.940 1
1 480 . 1 1 1 A 44 44 VAL H H 44 8.800 8.927 -0.127 1
1 481 . 1 1 1 A 44 44 VAL HA H 44 4.720 4.771 -0.051 1
1 489 . 1 1 1 A 44 44 VAL CA C 44 59.090 59.168 -0.078 1
1 490 . 1 1 1 A 44 44 VAL CB C 44 33.710 33.215 0.495 1
1 493 . 1 1 1 A 44 44 VAL N N 44 122.340 123.098 -0.758 1
1 494 . 1 1 1 A 45 45 PRO HA H 45 4.480 4.493 -0.013 1
1 501 . 1 1 1 A 45 45 PRO C C 45 177.080 175.790 1.290 1
1 502 . 1 1 1 A 45 45 PRO CA C 45 63.240 63.930 -0.690 1
1 503 . 1 1 1 A 45 45 PRO CB C 45 32.170 31.628 0.542 1
1 506 . 1 1 1 A 46 46 THR H H 46 8.200 7.567 0.633 1
1 507 . 1 1 1 A 46 46 THR HA H 46 4.290 4.626 -0.336 1
1 512 . 1 1 1 A 46 46 THR C C 46 174.600 172.461 2.139 1
1 513 . 1 1 1 A 46 46 THR CA C 46 62.100 59.789 2.311 1
1 514 . 1 1 1 A 46 46 THR CB C 46 69.990 72.079 -2.089 1
1 516 . 1 1 1 A 46 46 THR N N 46 113.410 111.908 1.502 1
1 517 . 1 1 1 A 47 47 GLU H H 47 8.380 8.659 -0.279 1
1 518 . 1 1 1 A 47 47 GLU HA H 47 4.400 4.541 -0.141 1
1 521 . 1 1 1 A 47 47 GLU C C 47 175.970 177.907 -1.937 1
1 522 . 1 1 1 A 47 47 GLU CA C 47 55.200 54.651 0.549 1
1 523 . 1 1 1 A 47 47 GLU CB C 47 32.300 31.789 0.511 1
1 524 . 1 1 1 A 47 47 GLU N N 47 122.830 125.688 -2.858 1
1 525 . 1 1 1 A 48 48 GLU H H 48 8.400 8.500 -0.100 1
1 526 . 1 1 1 A 48 48 GLU HA H 48 4.280 4.038 0.242 1
1 531 . 1 1 1 A 48 48 GLU C C 48 175.750 176.457 -0.707 1
1 532 . 1 1 1 A 48 48 GLU CA C 48 55.190 59.476 -4.286 1
1 533 . 1 1 1 A 48 48 GLU CB C 48 31.980 30.189 1.791 1
1 535 . 1 1 1 A 48 48 GLU N N 48 121.950 123.098 -1.148 1
1 536 . 1 1 1 A 49 49 VAL H H 49 8.240 7.204 1.036 1
1 537 . 1 1 1 A 49 49 VAL HA H 49 4.170 4.799 -0.629 1
1 542 . 1 1 1 A 49 49 VAL C C 49 174.610 174.552 0.058 1
1 543 . 1 1 1 A 49 49 VAL CA C 49 62.280 59.373 2.907 1
1 544 . 1 1 1 A 49 49 VAL CB C 49 32.930 35.185 -2.255 1
1 546 . 1 1 1 A 49 49 VAL N N 49 123.990 114.357 9.633 1
1 547 . 1 1 1 A 50 50 VAL H H 50 8.230 8.609 -0.379 1
1 548 . 1 1 1 A 50 50 VAL HA H 50 4.220 4.806 -0.586 1
1 553 . 1 1 1 A 50 50 VAL C C 50 175.770 174.004 1.766 1
1 554 . 1 1 1 A 50 50 VAL CA C 50 62.170 58.753 3.417 1
1 555 . 1 1 1 A 50 50 VAL CB C 50 33.110 34.887 -1.777 1
1 557 . 1 1 1 A 50 50 VAL N N 50 123.960 113.751 10.209 1
1 558 . 1 1 1 A 51 51 GLU H H 51 8.570 8.702 -0.132 1
1 559 . 1 1 1 A 51 51 GLU HA H 51 4.380 4.576 -0.196 1
1 564 . 1 1 1 A 51 51 GLU C C 51 175.920 177.390 -1.470 1
1 565 . 1 1 1 A 51 51 GLU CA C 51 56.050 55.901 0.149 1
1 566 . 1 1 1 A 51 51 GLU CB C 51 31.080 31.661 -0.581 1
1 568 . 1 1 1 A 51 51 GLU N N 51 125.070 123.970 1.100 1
1 569 . 1 1 1 A 52 52 ILE H H 52 8.320 8.594 -0.274 1
1 570 . 1 1 1 A 52 52 ILE HA H 52 4.290 3.734 0.556 1
1 580 . 1 1 1 A 52 52 ILE C C 52 176.330 176.872 -0.542 1
1 581 . 1 1 1 A 52 52 ILE CA C 52 60.940 65.062 -4.122 1
1 582 . 1 1 1 A 52 52 ILE CB C 52 38.510 37.540 0.970 1
1 586 . 1 1 1 A 52 52 ILE N N 52 122.760 126.555 -3.795 1
1 587 . 1 1 1 A 53 53 ARG H H 53 8.500 7.650 0.850 1
1 588 . 1 1 1 A 53 53 ARG HA H 53 4.430 4.163 0.267 1
1 595 . 1 1 1 A 53 53 ARG C C 53 176.950 175.515 1.435 1
1 596 . 1 1 1 A 53 53 ARG CA C 53 56.150 56.748 -0.598 1
1 597 . 1 1 1 A 53 53 ARG CB C 53 30.200 31.434 -1.234 1
1 600 . 1 1 1 A 53 53 ARG N N 53 125.250 122.842 2.408 1
1 601 . 1 1 1 A 54 54 GLY H H 54 8.760 8.536 0.224 1
1 602 . 1 1 1 A 54 54 GLY HA2 H 54 3.920 4.329 -0.409 1
1 603 . 1 1 1 A 54 54 GLY HA3 H 54 4.010 4.342 -0.332 1
1 604 . 1 1 1 A 54 54 GLY C C 54 175.110 172.818 2.292 1
1 605 . 1 1 1 A 54 54 GLY CA C 54 46.030 45.203 0.827 1
1 606 . 1 1 1 A 54 54 GLY N N 54 112.510 111.946 0.564 1
1 607 . 1 1 1 A 55 55 GLY H H 55 8.350 8.651 -0.301 1
1 608 . 1 1 1 A 55 55 GLY HA2 H 55 3.980 4.041 -0.061 1
1 609 . 1 1 1 A 55 55 GLY HA3 H 55 3.980 4.041 -0.061 1
1 610 . 1 1 1 A 55 55 GLY C C 55 173.920 175.128 -1.208 1
1 611 . 1 1 1 A 55 55 GLY CA C 55 45.200 45.570 -0.370 1
1 612 . 1 1 1 A 55 55 GLY N N 55 107.940 108.981 -1.041 1
1 613 . 1 1 1 A 56 56 GLN H H 56 8.100 8.525 -0.425 1
1 614 . 1 1 1 A 56 56 GLN HA H 56 4.420 4.061 0.359 1
1 619 . 1 1 1 A 56 56 GLN C C 56 175.570 176.281 -0.711 1
1 620 . 1 1 1 A 56 56 GLN CA C 56 55.420 58.355 -2.935 1
1 621 . 1 1 1 A 56 56 GLN CB C 56 30.100 29.233 0.867 1
1 623 . 1 1 1 A 56 56 GLN N N 56 119.350 120.398 -1.048 1
1 624 . 1 1 1 A 57 57 ARG H H 57 8.520 7.716 0.804 1
1 625 . 1 1 1 A 57 57 ARG HA H 57 4.400 4.710 -0.310 1
1 632 . 1 1 1 A 57 57 ARG C C 57 176.210 176.575 -0.365 1
1 633 . 1 1 1 A 57 57 ARG CA C 57 56.440 54.525 1.915 1
1 634 . 1 1 1 A 57 57 ARG CB C 57 30.930 33.444 -2.514 1
1 637 . 1 1 1 A 57 57 ARG N N 57 122.610 117.945 4.665 1
1 638 . 1 1 1 A 58 58 ARG H H 58 8.630 9.052 -0.422 1
1 639 . 1 1 1 A 58 58 ARG HA H 58 4.430 3.927 0.503 1
1 646 . 1 1 1 A 58 58 ARG C C 58 175.950 178.826 -2.876 1
1 647 . 1 1 1 A 58 58 ARG CA C 58 55.450 59.965 -4.515 1
1 648 . 1 1 1 A 58 58 ARG CB C 58 31.300 29.861 1.439 1
1 651 . 1 1 1 A 58 58 ARG N N 58 123.320 123.452 -0.132 1
1 652 . 1 1 1 A 59 59 LYS H H 59 8.560 7.834 0.726 1
1 653 . 1 1 1 A 59 59 LYS HA H 59 4.410 4.040 0.370 1
1 662 . 1 1 1 A 59 59 LYS C C 59 176.590 176.312 0.278 1
1 663 . 1 1 1 A 59 59 LYS CA C 59 56.720 58.691 -1.971 1
1 664 . 1 1 1 A 59 59 LYS CB C 59 33.150 31.992 1.158 1
1 668 . 1 1 1 A 59 59 LYS N N 59 123.380 120.344 3.036 1
1 669 . 1 1 1 A 60 60 SER H H 60 8.450 7.403 1.047 1
1 670 . 1 1 1 A 60 60 SER HA H 60 4.480 4.387 0.093 1
1 673 . 1 1 1 A 60 60 SER C C 60 174.280 174.254 0.026 1
1 674 . 1 1 1 A 60 60 SER CA C 60 58.140 58.443 -0.303 1
1 675 . 1 1 1 A 60 60 SER CB C 60 64.160 63.889 0.271 1
1 676 . 1 1 1 A 60 60 SER N N 60 117.320 112.120 5.200 1
1 677 . 1 1 1 A 61 61 GLU H H 61 8.550 8.789 -0.239 1
1 678 . 1 1 1 A 61 61 GLU HA H 61 4.400 4.858 -0.458 1
1 683 . 1 1 1 A 61 61 GLU C C 61 176.150 175.223 0.927 1
1 684 . 1 1 1 A 61 61 GLU CA C 61 56.300 54.793 1.507 1
1 685 . 1 1 1 A 61 61 GLU CB C 61 30.790 33.157 -2.367 1
1 687 . 1 1 1 A 61 61 GLU N N 61 122.810 120.743 2.067 1
1 688 . 1 1 1 A 62 62 ARG H H 62 8.310 8.636 -0.326 1
1 689 . 1 1 1 A 62 62 ARG HA H 62 4.340 4.653 -0.313 1
1 692 . 1 1 1 A 62 62 ARG C C 62 176.140 175.907 0.233 1
1 693 . 1 1 1 A 62 62 ARG CA C 62 56.230 54.681 1.549 1
1 694 . 1 1 1 A 62 62 ARG CB C 62 30.780 32.792 -2.012 1
1 695 . 1 1 1 A 62 62 ARG N N 62 122.080 120.738 1.342 1
1 696 . 1 1 1 A 63 63 LYS H H 63 8.470 8.428 0.042 1
1 697 . 1 1 1 A 63 63 LYS HA H 63 4.300 4.320 -0.020 1
1 700 . 1 1 1 A 63 63 LYS C C 63 175.490 176.739 -1.249 1
1 701 . 1 1 1 A 63 63 LYS CA C 63 56.200 56.017 0.183 1
1 702 . 1 1 1 A 63 63 LYS CB C 63 30.730 32.766 -2.036 1
1 703 . 1 1 1 A 63 63 LYS N N 63 123.450 122.481 0.969 1
1 704 . 1 1 1 A 64 64 PHE H H 64 8.200 7.395 0.805 1
1 705 . 1 1 1 A 64 64 PHE HA H 64 4.450 4.213 0.237 1
1 710 . 1 1 1 A 64 64 PHE C C 64 174.250 175.211 -0.961 1
1 711 . 1 1 1 A 64 64 PHE CA C 64 57.430 58.963 -1.533 1
1 712 . 1 1 1 A 64 64 PHE CB C 64 40.330 39.956 0.374 1
1 715 . 1 1 1 A 64 64 PHE N N 64 121.740 119.855 1.885 1
1 716 . 1 1 1 A 65 65 PHE H H 65 8.130 7.978 0.152 1
1 717 . 1 1 1 A 65 65 PHE HA H 65 4.440 5.328 -0.888 1
1 725 . 1 1 1 A 65 65 PHE CA C 65 55.650 54.471 1.179 1
1 726 . 1 1 1 A 65 65 PHE CB C 65 38.900 39.158 -0.258 1
1 731 . 1 1 1 A 65 65 PHE N N 65 120.910 118.413 2.497 1
1 732 . 1 1 1 A 66 66 PRO C C 66 176.780 177.465 -0.685 1
1 733 . 1 1 1 A 67 67 GLY H H 67 9.970 9.007 0.963 1
1 734 . 1 1 1 A 67 67 GLY HA2 H 67 3.820 3.957 -0.137 1
1 735 . 1 1 1 A 67 67 GLY HA3 H 67 4.400 4.001 0.399 1
1 736 . 1 1 1 A 67 67 GLY C C 67 173.670 173.362 0.308 1
1 737 . 1 1 1 A 67 67 GLY CA C 67 45.900 45.296 0.604 1
1 738 . 1 1 1 A 67 67 GLY N N 67 111.550 111.529 0.021 1
1 739 . 1 1 1 A 68 68 TYR H H 68 7.650 8.266 -0.616 1
1 740 . 1 1 1 A 68 68 TYR HA H 68 5.000 5.036 -0.036 1
1 747 . 1 1 1 A 68 68 TYR C C 68 175.220 175.001 0.219 1
1 748 . 1 1 1 A 68 68 TYR CA C 68 57.940 56.704 1.236 1
1 753 . 1 1 1 A 68 68 TYR N N 68 118.800 119.043 -0.243 1
1 754 . 1 1 1 A 69 69 VAL H H 69 9.090 8.875 0.215 1
1 755 . 1 1 1 A 69 69 VAL HA H 69 4.330 4.882 -0.552 1
1 763 . 1 1 1 A 69 69 VAL C C 69 174.250 174.949 -0.699 1
1 764 . 1 1 1 A 69 69 VAL CA C 69 62.120 60.347 1.773 1
1 765 . 1 1 1 A 69 69 VAL CB C 69 35.240 35.818 -0.578 1
1 768 . 1 1 1 A 69 69 VAL N N 69 119.300 122.825 -3.525 1
1 769 . 1 1 1 A 70 70 LEU H H 70 9.190 8.953 0.237 1
1 770 . 1 1 1 A 70 70 LEU HA H 70 5.460 5.404 0.056 1
1 780 . 1 1 1 A 70 70 LEU C C 70 176.130 176.377 -0.247 1
1 781 . 1 1 1 A 70 70 LEU CA C 70 54.120 53.489 0.631 1
1 782 . 1 1 1 A 70 70 LEU CB C 70 43.330 43.335 -0.005 1
1 786 . 1 1 1 A 70 70 LEU N N 70 126.710 126.828 -0.118 1
1 787 . 1 1 1 A 71 71 VAL H H 71 9.350 9.474 -0.124 1
1 788 . 1 1 1 A 71 71 VAL HA H 71 5.040 4.829 0.211 1
1 796 . 1 1 1 A 71 71 VAL C C 71 173.670 174.134 -0.464 1
1 797 . 1 1 1 A 71 71 VAL CA C 71 61.090 61.105 -0.015 1
1 798 . 1 1 1 A 71 71 VAL CB C 71 35.800 35.615 0.185 1
1 801 . 1 1 1 A 71 71 VAL N N 71 121.920 124.638 -2.718 1
1 802 . 1 1 1 A 72 72 GLN H H 72 8.390 8.542 -0.152 1
1 803 . 1 1 1 A 72 72 GLN HA H 72 4.610 4.252 0.358 1
1 810 . 1 1 1 A 72 72 GLN C C 72 175.920 174.275 1.645 1
1 811 . 1 1 1 A 72 72 GLN CA C 72 53.810 54.438 -0.628 1
1 812 . 1 1 1 A 72 72 GLN CB C 72 28.850 28.472 0.378 1
1 814 . 1 1 1 A 72 72 GLN N N 72 130.760 127.548 3.212 1
1 816 . 1 1 1 A 73 73 MET H H 73 9.750 8.732 1.018 1
1 817 . 1 1 1 A 73 73 MET HA H 73 5.060 5.136 -0.076 1
1 825 . 1 1 1 A 73 73 MET C C 73 175.500 174.259 1.241 1
1 826 . 1 1 1 A 73 73 MET CA C 73 55.520 54.365 1.155 1
1 827 . 1 1 1 A 73 73 MET CB C 73 35.350 35.466 -0.116 1
1 830 . 1 1 1 A 73 73 MET N N 73 121.070 124.759 -3.689 1
1 831 . 1 1 1 A 74 74 VAL H H 74 8.530 8.345 0.185 1
1 832 . 1 1 1 A 74 74 VAL HA H 74 3.970 4.445 -0.475 1
1 840 . 1 1 1 A 74 74 VAL C C 74 174.900 175.287 -0.387 1
1 841 . 1 1 1 A 74 74 VAL CA C 74 62.150 61.304 0.846 1
1 842 . 1 1 1 A 74 74 VAL CB C 74 32.480 32.965 -0.485 1
1 845 . 1 1 1 A 74 74 VAL N N 74 124.120 119.789 4.331 1
1 846 . 1 1 1 A 75 75 MET H H 75 8.600 8.634 -0.034 1
1 847 . 1 1 1 A 75 75 MET HA H 75 4.360 4.590 -0.230 1
1 855 . 1 1 1 A 75 75 MET C C 75 173.480 175.678 -2.198 1
1 856 . 1 1 1 A 75 75 MET CA C 75 53.830 55.306 -1.476 1
1 857 . 1 1 1 A 75 75 MET CB C 75 29.960 33.055 -3.095 1
1 860 . 1 1 1 A 75 75 MET N N 75 128.250 124.485 3.765 1
1 861 . 1 1 1 A 76 76 ASN H H 76 8.410 8.033 0.377 1
1 862 . 1 1 1 A 76 76 ASN HA H 76 4.540 5.011 -0.471 1
1 867 . 1 1 1 A 76 76 ASN C C 76 173.950 175.236 -1.286 1
1 868 . 1 1 1 A 76 76 ASN CA C 76 51.720 51.627 0.093 1
1 869 . 1 1 1 A 76 76 ASN CB C 76 38.430 41.175 -2.745 1
1 870 . 1 1 1 A 76 76 ASN N N 76 127.500 124.120 3.380 1
1 872 . 1 1 1 A 77 77 ASP H H 77 8.470 9.043 -0.573 1
1 873 . 1 1 1 A 77 77 ASP HA H 77 4.410 4.294 0.116 1
1 876 . 1 1 1 A 77 77 ASP C C 77 178.530 178.385 0.145 1
1 877 . 1 1 1 A 77 77 ASP CA C 77 58.730 57.400 1.330 1
1 878 . 1 1 1 A 77 77 ASP CB C 77 40.940 40.568 0.372 1
1 879 . 1 1 1 A 77 77 ASP N N 77 117.090 121.813 -4.723 1
1 880 . 1 1 1 A 78 78 ALA H H 78 8.160 8.072 0.088 1
1 881 . 1 1 1 A 78 78 ALA HA H 78 4.350 4.099 0.251 1
1 885 . 1 1 1 A 78 78 ALA C C 78 181.250 180.047 1.203 1
1 886 . 1 1 1 A 78 78 ALA CA C 78 55.190 55.423 -0.233 1
1 887 . 1 1 1 A 78 78 ALA CB C 78 18.260 18.914 -0.654 1
1 888 . 1 1 1 A 78 78 ALA N N 78 122.500 123.929 -1.429 1
1 889 . 1 1 1 A 79 79 SER H H 79 9.320 8.709 0.611 1
1 890 . 1 1 1 A 79 79 SER HA H 79 4.290 4.306 -0.016 1
1 893 . 1 1 1 A 79 79 SER C C 79 176.570 176.658 -0.088 1
1 894 . 1 1 1 A 79 79 SER CA C 79 61.080 61.486 -0.406 1
1 895 . 1 1 1 A 79 79 SER CB C 79 62.200 62.603 -0.403 1
1 896 . 1 1 1 A 79 79 SER N N 79 119.280 112.187 7.093 1
1 897 . 1 1 1 A 80 80 TRP H H 80 8.900 7.918 0.982 1
1 898 . 1 1 1 A 80 80 TRP HA H 80 4.020 4.269 -0.249 1
1 907 . 1 1 1 A 80 80 TRP C C 80 178.210 177.910 0.300 1
1 908 . 1 1 1 A 80 80 TRP CA C 80 62.490 61.380 1.110 1
1 909 . 1 1 1 A 80 80 TRP CB C 80 29.800 29.792 0.008 1
1 915 . 1 1 1 A 80 80 TRP N N 80 125.870 123.746 2.124 1
1 917 . 1 1 1 A 81 81 HIS H H 81 8.190 8.294 -0.104 1
1 918 . 1 1 1 A 81 81 HIS HA H 81 3.930 4.297 -0.367 1
1 923 . 1 1 1 A 81 81 HIS C C 81 177.740 176.434 1.306 1
1 924 . 1 1 1 A 81 81 HIS CA C 81 61.020 59.811 1.209 1
1 925 . 1 1 1 A 81 81 HIS CB C 81 28.910 29.467 -0.557 1
1 927 . 1 1 1 A 81 81 HIS N N 81 114.080 119.689 -5.609 1
1 928 . 1 1 1 A 82 82 LEU H H 82 8.080 8.521 -0.441 1
1 929 . 1 1 1 A 82 82 LEU HA H 82 3.900 3.695 0.205 1
1 939 . 1 1 1 A 82 82 LEU C C 82 180.330 178.453 1.877 1
1 940 . 1 1 1 A 82 82 LEU CA C 82 58.590 58.166 0.424 1
1 941 . 1 1 1 A 82 82 LEU CB C 82 41.350 41.455 -0.105 1
1 945 . 1 1 1 A 82 82 LEU N N 82 121.320 120.524 0.796 1
1 946 . 1 1 1 A 83 83 VAL H H 83 8.000 8.476 -0.476 1
1 947 . 1 1 1 A 83 83 VAL HA H 83 3.210 3.439 -0.229 1
1 955 . 1 1 1 A 83 83 VAL C C 83 177.060 178.087 -1.027 1
1 956 . 1 1 1 A 83 83 VAL CA C 83 67.430 66.692 0.738 1
1 957 . 1 1 1 A 83 83 VAL CB C 83 31.680 31.217 0.463 1
1 960 . 1 1 1 A 83 83 VAL N N 83 118.850 118.598 0.252 1
1 961 . 1 1 1 A 84 84 ARG H H 84 7.540 7.701 -0.161 1
1 962 . 1 1 1 A 84 84 ARG HA H 84 3.590 3.680 -0.090 1
1 969 . 1 1 1 A 84 84 ARG C C 84 177.240 178.665 -1.425 1
1 970 . 1 1 1 A 84 84 ARG CA C 84 56.050 59.631 -3.581 1
1 971 . 1 1 1 A 84 84 ARG CB C 84 28.190 29.612 -1.422 1
1 974 . 1 1 1 A 84 84 ARG N N 84 111.460 120.299 -8.839 1
1 975 . 1 1 1 A 85 85 SER H H 85 7.530 7.392 0.138 1
1 976 . 1 1 1 A 85 85 SER HA H 85 4.280 4.156 0.124 1
1 979 . 1 1 1 A 85 85 SER C C 85 173.930 174.709 -0.779 1
1 980 . 1 1 1 A 85 85 SER CA C 85 59.220 60.515 -1.295 1
1 981 . 1 1 1 A 85 85 SER CB C 85 63.830 62.727 1.103 1
1 982 . 1 1 1 A 85 85 SER N N 85 113.660 114.108 -0.448 1
1 983 . 1 1 1 A 86 86 VAL H H 86 7.230 7.384 -0.154 1
1 984 . 1 1 1 A 86 86 VAL HA H 86 3.480 3.634 -0.154 1
1 992 . 1 1 1 A 86 86 VAL CA C 86 61.300 61.153 0.147 1
1 993 . 1 1 1 A 86 86 VAL CB C 86 31.780 32.148 -0.368 1
1 996 . 1 1 1 A 86 86 VAL N N 86 128.120 125.206 2.914 1
1 997 . 1 1 1 A 87 87 PRO HA H 87 4.140 4.350 -0.210 1
1 1004 . 1 1 1 A 87 87 PRO C C 87 176.400 176.755 -0.355 1
1 1005 . 1 1 1 A 87 87 PRO CA C 87 64.100 63.374 0.726 1
1 1006 . 1 1 1 A 87 87 PRO CB C 87 31.710 32.293 -0.583 1
1 1009 . 1 1 1 A 88 88 ARG H H 88 8.320 8.739 -0.419 1
1 1010 . 1 1 1 A 88 88 ARG HA H 88 3.030 4.015 -0.985 1
1 1017 . 1 1 1 A 88 88 ARG C C 88 174.630 174.862 -0.232 1
1 1018 . 1 1 1 A 88 88 ARG CA C 88 57.620 57.302 0.318 1
1 1019 . 1 1 1 A 88 88 ARG CB C 88 26.960 27.931 -0.971 1
1 1022 . 1 1 1 A 88 88 ARG N N 88 111.360 116.252 -4.892 1
1 1023 . 1 1 1 A 89 89 VAL H H 89 7.390 7.697 -0.307 1
1 1024 . 1 1 1 A 89 89 VAL HA H 89 3.910 4.292 -0.382 1
1 1032 . 1 1 1 A 89 89 VAL C C 89 177.370 175.566 1.804 1
1 1033 . 1 1 1 A 89 89 VAL CA C 89 64.170 61.207 2.963 1
1 1034 . 1 1 1 A 89 89 VAL CB C 89 32.070 33.945 -1.875 1
1 1037 . 1 1 1 A 89 89 VAL N N 89 117.900 118.637 -0.737 1
1 1038 . 1 1 1 A 90 90 MET H H 90 9.290 8.896 0.394 1
1 1039 . 1 1 1 A 90 90 MET HA H 90 4.340 4.151 0.189 1
1 1047 . 1 1 1 A 90 90 MET C C 90 175.800 175.948 -0.148 1
1 1048 . 1 1 1 A 90 90 MET CA C 90 56.440 56.922 -0.482 1
1 1049 . 1 1 1 A 90 90 MET CB C 90 34.160 33.093 1.067 1
1 1052 . 1 1 1 A 90 90 MET N N 90 128.200 125.818 2.382 1
1 1053 . 1 1 1 A 91 91 GLY H H 91 7.130 6.727 0.403 1
1 1054 . 1 1 1 A 91 91 GLY HA2 H 91 3.340 3.934 -0.594 1
1 1055 . 1 1 1 A 91 91 GLY HA3 H 91 4.410 4.040 0.370 1
1 1056 . 1 1 1 A 91 91 GLY C C 91 170.920 171.662 -0.742 1
1 1057 . 1 1 1 A 91 91 GLY CA C 91 44.440 45.447 -1.007 1
1 1058 . 1 1 1 A 91 91 GLY N N 91 104.320 103.899 0.421 1
1 1059 . 1 1 1 A 92 92 PHE H H 92 8.790 8.486 0.304 1
1 1060 . 1 1 1 A 92 92 PHE HA H 92 5.270 5.219 0.051 1
1 1068 . 1 1 1 A 92 92 PHE C C 92 176.230 175.026 1.204 1
1 1069 . 1 1 1 A 92 92 PHE CA C 92 57.480 56.946 0.534 1
1 1070 . 1 1 1 A 92 92 PHE CB C 92 42.190 42.631 -0.441 1
1 1075 . 1 1 1 A 92 92 PHE N N 92 118.770 119.714 -0.944 1
1 1076 . 1 1 1 A 93 93 ILE H H 93 8.800 8.227 0.573 1
1 1077 . 1 1 1 A 93 93 ILE HA H 93 4.310 4.994 -0.684 1
1 1087 . 1 1 1 A 93 93 ILE C C 93 176.380 175.964 0.416 1
1 1088 . 1 1 1 A 93 93 ILE CA C 93 60.480 59.807 0.673 1
1 1089 . 1 1 1 A 93 93 ILE CB C 93 38.010 39.756 -1.746 1
1 1093 . 1 1 1 A 93 93 ILE N N 93 122.300 121.336 0.964 1
1 1094 . 1 1 1 A 94 94 GLY H H 94 8.640 8.439 0.201 1
1 1095 . 1 1 1 A 94 94 GLY HA2 H 94 3.830 4.334 -0.504 1
1 1096 . 1 1 1 A 94 94 GLY HA3 H 94 4.600 4.343 0.257 1
1 1097 . 1 1 1 A 94 94 GLY C C 94 175.080 174.509 0.571 1
1 1098 . 1 1 1 A 94 94 GLY CA C 94 44.530 46.216 -1.686 1
1 1099 . 1 1 1 A 94 94 GLY N N 94 116.550 114.144 2.406 1
1 1100 . 1 1 1 A 95 95 GLY H H 95 8.900 8.757 0.143 1
1 1101 . 1 1 1 A 95 95 GLY HA2 H 95 3.970 3.910 0.060 1
1 1102 . 1 1 1 A 95 95 GLY HA3 H 95 4.370 3.919 0.451 1
1 1103 . 1 1 1 A 95 95 GLY C C 95 174.560 173.911 0.649 1
1 1104 . 1 1 1 A 95 95 GLY CA C 95 45.640 46.848 -1.208 1
1 1105 . 1 1 1 A 95 95 GLY N N 95 112.960 109.940 3.020 1
1 1106 . 1 1 1 A 96 96 THR H H 96 7.830 7.804 0.026 1
1 1107 . 1 1 1 A 96 96 THR HA H 96 4.720 4.846 -0.126 1
1 1112 . 1 1 1 A 96 96 THR C C 96 176.260 173.501 2.759 1
1 1113 . 1 1 1 A 96 96 THR CA C 96 60.360 60.027 0.333 1
1 1114 . 1 1 1 A 96 96 THR CB C 96 70.960 71.191 -0.231 1
1 1116 . 1 1 1 A 96 96 THR N N 96 113.350 113.076 0.274 1
1 1117 . 1 1 1 A 97 97 SER H H 97 8.850 8.778 0.072 1
1 1118 . 1 1 1 A 97 97 SER HA H 97 4.310 4.667 -0.357 1
1 1121 . 1 1 1 A 97 97 SER C C 97 175.570 174.680 0.890 1
1 1122 . 1 1 1 A 97 97 SER CA C 97 60.850 58.583 2.267 1
1 1123 . 1 1 1 A 97 97 SER CB C 97 63.000 63.478 -0.478 1
1 1124 . 1 1 1 A 97 97 SER N N 97 116.420 118.645 -2.225 1
1 1125 . 1 1 1 A 98 98 ASP H H 98 8.360 7.964 0.396 1
1 1126 . 1 1 1 A 98 98 ASP HA H 98 4.310 5.142 -0.832 1
1 1129 . 1 1 1 A 98 98 ASP C C 98 175.380 175.197 0.183 1
1 1130 . 1 1 1 A 98 98 ASP CA C 98 54.190 54.095 0.095 1
1 1131 . 1 1 1 A 98 98 ASP CB C 98 40.740 42.566 -1.826 1
1 1132 . 1 1 1 A 98 98 ASP N N 98 116.320 119.670 -3.350 1
1 1133 . 1 1 1 A 99 99 ARG H H 99 7.450 7.671 -0.221 1
1 1134 . 1 1 1 A 99 99 ARG HA H 99 4.350 4.644 -0.294 1
1 1141 . 1 1 1 A 99 99 ARG CA C 99 52.920 53.057 -0.137 1
1 1142 . 1 1 1 A 99 99 ARG CB C 99 30.340 31.966 -1.626 1
1 1145 . 1 1 1 A 99 99 ARG N N 99 119.960 118.640 1.320 1
1 1146 . 1 1 1 A 100 100 PRO HA H 100 4.750 4.577 0.173 1
1 1153 . 1 1 1 A 100 100 PRO C C 100 175.220 176.956 -1.736 1
1 1154 . 1 1 1 A 100 100 PRO CA C 100 62.680 62.637 0.043 1
1 1155 . 1 1 1 A 100 100 PRO CB C 100 32.820 31.508 1.312 1
1 1158 . 1 1 1 A 101 101 ALA H H 101 7.210 8.310 -1.100 1
1 1159 . 1 1 1 A 101 101 ALA HA H 101 5.030 4.441 0.589 1
1 1163 . 1 1 1 A 101 101 ALA CA C 101 48.570 50.506 -1.936 1
1 1164 . 1 1 1 A 101 101 ALA CB C 101 19.660 17.776 1.884 1
1 1165 . 1 1 1 A 101 101 ALA N N 101 124.490 125.395 -0.905 1
1 1166 . 1 1 1 A 102 102 PRO HA H 102 4.440 4.868 -0.428 1
1 1173 . 1 1 1 A 102 102 PRO C C 102 177.200 176.604 0.596 1
1 1174 . 1 1 1 A 102 102 PRO CA C 102 62.190 62.907 -0.717 1
1 1175 . 1 1 1 A 102 102 PRO CB C 102 32.310 32.827 -0.517 1
1 1178 . 1 1 1 A 103 103 ILE H H 103 8.550 8.346 0.204 1
1 1179 . 1 1 1 A 103 103 ILE HA H 103 4.630 4.969 -0.339 1
1 1189 . 1 1 1 A 103 103 ILE C C 103 175.460 175.230 0.230 1
1 1190 . 1 1 1 A 103 103 ILE CA C 103 59.730 58.550 1.180 1
1 1191 . 1 1 1 A 103 103 ILE CB C 103 40.140 42.098 -1.958 1
1 1195 . 1 1 1 A 103 103 ILE N N 103 115.670 116.656 -0.986 1
1 1196 . 1 1 1 A 104 104 SER H H 104 8.730 8.614 0.116 1
1 1197 . 1 1 1 A 104 104 SER HA H 104 4.500 4.498 0.002 1
1 1200 . 1 1 1 A 104 104 SER C C 104 174.840 175.315 -0.475 1
1 1201 . 1 1 1 A 104 104 SER CA C 104 58.010 59.137 -1.127 1
1 1202 . 1 1 1 A 104 104 SER CB C 104 65.470 63.577 1.893 1
1 1203 . 1 1 1 A 104 104 SER N N 104 119.170 120.015 -0.845 1
1 1204 . 1 1 1 A 105 105 ASP H H 105 8.830 9.070 -0.240 1
1 1205 . 1 1 1 A 105 105 ASP HA H 105 4.200 4.286 -0.086 1
1 1208 . 1 1 1 A 105 105 ASP C C 105 178.520 178.268 0.252 1
1 1209 . 1 1 1 A 105 105 ASP CA C 105 57.870 58.027 -0.157 1
1 1210 . 1 1 1 A 105 105 ASP CB C 105 40.040 40.571 -0.531 1
1 1211 . 1 1 1 A 105 105 ASP N N 105 121.640 125.063 -3.423 1
1 1212 . 1 1 1 A 106 106 LYS H H 106 8.130 8.007 0.123 1
1 1213 . 1 1 1 A 106 106 LYS HA H 106 4.100 3.887 0.213 1
1 1222 . 1 1 1 A 106 106 LYS C C 106 179.400 178.790 0.610 1
1 1223 . 1 1 1 A 106 106 LYS CA C 106 58.980 59.520 -0.540 1
1 1224 . 1 1 1 A 106 106 LYS CB C 106 32.330 32.141 0.189 1
1 1228 . 1 1 1 A 106 106 LYS N N 106 118.300 120.603 -2.303 1
1 1229 . 1 1 1 A 107 107 GLU H H 107 7.670 8.074 -0.404 1
1 1230 . 1 1 1 A 107 107 GLU HA H 107 4.020 4.037 -0.017 1
1 1235 . 1 1 1 A 107 107 GLU C C 107 178.750 179.691 -0.941 1
1 1236 . 1 1 1 A 107 107 GLU CA C 107 59.210 59.041 0.169 1
1 1237 . 1 1 1 A 107 107 GLU CB C 107 29.780 29.651 0.129 1
1 1239 . 1 1 1 A 107 107 GLU N N 107 121.270 119.333 1.937 1
1 1240 . 1 1 1 A 108 108 VAL H H 108 7.790 7.686 0.104 1
1 1241 . 1 1 1 A 108 108 VAL HA H 108 3.050 3.392 -0.342 1
1 1249 . 1 1 1 A 108 108 VAL C C 108 177.550 177.566 -0.016 1
1 1250 . 1 1 1 A 108 108 VAL CA C 108 67.080 66.175 0.905 1
1 1251 . 1 1 1 A 108 108 VAL CB C 108 31.220 30.890 0.330 1
1 1254 . 1 1 1 A 108 108 VAL N N 108 120.940 121.194 -0.254 1
1 1255 . 1 1 1 A 109 109 ASP H H 109 7.840 7.765 0.075 1
1 1256 . 1 1 1 A 109 109 ASP HA H 109 4.110 4.193 -0.083 1
1 1259 . 1 1 1 A 109 109 ASP C C 109 178.190 178.526 -0.336 1
1 1260 . 1 1 1 A 109 109 ASP CA C 109 57.470 57.126 0.344 1
1 1261 . 1 1 1 A 109 109 ASP CB C 109 40.480 39.970 0.510 1
1 1262 . 1 1 1 A 109 109 ASP N N 109 118.780 121.202 -2.422 1
1 1263 . 1 1 1 A 110 110 ALA H H 110 7.520 7.613 -0.093 1
1 1264 . 1 1 1 A 110 110 ALA HA H 110 4.110 4.073 0.037 1
1 1268 . 1 1 1 A 110 110 ALA C C 110 180.550 179.873 0.677 1
1 1269 . 1 1 1 A 110 110 ALA CA C 110 54.880 55.073 -0.193 1
1 1270 . 1 1 1 A 110 110 ALA CB C 110 18.440 18.236 0.204 1
1 1271 . 1 1 1 A 110 110 ALA N N 110 120.640 122.923 -2.283 1
1 1272 . 1 1 1 A 111 111 ILE H H 111 7.840 7.557 0.283 1
1 1273 . 1 1 1 A 111 111 ILE HA H 111 3.580 3.442 0.138 1
1 1281 . 1 1 1 A 111 111 ILE C C 111 177.470 178.122 -0.652 1
1 1282 . 1 1 1 A 111 111 ILE CA C 111 64.620 64.904 -0.284 1
1 1283 . 1 1 1 A 111 111 ILE CB C 111 38.600 37.696 0.904 1
1 1286 . 1 1 1 A 111 111 ILE N N 111 119.840 119.100 0.740 1
1 1287 . 1 1 1 A 112 112 MET H H 112 8.100 7.832 0.268 1
1 1288 . 1 1 1 A 112 112 MET HA H 112 4.400 4.404 -0.004 1
1 1296 . 1 1 1 A 112 112 MET C C 112 177.710 178.845 -1.135 1
1 1297 . 1 1 1 A 112 112 MET CA C 112 55.300 58.467 -3.167 1
1 1298 . 1 1 1 A 112 112 MET CB C 112 30.510 32.176 -1.666 1
1 1301 . 1 1 1 A 112 112 MET N N 112 115.180 118.544 -3.364 1
1 1302 . 1 1 1 A 113 113 ASN H H 113 8.070 8.240 -0.170 1
1 1303 . 1 1 1 A 113 113 ASN HA H 113 4.570 4.492 0.078 1
1 1308 . 1 1 1 A 113 113 ASN C C 113 175.530 178.467 -2.937 1
1 1309 . 1 1 1 A 113 113 ASN CA C 113 54.420 56.429 -2.009 1
1 1310 . 1 1 1 A 113 113 ASN CB C 113 38.350 37.852 0.498 1
1 1311 . 1 1 1 A 113 113 ASN N N 113 117.190 117.368 -0.178 1
1 1313 . 1 1 1 A 114 114 ARG H H 114 8.070 7.855 0.215 1
1 1314 . 1 1 1 A 114 114 ARG HA H 114 4.280 4.188 0.092 1
1 1321 . 1 1 1 A 114 114 ARG C C 114 176.620 179.152 -2.532 1
1 1322 . 1 1 1 A 114 114 ARG CA C 114 56.910 59.022 -2.112 1
1 1323 . 1 1 1 A 114 114 ARG CB C 114 30.370 29.792 0.578 1
1 1326 . 1 1 1 A 114 114 ARG N N 114 118.360 120.027 -1.667 1
1 1327 . 1 1 1 A 115 115 LEU H H 115 8.100 7.979 0.121 1
1 1328 . 1 1 1 A 115 115 LEU HA H 115 4.310 4.244 0.066 1
1 1338 . 1 1 1 A 115 115 LEU C C 115 177.440 178.518 -1.078 1
1 1339 . 1 1 1 A 115 115 LEU CA C 115 55.440 57.758 -2.318 1
1 1340 . 1 1 1 A 115 115 LEU CB C 115 42.250 41.982 0.268 1
1 1344 . 1 1 1 A 115 115 LEU N N 115 120.580 121.294 -0.714 1
1 1345 . 1 1 1 A 116 116 GLN H H 116 8.180 7.965 0.215 1
1 1346 . 1 1 1 A 116 116 GLN HA H 116 4.360 4.074 0.286 1
1 1353 . 1 1 1 A 116 116 GLN C C 116 175.890 177.342 -1.452 1
1 1354 . 1 1 1 A 116 116 GLN CA C 116 55.810 58.975 -3.165 1
1 1355 . 1 1 1 A 116 116 GLN CB C 116 29.500 28.483 1.017 1
1 1357 . 1 1 1 A 116 116 GLN N N 116 119.770 118.399 1.371 1
1 1358 . 1 1 1 A 117 117 GLN H H 117 8.350 7.429 0.921 1
1 1359 . 1 1 1 A 117 117 GLN HA H 117 4.380 4.167 0.213 1
1 1366 . 1 1 1 A 117 117 GLN C C 117 176.130 175.187 0.943 1
1 1367 . 1 1 1 A 117 117 GLN CA C 117 55.810 56.633 -0.823 1
1 1368 . 1 1 1 A 117 117 GLN CB C 117 29.500 29.465 0.035 1
1 1370 . 1 1 1 A 117 117 GLN N N 117 121.440 119.634 1.806 1
1 1371 . 1 1 1 A 118 118 VAL H H 118 8.240 8.764 -0.524 1
1 1372 . 1 1 1 A 118 118 VAL HA H 118 4.120 4.752 -0.632 1
1 1380 . 1 1 1 A 118 118 VAL C C 118 176.650 174.766 1.884 1
1 1381 . 1 1 1 A 118 118 VAL CA C 118 62.720 59.324 3.396 1
1 1382 . 1 1 1 A 118 118 VAL CB C 118 32.730 35.031 -2.301 1
1 1385 . 1 1 1 A 118 118 VAL N N 118 121.250 120.426 0.824 1
1 1386 . 1 1 1 A 119 119 GLY H H 119 8.460 8.747 -0.287 1
1 1387 . 1 1 1 A 119 119 GLY HA2 H 119 3.990 3.897 0.093 1
1 1388 . 1 1 1 A 119 119 GLY HA3 H 119 3.990 3.905 0.085 1
1 1389 . 1 1 1 A 119 119 GLY C C 119 173.770 174.101 -0.331 1
1 1390 . 1 1 1 A 119 119 GLY CA C 119 45.260 47.084 -1.824 1
1 1391 . 1 1 1 A 119 119 GLY N N 119 112.300 109.829 2.471 1
1 1392 . 1 1 1 A 120 120 ASP H H 120 8.230 7.672 0.558 1
1 1393 . 1 1 1 A 120 120 ASP HA H 120 4.580 4.296 0.284 1
1 1396 . 1 1 1 A 120 120 ASP C C 120 175.180 176.266 -1.086 1
1 1397 . 1 1 1 A 120 120 ASP CA C 120 54.340 57.080 -2.740 1
1 1398 . 1 1 1 A 120 120 ASP CB C 120 41.390 40.814 0.576 1
1 1399 . 1 1 1 A 120 120 ASP N N 120 120.420 121.837 -1.417 1
1 1400 . 1 1 1 A 121 121 LYS H H 121 7.950 8.065 -0.115 1
1 1401 . 1 1 1 A 121 121 LYS HA H 121 4.240 4.700 -0.460 1
1 1402 . 1 1 1 A 121 121 LYS CA C 121 53.620 53.797 -0.177 1
1 1403 . 1 1 1 A 121 121 LYS N N 121 119.110 116.753 2.357 1
1 1404 . 1 1 1 A 122 122 PRO HA H 122 4.410 4.723 -0.313 1
1 1405 . 1 1 1 A 122 122 PRO C C 122 176.560 176.231 0.329 1
1 1406 . 1 1 1 A 122 122 PRO CA C 122 63.130 62.600 0.530 1
1 2 . 2 1 1 A 2 2 SER H H 2 7.890 7.848 0.042 1
1 3 . 2 1 1 A 2 2 SER HA H 2 4.270 5.039 -0.769 1
1 4 . 2 1 1 A 2 2 SER C C 2 173.960 172.691 1.269 1
1 5 . 2 1 1 A 2 2 SER CA C 2 60.800 56.256 4.544 1
1 6 . 2 1 1 A 2 2 SER N N 2 111.940 113.536 -1.596 1
1 7 . 2 1 1 A 3 3 GLU H H 3 8.010 8.717 -0.707 1
1 8 . 2 1 1 A 3 3 GLU HA H 3 4.360 4.986 -0.626 1
1 9 . 2 1 1 A 3 3 GLU C C 3 175.710 176.453 -0.743 1
1 10 . 2 1 1 A 3 3 GLU CA C 3 56.310 55.200 1.110 1
1 11 . 2 1 1 A 3 3 GLU N N 3 121.280 124.152 -2.872 1
1 12 . 2 1 1 A 4 4 ALA H H 4 8.540 8.682 -0.142 1
1 13 . 2 1 1 A 4 4 ALA HA H 4 4.560 4.408 0.152 1
1 14 . 2 1 1 A 4 4 ALA CA C 4 50.630 50.620 0.010 1
1 15 . 2 1 1 A 4 4 ALA N N 4 127.840 129.978 -2.138 1
1 16 . 2 1 1 A 5 5 PRO HA H 5 4.420 4.535 -0.115 1
1 17 . 2 1 1 A 5 5 PRO C C 5 174.240 176.208 -1.968 1
1 18 . 2 1 1 A 5 5 PRO CA C 5 62.840 63.929 -1.089 1
1 19 . 2 1 1 A 6 6 LYS H H 6 8.320 7.617 0.703 1
1 20 . 2 1 1 A 6 6 LYS HA H 6 4.290 4.397 -0.107 1
1 21 . 2 1 1 A 6 6 LYS C C 6 176.100 176.331 -0.231 1
1 22 . 2 1 1 A 6 6 LYS CA C 6 55.540 55.334 0.206 1
1 23 . 2 1 1 A 6 6 LYS N N 6 121.910 119.979 1.931 1
1 24 . 2 1 1 A 7 7 LYS H H 7 8.450 8.802 -0.352 1
1 25 . 2 1 1 A 7 7 LYS HA H 7 3.940 3.672 0.268 1
1 26 . 2 1 1 A 7 7 LYS C C 7 175.700 175.611 0.089 1
1 27 . 2 1 1 A 7 7 LYS CA C 7 56.440 57.122 -0.682 1
1 28 . 2 1 1 A 7 7 LYS N N 7 122.250 117.702 4.548 1
1 29 . 2 1 1 A 8 8 ARG H H 8 8.210 7.969 0.241 1
1 30 . 2 1 1 A 8 8 ARG HA H 8 4.670 4.137 0.533 1
1 31 . 2 1 1 A 8 8 ARG C C 8 173.760 175.924 -2.164 1
1 32 . 2 1 1 A 8 8 ARG CA C 8 53.420 56.099 -2.679 1
1 33 . 2 1 1 A 8 8 ARG N N 8 122.560 118.561 3.999 1
1 34 . 2 1 1 A 9 9 TRP H H 9 8.610 8.463 0.147 1
1 35 . 2 1 1 A 9 9 TRP HA H 9 4.910 4.886 0.024 1
1 44 . 2 1 1 A 9 9 TRP C C 9 174.610 175.841 -1.231 1
1 45 . 2 1 1 A 9 9 TRP CA C 9 57.630 57.410 0.220 1
1 46 . 2 1 1 A 9 9 TRP CB C 9 31.020 30.903 0.117 1
1 52 . 2 1 1 A 9 9 TRP N N 9 120.540 121.941 -1.401 1
1 54 . 2 1 1 A 10 10 TYR H H 10 9.260 9.013 0.247 1
1 55 . 2 1 1 A 10 10 TYR HA H 10 4.820 5.072 -0.252 1
1 62 . 2 1 1 A 10 10 TYR C C 10 174.340 175.269 -0.929 1
1 63 . 2 1 1 A 10 10 TYR CA C 10 57.050 56.357 0.693 1
1 64 . 2 1 1 A 10 10 TYR CB C 10 41.920 41.759 0.161 1
1 69 . 2 1 1 A 10 10 TYR N N 10 118.990 121.120 -2.130 1
1 70 . 2 1 1 A 11 11 VAL H H 11 9.450 8.740 0.710 1
1 71 . 2 1 1 A 11 11 VAL HA H 11 4.470 4.699 -0.229 1
1 79 . 2 1 1 A 11 11 VAL C C 11 175.030 175.505 -0.475 1
1 80 . 2 1 1 A 11 11 VAL CA C 11 62.320 62.226 0.094 1
1 81 . 2 1 1 A 11 11 VAL CB C 11 32.400 32.084 0.316 1
1 84 . 2 1 1 A 11 11 VAL N N 11 120.930 124.152 -3.222 1
1 85 . 2 1 1 A 12 12 VAL H H 12 9.320 9.249 0.071 1
1 86 . 2 1 1 A 12 12 VAL HA H 12 3.940 4.294 -0.354 1
1 94 . 2 1 1 A 12 12 VAL C C 12 173.870 174.785 -0.915 1
1 95 . 2 1 1 A 12 12 VAL CA C 12 61.330 60.760 0.570 1
1 96 . 2 1 1 A 12 12 VAL CB C 12 33.500 35.112 -1.612 1
1 99 . 2 1 1 A 12 12 VAL N N 12 128.860 127.095 1.765 1
1 100 . 2 1 1 A 13 13 GLN H H 13 8.830 8.173 0.657 1
1 101 . 2 1 1 A 13 13 GLN HA H 13 4.710 4.851 -0.141 1
1 108 . 2 1 1 A 13 13 GLN C C 13 174.230 175.302 -1.072 1
1 109 . 2 1 1 A 13 13 GLN CA C 13 54.800 55.921 -1.121 1
1 110 . 2 1 1 A 13 13 GLN CB C 13 29.450 29.387 0.063 1
1 111 . 2 1 1 A 13 13 GLN N N 13 126.050 126.366 -0.316 1
1 113 . 2 1 1 A 14 14 ALA H H 14 9.420 8.429 0.991 1
1 114 . 2 1 1 A 14 14 ALA HA H 14 5.150 4.605 0.545 1
1 118 . 2 1 1 A 14 14 ALA C C 14 176.400 176.128 0.272 1
1 119 . 2 1 1 A 14 14 ALA CA C 14 49.660 51.226 -1.566 1
1 120 . 2 1 1 A 14 14 ALA CB C 14 22.840 22.705 0.135 1
1 121 . 2 1 1 A 14 14 ALA N N 14 131.620 123.099 8.521 1
1 122 . 2 1 1 A 15 15 PHE H H 15 8.070 8.657 -0.587 1
1 123 . 2 1 1 A 15 15 PHE HA H 15 4.410 4.651 -0.241 1
1 128 . 2 1 1 A 15 15 PHE C C 15 176.130 175.964 0.166 1
1 129 . 2 1 1 A 15 15 PHE CA C 15 58.550 58.939 -0.389 1
1 130 . 2 1 1 A 15 15 PHE CB C 15 39.780 39.694 0.086 1
1 133 . 2 1 1 A 15 15 PHE N N 15 119.680 119.478 0.202 1
1 134 . 2 1 1 A 16 16 SER H H 16 8.370 8.854 -0.484 1
1 135 . 2 1 1 A 16 16 SER HA H 16 4.140 4.513 -0.373 1
1 138 . 2 1 1 A 16 16 SER C C 16 175.820 174.959 0.861 1
1 139 . 2 1 1 A 16 16 SER CA C 16 60.570 59.246 1.324 1
1 140 . 2 1 1 A 16 16 SER CB C 16 63.030 63.497 -0.467 1
1 141 . 2 1 1 A 16 16 SER N N 16 119.700 117.361 2.339 1
1 142 . 2 1 1 A 17 17 GLY H H 17 9.130 8.768 0.362 1
1 143 . 2 1 1 A 17 17 GLY HA2 H 17 3.640 3.683 -0.043 1
1 144 . 2 1 1 A 17 17 GLY HA3 H 17 4.200 3.799 0.401 1
1 145 . 2 1 1 A 17 17 GLY C C 17 175.520 174.603 0.917 1
1 146 . 2 1 1 A 17 17 GLY CA C 17 45.260 45.371 -0.111 1
1 147 . 2 1 1 A 17 17 GLY N N 17 115.850 112.298 3.552 1
1 148 . 2 1 1 A 18 18 PHE H H 18 8.480 7.667 0.813 1
1 149 . 2 1 1 A 18 18 PHE HA H 18 4.740 4.654 0.086 1
1 154 . 2 1 1 A 18 18 PHE C C 18 175.430 176.267 -0.837 1
1 155 . 2 1 1 A 18 18 PHE CA C 18 58.240 57.770 0.470 1
1 156 . 2 1 1 A 18 18 PHE CB C 18 39.010 38.741 0.269 1
1 159 . 2 1 1 A 18 18 PHE N N 18 118.550 119.760 -1.210 1
1 160 . 2 1 1 A 19 19 GLU H H 19 10.690 8.332 2.358 1
1 161 . 2 1 1 A 19 19 GLU HA H 19 3.490 4.063 -0.573 1
1 166 . 2 1 1 A 19 19 GLU C C 19 177.650 179.194 -1.544 1
1 167 . 2 1 1 A 19 19 GLU CA C 19 62.280 59.770 2.510 1
1 168 . 2 1 1 A 19 19 GLU CB C 19 28.380 29.358 -0.978 1
1 170 . 2 1 1 A 19 19 GLU N N 19 123.470 123.378 0.092 1
1 171 . 2 1 1 A 20 20 GLY H H 20 8.740 8.335 0.405 1
1 172 . 2 1 1 A 20 20 GLY HA2 H 20 3.840 3.923 -0.083 1
1 173 . 2 1 1 A 20 20 GLY HA3 H 20 3.940 3.932 0.008 1
1 174 . 2 1 1 A 20 20 GLY C C 20 176.860 175.684 1.176 1
1 175 . 2 1 1 A 20 20 GLY CA C 20 47.140 47.139 0.001 1
1 176 . 2 1 1 A 20 20 GLY N N 20 105.480 108.005 -2.525 1
1 177 . 2 1 1 A 21 21 ARG H H 21 7.690 8.229 -0.539 1
1 178 . 2 1 1 A 21 21 ARG HA H 21 4.180 4.153 0.027 1
1 185 . 2 1 1 A 21 21 ARG C C 21 179.490 178.315 1.175 1
1 186 . 2 1 1 A 21 21 ARG CA C 21 58.660 58.899 -0.239 1
1 187 . 2 1 1 A 21 21 ARG CB C 21 30.100 29.603 0.497 1
1 190 . 2 1 1 A 21 21 ARG N N 21 123.120 121.837 1.283 1
1 191 . 2 1 1 A 22 22 VAL H H 22 8.980 8.433 0.547 1
1 192 . 2 1 1 A 22 22 VAL HA H 22 3.560 3.702 -0.142 1
1 200 . 2 1 1 A 22 22 VAL C C 22 177.320 178.327 -1.007 1
1 201 . 2 1 1 A 22 22 VAL CA C 22 66.960 66.133 0.827 1
1 202 . 2 1 1 A 22 22 VAL CB C 22 31.050 31.424 -0.374 1
1 205 . 2 1 1 A 22 22 VAL N N 22 122.760 119.403 3.357 1
1 206 . 2 1 1 A 23 23 ALA H H 23 8.280 7.780 0.500 1
1 207 . 2 1 1 A 23 23 ALA HA H 23 3.850 4.072 -0.222 1
1 211 . 2 1 1 A 23 23 ALA C C 23 179.340 179.853 -0.513 1
1 212 . 2 1 1 A 23 23 ALA CA C 23 56.260 55.314 0.946 1
1 213 . 2 1 1 A 23 23 ALA CB C 23 18.260 18.358 -0.098 1
1 214 . 2 1 1 A 23 23 ALA N N 23 122.120 121.588 0.532 1
1 215 . 2 1 1 A 24 24 THR H H 24 8.020 7.338 0.682 1
1 216 . 2 1 1 A 24 24 THR HA H 24 3.920 3.933 -0.013 1
1 221 . 2 1 1 A 24 24 THR C C 24 176.940 176.089 0.851 1
1 222 . 2 1 1 A 24 24 THR CA C 24 66.820 66.074 0.746 1
1 223 . 2 1 1 A 24 24 THR CB C 24 68.930 68.551 0.379 1
1 225 . 2 1 1 A 24 24 THR N N 24 113.410 115.005 -1.595 1
1 226 . 2 1 1 A 25 25 SER H H 25 8.570 8.285 0.285 1
1 227 . 2 1 1 A 25 25 SER HA H 25 4.400 4.037 0.363 1
1 230 . 2 1 1 A 25 25 SER C C 25 177.610 176.169 1.441 1
1 231 . 2 1 1 A 25 25 SER CA C 25 61.920 62.410 -0.490 1
1 232 . 2 1 1 A 25 25 SER CB C 25 63.540 62.785 0.755 1
1 233 . 2 1 1 A 25 25 SER N N 25 118.260 117.826 0.434 1
1 234 . 2 1 1 A 26 26 LEU H H 26 9.430 8.171 1.259 1
1 235 . 2 1 1 A 26 26 LEU HA H 26 3.900 4.190 -0.290 1
1 245 . 2 1 1 A 26 26 LEU C C 26 177.710 178.361 -0.651 1
1 246 . 2 1 1 A 26 26 LEU CA C 26 58.910 57.928 0.982 1
1 247 . 2 1 1 A 26 26 LEU CB C 26 41.300 41.736 -0.436 1
1 251 . 2 1 1 A 26 26 LEU N N 26 124.120 122.851 1.269 1
1 252 . 2 1 1 A 27 27 ARG H H 27 7.790 7.754 0.036 1
1 253 . 2 1 1 A 27 27 ARG HA H 27 3.880 3.799 0.081 1
1 260 . 2 1 1 A 27 27 ARG C C 27 179.380 178.534 0.846 1
1 261 . 2 1 1 A 27 27 ARG CA C 27 60.510 59.764 0.746 1
1 262 . 2 1 1 A 27 27 ARG CB C 27 29.670 29.966 -0.296 1
1 265 . 2 1 1 A 27 27 ARG N N 27 116.710 119.528 -2.818 1
1 266 . 2 1 1 A 28 28 GLU H H 28 7.900 7.856 0.044 1
1 267 . 2 1 1 A 28 28 GLU HA H 28 4.070 3.897 0.173 1
1 272 . 2 1 1 A 28 28 GLU C C 28 179.450 179.328 0.122 1
1 273 . 2 1 1 A 28 28 GLU CA C 28 59.450 59.391 0.059 1
1 274 . 2 1 1 A 28 28 GLU CB C 28 29.610 29.159 0.451 1
1 276 . 2 1 1 A 28 28 GLU N N 28 118.340 117.507 0.833 1
1 277 . 2 1 1 A 29 29 HIS H H 29 8.940 7.414 1.526 1
1 278 . 2 1 1 A 29 29 HIS HA H 29 4.160 4.453 -0.293 1
1 283 . 2 1 1 A 29 29 HIS C C 29 177.750 178.044 -0.294 1
1 284 . 2 1 1 A 29 29 HIS CA C 29 61.260 59.802 1.458 1
1 285 . 2 1 1 A 29 29 HIS CB C 29 29.870 29.567 0.303 1
1 287 . 2 1 1 A 29 29 HIS N N 29 120.440 118.520 1.920 1
1 288 . 2 1 1 A 30 30 ILE H H 30 8.580 7.974 0.606 1
1 289 . 2 1 1 A 30 30 ILE HA H 30 3.160 3.615 -0.455 1
1 299 . 2 1 1 A 30 30 ILE C C 30 177.230 177.847 -0.617 1
1 300 . 2 1 1 A 30 30 ILE CA C 30 66.460 64.735 1.725 1
1 301 . 2 1 1 A 30 30 ILE CB C 30 38.630 37.602 1.028 1
1 305 . 2 1 1 A 30 30 ILE N N 30 121.010 120.572 0.438 1
1 306 . 2 1 1 A 31 31 LYS H H 31 7.020 7.740 -0.720 1
1 307 . 2 1 1 A 31 31 LYS HA H 31 4.170 3.982 0.188 1
1 316 . 2 1 1 A 31 31 LYS C C 31 180.570 178.899 1.671 1
1 317 . 2 1 1 A 31 31 LYS CA C 31 58.920 59.979 -1.059 1
1 318 . 2 1 1 A 31 31 LYS CB C 31 32.490 32.253 0.237 1
1 322 . 2 1 1 A 31 31 LYS N N 31 117.400 119.147 -1.747 1
1 323 . 2 1 1 A 32 32 LEU H H 32 8.400 8.410 -0.010 1
1 324 . 2 1 1 A 32 32 LEU HA H 32 3.990 3.867 0.123 1
1 334 . 2 1 1 A 32 32 LEU C C 32 178.230 178.320 -0.090 1
1 335 . 2 1 1 A 32 32 LEU CA C 32 57.700 57.941 -0.241 1
1 336 . 2 1 1 A 32 32 LEU CB C 32 42.540 41.803 0.737 1
1 340 . 2 1 1 A 32 32 LEU N N 32 121.180 120.001 1.179 1
1 341 . 2 1 1 A 33 33 HIS H H 33 7.620 7.703 -0.083 1
1 342 . 2 1 1 A 33 33 HIS HA H 33 4.600 4.661 -0.061 1
1 347 . 2 1 1 A 33 33 HIS C C 33 177.090 174.098 2.992 1
1 348 . 2 1 1 A 33 33 HIS CA C 33 55.840 55.501 0.339 1
1 349 . 2 1 1 A 33 33 HIS CB C 33 29.330 30.120 -0.790 1
1 351 . 2 1 1 A 33 33 HIS N N 33 112.220 115.206 -2.986 1
1 352 . 2 1 1 A 34 34 ASN H H 34 8.030 7.902 0.128 1
1 353 . 2 1 1 A 34 34 ASN HA H 34 4.890 4.319 0.571 1
1 358 . 2 1 1 A 34 34 ASN C C 34 175.910 175.518 0.392 1
1 359 . 2 1 1 A 34 34 ASN CA C 34 54.530 54.420 0.110 1
1 360 . 2 1 1 A 34 34 ASN CB C 34 37.380 36.770 0.610 1
1 361 . 2 1 1 A 34 34 ASN N N 34 117.600 114.570 3.030 1
1 363 . 2 1 1 A 35 35 MET H H 35 8.330 8.731 -0.401 1
1 364 . 2 1 1 A 35 35 MET HA H 35 4.940 4.861 0.079 1
1 372 . 2 1 1 A 35 35 MET C C 35 176.880 176.787 0.093 1
1 373 . 2 1 1 A 35 35 MET CA C 35 55.600 54.554 1.046 1
1 374 . 2 1 1 A 35 35 MET CB C 35 33.790 32.860 0.930 1
1 377 . 2 1 1 A 35 35 MET N N 35 116.190 116.252 -0.062 1
1 378 . 2 1 1 A 36 36 GLU H H 36 9.730 8.194 1.536 1
1 379 . 2 1 1 A 36 36 GLU HA H 36 3.850 4.115 -0.265 1
1 384 . 2 1 1 A 36 36 GLU C C 36 178.290 179.304 -1.014 1
1 385 . 2 1 1 A 36 36 GLU CA C 36 61.280 59.616 1.664 1
1 386 . 2 1 1 A 36 36 GLU CB C 36 29.270 29.274 -0.004 1
1 388 . 2 1 1 A 36 36 GLU N N 36 121.630 120.597 1.033 1
1 389 . 2 1 1 A 37 37 ASP H H 37 8.850 8.087 0.763 1
1 390 . 2 1 1 A 37 37 ASP HA H 37 4.470 4.503 -0.033 1
1 393 . 2 1 1 A 37 37 ASP C C 37 177.190 178.940 -1.750 1
1 394 . 2 1 1 A 37 37 ASP CA C 37 56.140 57.400 -1.260 1
1 395 . 2 1 1 A 37 37 ASP CB C 37 40.050 40.437 -0.387 1
1 396 . 2 1 1 A 37 37 ASP N N 37 114.390 120.507 -6.117 1
1 397 . 2 1 1 A 38 38 LEU H H 38 7.880 7.744 0.136 1
1 398 . 2 1 1 A 38 38 LEU HA H 38 4.290 4.050 0.240 1
1 408 . 2 1 1 A 38 38 LEU C C 38 175.090 177.636 -2.546 1
1 409 . 2 1 1 A 38 38 LEU CA C 38 54.670 57.904 -3.234 1
1 410 . 2 1 1 A 38 38 LEU CB C 38 42.940 42.137 0.803 1
1 414 . 2 1 1 A 38 38 LEU N N 38 116.550 119.318 -2.768 1
1 415 . 2 1 1 A 39 39 PHE H H 39 7.500 7.688 -0.188 1
1 416 . 2 1 1 A 39 39 PHE HA H 39 4.970 4.655 0.315 1
1 424 . 2 1 1 A 39 39 PHE C C 39 175.380 175.763 -0.383 1
1 425 . 2 1 1 A 39 39 PHE CA C 39 57.580 58.644 -1.064 1
1 426 . 2 1 1 A 39 39 PHE CB C 39 44.990 39.160 5.830 1
1 432 . 2 1 1 A 39 39 PHE N N 39 115.370 116.891 -1.521 1
1 433 . 2 1 1 A 40 40 GLY H H 40 8.680 9.281 -0.601 1
1 434 . 2 1 1 A 40 40 GLY HA2 H 40 3.370 3.932 -0.562 1
1 435 . 2 1 1 A 40 40 GLY HA3 H 40 4.550 4.018 0.532 1
1 436 . 2 1 1 A 40 40 GLY C C 40 173.090 173.703 -0.613 1
1 437 . 2 1 1 A 40 40 GLY CA C 40 44.180 46.475 -2.295 1
1 438 . 2 1 1 A 40 40 GLY N N 40 110.930 111.594 -0.664 1
1 439 . 2 1 1 A 41 41 GLU H H 41 8.320 7.679 0.641 1
1 440 . 2 1 1 A 41 41 GLU HA H 41 4.280 4.923 -0.643 1
1 445 . 2 1 1 A 41 41 GLU C C 41 173.900 175.088 -1.188 1
1 446 . 2 1 1 A 41 41 GLU CA C 41 56.900 54.637 2.263 1
1 447 . 2 1 1 A 41 41 GLU CB C 41 32.110 34.313 -2.203 1
1 449 . 2 1 1 A 41 41 GLU N N 41 126.730 117.236 9.494 1
1 450 . 2 1 1 A 42 42 VAL H H 42 8.100 8.697 -0.597 1
1 451 . 2 1 1 A 42 42 VAL HA H 42 5.160 5.153 0.007 1
1 459 . 2 1 1 A 42 42 VAL C C 42 176.340 175.106 1.234 1
1 460 . 2 1 1 A 42 42 VAL CA C 42 61.200 61.178 0.022 1
1 461 . 2 1 1 A 42 42 VAL CB C 42 34.770 34.725 0.045 1
1 464 . 2 1 1 A 42 42 VAL N N 42 119.360 121.699 -2.339 1
1 465 . 2 1 1 A 43 43 MET H H 43 9.870 9.042 0.828 1
1 466 . 2 1 1 A 43 43 MET HA H 43 5.070 5.152 -0.082 1
1 474 . 2 1 1 A 43 43 MET C C 43 173.890 175.297 -1.407 1
1 475 . 2 1 1 A 43 43 MET CA C 43 54.740 54.319 0.421 1
1 476 . 2 1 1 A 43 43 MET CB C 43 37.500 36.732 0.768 1
1 479 . 2 1 1 A 43 43 MET N N 43 125.720 124.799 0.921 1
1 480 . 2 1 1 A 44 44 VAL H H 44 8.800 8.981 -0.181 1
1 481 . 2 1 1 A 44 44 VAL HA H 44 4.720 4.835 -0.115 1
1 489 . 2 1 1 A 44 44 VAL CA C 44 59.090 59.066 0.024 1
1 490 . 2 1 1 A 44 44 VAL CB C 44 33.710 32.702 1.008 1
1 493 . 2 1 1 A 44 44 VAL N N 44 122.340 123.368 -1.028 1
1 494 . 2 1 1 A 45 45 PRO HA H 45 4.480 4.622 -0.142 1
1 501 . 2 1 1 A 45 45 PRO C C 45 177.080 174.815 2.265 1
1 502 . 2 1 1 A 45 45 PRO CA C 45 63.240 62.480 0.760 1
1 503 . 2 1 1 A 45 45 PRO CB C 45 32.170 28.891 3.279 1
1 506 . 2 1 1 A 46 46 THR H H 46 8.200 8.555 -0.355 1
1 507 . 2 1 1 A 46 46 THR HA H 46 4.290 5.111 -0.821 1
1 512 . 2 1 1 A 46 46 THR C C 46 174.600 174.850 -0.250 1
1 513 . 2 1 1 A 46 46 THR CA C 46 62.100 59.523 2.577 1
1 514 . 2 1 1 A 46 46 THR CB C 46 69.990 72.610 -2.620 1
1 516 . 2 1 1 A 46 46 THR N N 46 113.410 112.305 1.105 1
1 517 . 2 1 1 A 47 47 GLU H H 47 8.380 9.270 -0.890 1
1 518 . 2 1 1 A 47 47 GLU HA H 47 4.400 4.082 0.318 1
1 521 . 2 1 1 A 47 47 GLU C C 47 175.970 178.650 -2.680 1
1 522 . 2 1 1 A 47 47 GLU CA C 47 55.200 59.233 -4.033 1
1 523 . 2 1 1 A 47 47 GLU CB C 47 32.300 29.329 2.971 1
1 524 . 2 1 1 A 47 47 GLU N N 47 122.830 121.686 1.144 1
1 525 . 2 1 1 A 48 48 GLU H H 48 8.400 7.863 0.537 1
1 526 . 2 1 1 A 48 48 GLU HA H 48 4.280 4.116 0.164 1
1 531 . 2 1 1 A 48 48 GLU C C 48 175.750 176.092 -0.342 1
1 532 . 2 1 1 A 48 48 GLU CA C 48 55.190 58.901 -3.711 1
1 533 . 2 1 1 A 48 48 GLU CB C 48 31.980 29.862 2.118 1
1 535 . 2 1 1 A 48 48 GLU N N 48 121.950 119.490 2.460 1
1 536 . 2 1 1 A 49 49 VAL H H 49 8.240 7.654 0.586 1
1 537 . 2 1 1 A 49 49 VAL HA H 49 4.170 4.750 -0.580 1
1 542 . 2 1 1 A 49 49 VAL C C 49 174.610 174.353 0.257 1
1 543 . 2 1 1 A 49 49 VAL CA C 49 62.280 59.930 2.350 1
1 544 . 2 1 1 A 49 49 VAL CB C 49 32.930 35.358 -2.428 1
1 546 . 2 1 1 A 49 49 VAL N N 49 123.990 117.929 6.061 1
1 547 . 2 1 1 A 50 50 VAL H H 50 8.230 8.526 -0.296 1
1 548 . 2 1 1 A 50 50 VAL HA H 50 4.220 4.654 -0.434 1
1 553 . 2 1 1 A 50 50 VAL C C 50 175.770 176.211 -0.441 1
1 554 . 2 1 1 A 50 50 VAL CA C 50 62.170 58.828 3.342 1
1 555 . 2 1 1 A 50 50 VAL CB C 50 33.110 35.138 -2.028 1
1 557 . 2 1 1 A 50 50 VAL N N 50 123.960 123.245 0.715 1
1 558 . 2 1 1 A 51 51 GLU H H 51 8.570 8.861 -0.291 1
1 559 . 2 1 1 A 51 51 GLU HA H 51 4.380 4.009 0.371 1
1 564 . 2 1 1 A 51 51 GLU C C 51 175.920 176.154 -0.234 1
1 565 . 2 1 1 A 51 51 GLU CA C 51 56.050 59.700 -3.650 1
1 566 . 2 1 1 A 51 51 GLU CB C 51 31.080 29.794 1.286 1
1 568 . 2 1 1 A 51 51 GLU N N 51 125.070 121.889 3.181 1
1 569 . 2 1 1 A 52 52 ILE H H 52 8.320 7.834 0.486 1
1 570 . 2 1 1 A 52 52 ILE HA H 52 4.290 4.501 -0.211 1
1 580 . 2 1 1 A 52 52 ILE C C 52 176.330 174.528 1.802 1
1 581 . 2 1 1 A 52 52 ILE CA C 52 60.940 60.382 0.558 1
1 582 . 2 1 1 A 52 52 ILE CB C 52 38.510 39.970 -1.460 1
1 586 . 2 1 1 A 52 52 ILE N N 52 122.760 118.843 3.917 1
1 587 . 2 1 1 A 53 53 ARG H H 53 8.500 8.719 -0.219 1
1 588 . 2 1 1 A 53 53 ARG HA H 53 4.430 4.214 0.216 1
1 595 . 2 1 1 A 53 53 ARG C C 53 176.950 178.119 -1.169 1
1 596 . 2 1 1 A 53 53 ARG CA C 53 56.150 56.983 -0.833 1
1 597 . 2 1 1 A 53 53 ARG CB C 53 30.200 30.691 -0.491 1
1 600 . 2 1 1 A 53 53 ARG N N 53 125.250 129.808 -4.558 1
1 601 . 2 1 1 A 54 54 GLY H H 54 8.760 8.734 0.026 1
1 602 . 2 1 1 A 54 54 GLY HA2 H 54 3.920 3.832 0.088 1
1 603 . 2 1 1 A 54 54 GLY HA3 H 54 4.010 3.832 0.178 1
1 604 . 2 1 1 A 54 54 GLY C C 54 175.110 174.313 0.797 1
1 605 . 2 1 1 A 54 54 GLY CA C 54 46.030 46.320 -0.290 1
1 606 . 2 1 1 A 54 54 GLY N N 54 112.510 111.376 1.134 1
1 607 . 2 1 1 A 55 55 GLY H H 55 8.350 7.732 0.618 1
1 608 . 2 1 1 A 55 55 GLY HA2 H 55 3.980 4.015 -0.035 1
1 609 . 2 1 1 A 55 55 GLY HA3 H 55 3.980 4.015 -0.035 1
1 610 . 2 1 1 A 55 55 GLY C C 55 173.920 174.914 -0.994 1
1 611 . 2 1 1 A 55 55 GLY CA C 55 45.200 45.900 -0.700 1
1 612 . 2 1 1 A 55 55 GLY N N 55 107.940 106.777 1.163 1
1 613 . 2 1 1 A 56 56 GLN H H 56 8.100 8.619 -0.519 1
1 614 . 2 1 1 A 56 56 GLN HA H 56 4.420 4.068 0.352 1
1 619 . 2 1 1 A 56 56 GLN C C 56 175.570 175.560 0.010 1
1 620 . 2 1 1 A 56 56 GLN CA C 56 55.420 58.262 -2.842 1
1 621 . 2 1 1 A 56 56 GLN CB C 56 30.100 28.743 1.357 1
1 623 . 2 1 1 A 56 56 GLN N N 56 119.350 126.303 -6.953 1
1 624 . 2 1 1 A 57 57 ARG H H 57 8.520 7.795 0.725 1
1 625 . 2 1 1 A 57 57 ARG HA H 57 4.400 4.024 0.376 1
1 632 . 2 1 1 A 57 57 ARG C C 57 176.210 175.962 0.248 1
1 633 . 2 1 1 A 57 57 ARG CA C 57 56.440 57.111 -0.671 1
1 634 . 2 1 1 A 57 57 ARG CB C 57 30.930 27.072 3.858 1
1 637 . 2 1 1 A 57 57 ARG N N 57 122.610 117.390 5.220 1
1 638 . 2 1 1 A 58 58 ARG H H 58 8.630 7.925 0.705 1
1 639 . 2 1 1 A 58 58 ARG HA H 58 4.430 4.148 0.282 1
1 646 . 2 1 1 A 58 58 ARG C C 58 175.950 176.636 -0.686 1
1 647 . 2 1 1 A 58 58 ARG CA C 58 55.450 59.035 -3.585 1
1 648 . 2 1 1 A 58 58 ARG CB C 58 31.300 30.176 1.124 1
1 651 . 2 1 1 A 58 58 ARG N N 58 123.320 118.111 5.209 1
1 652 . 2 1 1 A 59 59 LYS H H 59 8.560 7.544 1.016 1
1 653 . 2 1 1 A 59 59 LYS HA H 59 4.410 4.244 0.166 1
1 662 . 2 1 1 A 59 59 LYS C C 59 176.590 176.821 -0.231 1
1 663 . 2 1 1 A 59 59 LYS CA C 59 56.720 56.459 0.261 1
1 664 . 2 1 1 A 59 59 LYS CB C 59 33.150 33.071 0.079 1
1 668 . 2 1 1 A 59 59 LYS N N 59 123.380 121.806 1.574 1
1 669 . 2 1 1 A 60 60 SER H H 60 8.450 8.522 -0.072 1
1 670 . 2 1 1 A 60 60 SER HA H 60 4.480 4.467 0.013 1
1 673 . 2 1 1 A 60 60 SER C C 60 174.280 174.358 -0.078 1
1 674 . 2 1 1 A 60 60 SER CA C 60 58.140 58.975 -0.835 1
1 675 . 2 1 1 A 60 60 SER CB C 60 64.160 64.161 -0.001 1
1 676 . 2 1 1 A 60 60 SER N N 60 117.320 121.406 -4.086 1
1 677 . 2 1 1 A 61 61 GLU H H 61 8.550 8.762 -0.212 1
1 678 . 2 1 1 A 61 61 GLU HA H 61 4.400 5.126 -0.726 1
1 683 . 2 1 1 A 61 61 GLU C C 61 176.150 175.267 0.883 1
1 684 . 2 1 1 A 61 61 GLU CA C 61 56.300 54.800 1.500 1
1 685 . 2 1 1 A 61 61 GLU CB C 61 30.790 32.919 -2.129 1
1 687 . 2 1 1 A 61 61 GLU N N 61 122.810 122.788 0.022 1
1 688 . 2 1 1 A 62 62 ARG H H 62 8.310 9.579 -1.269 1
1 689 . 2 1 1 A 62 62 ARG HA H 62 4.340 5.082 -0.742 1
1 692 . 2 1 1 A 62 62 ARG C C 62 176.140 174.671 1.469 1
1 693 . 2 1 1 A 62 62 ARG CA C 62 56.230 54.436 1.794 1
1 694 . 2 1 1 A 62 62 ARG CB C 62 30.780 33.705 -2.925 1
1 695 . 2 1 1 A 62 62 ARG N N 62 122.080 122.287 -0.207 1
1 696 . 2 1 1 A 63 63 LYS H H 63 8.470 8.801 -0.331 1
1 697 . 2 1 1 A 63 63 LYS HA H 63 4.300 4.737 -0.437 1
1 700 . 2 1 1 A 63 63 LYS C C 63 175.490 176.897 -1.407 1
1 701 . 2 1 1 A 63 63 LYS CA C 63 56.200 55.297 0.903 1
1 702 . 2 1 1 A 63 63 LYS CB C 63 30.730 33.154 -2.424 1
1 703 . 2 1 1 A 63 63 LYS N N 63 123.450 122.289 1.161 1
1 704 . 2 1 1 A 64 64 PHE H H 64 8.200 8.962 -0.762 1
1 705 . 2 1 1 A 64 64 PHE HA H 64 4.450 3.803 0.647 1
1 710 . 2 1 1 A 64 64 PHE C C 64 174.250 175.404 -1.154 1
1 711 . 2 1 1 A 64 64 PHE CA C 64 57.430 61.306 -3.876 1
1 712 . 2 1 1 A 64 64 PHE CB C 64 40.330 39.048 1.282 1
1 715 . 2 1 1 A 64 64 PHE N N 64 121.740 125.749 -4.009 1
1 716 . 2 1 1 A 65 65 PHE H H 65 8.130 8.262 -0.132 1
1 717 . 2 1 1 A 65 65 PHE HA H 65 4.440 4.993 -0.553 1
1 725 . 2 1 1 A 65 65 PHE CA C 65 55.650 54.952 0.698 1
1 726 . 2 1 1 A 65 65 PHE CB C 65 38.900 39.319 -0.419 1
1 731 . 2 1 1 A 65 65 PHE N N 65 120.910 115.761 5.149 1
1 732 . 2 1 1 A 66 66 PRO C C 66 176.780 178.207 -1.427 1
1 733 . 2 1 1 A 67 67 GLY H H 67 9.970 8.531 1.439 1
1 734 . 2 1 1 A 67 67 GLY HA2 H 67 3.820 4.010 -0.190 1
1 735 . 2 1 1 A 67 67 GLY HA3 H 67 4.400 4.026 0.374 1
1 736 . 2 1 1 A 67 67 GLY C C 67 173.670 173.798 -0.128 1
1 737 . 2 1 1 A 67 67 GLY CA C 67 45.900 45.743 0.157 1
1 738 . 2 1 1 A 67 67 GLY N N 67 111.550 112.809 -1.259 1
1 739 . 2 1 1 A 68 68 TYR H H 68 7.650 7.868 -0.218 1
1 740 . 2 1 1 A 68 68 TYR HA H 68 5.000 4.932 0.068 1
1 747 . 2 1 1 A 68 68 TYR C C 68 175.220 174.806 0.414 1
1 748 . 2 1 1 A 68 68 TYR CA C 68 57.940 56.783 1.157 1
1 753 . 2 1 1 A 68 68 TYR N N 68 118.800 118.793 0.007 1
1 754 . 2 1 1 A 69 69 VAL H H 69 9.090 8.647 0.443 1
1 755 . 2 1 1 A 69 69 VAL HA H 69 4.330 4.701 -0.371 1
1 763 . 2 1 1 A 69 69 VAL C C 69 174.250 174.764 -0.514 1
1 764 . 2 1 1 A 69 69 VAL CA C 69 62.120 60.670 1.450 1
1 765 . 2 1 1 A 69 69 VAL CB C 69 35.240 36.082 -0.842 1
1 768 . 2 1 1 A 69 69 VAL N N 69 119.300 123.443 -4.143 1
1 769 . 2 1 1 A 70 70 LEU H H 70 9.190 8.920 0.270 1
1 770 . 2 1 1 A 70 70 LEU HA H 70 5.460 5.807 -0.347 1
1 780 . 2 1 1 A 70 70 LEU C C 70 176.130 176.241 -0.111 1
1 781 . 2 1 1 A 70 70 LEU CA C 70 54.120 53.533 0.587 1
1 782 . 2 1 1 A 70 70 LEU CB C 70 43.330 44.460 -1.130 1
1 786 . 2 1 1 A 70 70 LEU N N 70 126.710 126.877 -0.167 1
1 787 . 2 1 1 A 71 71 VAL H H 71 9.350 9.214 0.136 1
1 788 . 2 1 1 A 71 71 VAL HA H 71 5.040 4.906 0.134 1
1 796 . 2 1 1 A 71 71 VAL C C 71 173.670 175.256 -1.586 1
1 797 . 2 1 1 A 71 71 VAL CA C 71 61.090 61.681 -0.591 1
1 798 . 2 1 1 A 71 71 VAL CB C 71 35.800 35.196 0.604 1
1 801 . 2 1 1 A 71 71 VAL N N 71 121.920 123.201 -1.281 1
1 802 . 2 1 1 A 72 72 GLN H H 72 8.390 8.511 -0.121 1
1 803 . 2 1 1 A 72 72 GLN HA H 72 4.610 3.831 0.779 1
1 810 . 2 1 1 A 72 72 GLN C C 72 175.920 175.448 0.472 1
1 811 . 2 1 1 A 72 72 GLN CA C 72 53.810 56.549 -2.739 1
1 812 . 2 1 1 A 72 72 GLN CB C 72 28.850 28.446 0.404 1
1 814 . 2 1 1 A 72 72 GLN N N 72 130.760 127.270 3.490 1
1 816 . 2 1 1 A 73 73 MET H H 73 9.750 8.636 1.114 1
1 817 . 2 1 1 A 73 73 MET HA H 73 5.060 5.233 -0.173 1
1 825 . 2 1 1 A 73 73 MET C C 73 175.500 174.218 1.282 1
1 826 . 2 1 1 A 73 73 MET CA C 73 55.520 54.720 0.800 1
1 827 . 2 1 1 A 73 73 MET CB C 73 35.350 35.385 -0.035 1
1 830 . 2 1 1 A 73 73 MET N N 73 121.070 122.904 -1.834 1
1 831 . 2 1 1 A 74 74 VAL H H 74 8.530 8.581 -0.051 1
1 832 . 2 1 1 A 74 74 VAL HA H 74 3.970 4.364 -0.394 1
1 840 . 2 1 1 A 74 74 VAL C C 74 174.900 175.573 -0.673 1
1 841 . 2 1 1 A 74 74 VAL CA C 74 62.150 61.726 0.424 1
1 842 . 2 1 1 A 74 74 VAL CB C 74 32.480 33.132 -0.652 1
1 845 . 2 1 1 A 74 74 VAL N N 74 124.120 122.487 1.633 1
1 846 . 2 1 1 A 75 75 MET H H 75 8.600 8.505 0.095 1
1 847 . 2 1 1 A 75 75 MET HA H 75 4.360 4.670 -0.310 1
1 855 . 2 1 1 A 75 75 MET C C 75 173.480 175.502 -2.022 1
1 856 . 2 1 1 A 75 75 MET CA C 75 53.830 53.681 0.149 1
1 857 . 2 1 1 A 75 75 MET CB C 75 29.960 32.535 -2.575 1
1 860 . 2 1 1 A 75 75 MET N N 75 128.250 124.817 3.433 1
1 861 . 2 1 1 A 76 76 ASN H H 76 8.410 8.132 0.278 1
1 862 . 2 1 1 A 76 76 ASN HA H 76 4.540 5.086 -0.546 1
1 867 . 2 1 1 A 76 76 ASN C C 76 173.950 175.692 -1.742 1
1 868 . 2 1 1 A 76 76 ASN CA C 76 51.720 51.436 0.284 1
1 869 . 2 1 1 A 76 76 ASN CB C 76 38.430 41.019 -2.589 1
1 870 . 2 1 1 A 76 76 ASN N N 76 127.500 123.155 4.345 1
1 872 . 2 1 1 A 77 77 ASP H H 77 8.470 8.951 -0.481 1
1 873 . 2 1 1 A 77 77 ASP HA H 77 4.410 4.307 0.103 1
1 876 . 2 1 1 A 77 77 ASP C C 77 178.530 178.359 0.171 1
1 877 . 2 1 1 A 77 77 ASP CA C 77 58.730 56.815 1.915 1
1 878 . 2 1 1 A 77 77 ASP CB C 77 40.940 40.358 0.582 1
1 879 . 2 1 1 A 77 77 ASP N N 77 117.090 120.944 -3.854 1
1 880 . 2 1 1 A 78 78 ALA H H 78 8.160 8.062 0.098 1
1 881 . 2 1 1 A 78 78 ALA HA H 78 4.350 4.140 0.210 1
1 885 . 2 1 1 A 78 78 ALA C C 78 181.250 179.812 1.438 1
1 886 . 2 1 1 A 78 78 ALA CA C 78 55.190 55.159 0.031 1
1 887 . 2 1 1 A 78 78 ALA CB C 78 18.260 19.113 -0.853 1
1 888 . 2 1 1 A 78 78 ALA N N 78 122.500 123.248 -0.748 1
1 889 . 2 1 1 A 79 79 SER H H 79 9.320 8.839 0.481 1
1 890 . 2 1 1 A 79 79 SER HA H 79 4.290 4.265 0.025 1
1 893 . 2 1 1 A 79 79 SER C C 79 176.570 176.582 -0.012 1
1 894 . 2 1 1 A 79 79 SER CA C 79 61.080 61.322 -0.242 1
1 895 . 2 1 1 A 79 79 SER CB C 79 62.200 62.196 0.004 1
1 896 . 2 1 1 A 79 79 SER N N 79 119.280 112.347 6.933 1
1 897 . 2 1 1 A 80 80 TRP H H 80 8.900 8.278 0.622 1
1 898 . 2 1 1 A 80 80 TRP HA H 80 4.020 4.377 -0.357 1
1 907 . 2 1 1 A 80 80 TRP C C 80 178.210 177.838 0.372 1
1 908 . 2 1 1 A 80 80 TRP CA C 80 62.490 61.404 1.086 1
1 909 . 2 1 1 A 80 80 TRP CB C 80 29.800 29.787 0.013 1
1 915 . 2 1 1 A 80 80 TRP N N 80 125.870 124.141 1.729 1
1 917 . 2 1 1 A 81 81 HIS H H 81 8.190 8.076 0.114 1
1 918 . 2 1 1 A 81 81 HIS HA H 81 3.930 4.304 -0.374 1
1 923 . 2 1 1 A 81 81 HIS C C 81 177.740 176.453 1.287 1
1 924 . 2 1 1 A 81 81 HIS CA C 81 61.020 60.065 0.955 1
1 925 . 2 1 1 A 81 81 HIS CB C 81 28.910 29.485 -0.575 1
1 927 . 2 1 1 A 81 81 HIS N N 81 114.080 119.852 -5.772 1
1 928 . 2 1 1 A 82 82 LEU H H 82 8.080 8.242 -0.162 1
1 929 . 2 1 1 A 82 82 LEU HA H 82 3.900 3.549 0.351 1
1 939 . 2 1 1 A 82 82 LEU C C 82 180.330 178.401 1.929 1
1 940 . 2 1 1 A 82 82 LEU CA C 82 58.590 58.001 0.589 1
1 941 . 2 1 1 A 82 82 LEU CB C 82 41.350 41.405 -0.055 1
1 945 . 2 1 1 A 82 82 LEU N N 82 121.320 120.458 0.862 1
1 946 . 2 1 1 A 83 83 VAL H H 83 8.000 8.465 -0.465 1
1 947 . 2 1 1 A 83 83 VAL HA H 83 3.210 3.373 -0.163 1
1 955 . 2 1 1 A 83 83 VAL C C 83 177.060 177.973 -0.913 1
1 956 . 2 1 1 A 83 83 VAL CA C 83 67.430 66.700 0.730 1
1 957 . 2 1 1 A 83 83 VAL CB C 83 31.680 31.172 0.508 1
1 960 . 2 1 1 A 83 83 VAL N N 83 118.850 118.681 0.169 1
1 961 . 2 1 1 A 84 84 ARG H H 84 7.540 7.405 0.135 1
1 962 . 2 1 1 A 84 84 ARG HA H 84 3.590 3.701 -0.111 1
1 969 . 2 1 1 A 84 84 ARG C C 84 177.240 178.111 -0.871 1
1 970 . 2 1 1 A 84 84 ARG CA C 84 56.050 59.603 -3.553 1
1 971 . 2 1 1 A 84 84 ARG CB C 84 28.190 29.495 -1.305 1
1 974 . 2 1 1 A 84 84 ARG N N 84 111.460 120.482 -9.022 1
1 975 . 2 1 1 A 85 85 SER H H 85 7.530 7.323 0.207 1
1 976 . 2 1 1 A 85 85 SER HA H 85 4.280 4.054 0.226 1
1 979 . 2 1 1 A 85 85 SER C C 85 173.930 174.540 -0.610 1
1 980 . 2 1 1 A 85 85 SER CA C 85 59.220 61.051 -1.831 1
1 981 . 2 1 1 A 85 85 SER CB C 85 63.830 62.751 1.079 1
1 982 . 2 1 1 A 85 85 SER N N 85 113.660 114.147 -0.487 1
1 983 . 2 1 1 A 86 86 VAL H H 86 7.230 7.107 0.123 1
1 984 . 2 1 1 A 86 86 VAL HA H 86 3.480 4.017 -0.537 1
1 992 . 2 1 1 A 86 86 VAL CA C 86 61.300 61.208 0.092 1
1 993 . 2 1 1 A 86 86 VAL CB C 86 31.780 32.097 -0.317 1
1 996 . 2 1 1 A 86 86 VAL N N 86 128.120 121.807 6.313 1
1 997 . 2 1 1 A 87 87 PRO HA H 87 4.140 4.391 -0.251 1
1 1004 . 2 1 1 A 87 87 PRO C C 87 176.400 176.795 -0.395 1
1 1005 . 2 1 1 A 87 87 PRO CA C 87 64.100 63.530 0.570 1
1 1006 . 2 1 1 A 87 87 PRO CB C 87 31.710 32.319 -0.609 1
1 1009 . 2 1 1 A 88 88 ARG H H 88 8.320 8.787 -0.467 1
1 1010 . 2 1 1 A 88 88 ARG HA H 88 3.030 4.179 -1.149 1
1 1017 . 2 1 1 A 88 88 ARG C C 88 174.630 174.893 -0.263 1
1 1018 . 2 1 1 A 88 88 ARG CA C 88 57.620 57.471 0.149 1
1 1019 . 2 1 1 A 88 88 ARG CB C 88 26.960 27.778 -0.818 1
1 1022 . 2 1 1 A 88 88 ARG N N 88 111.360 116.275 -4.915 1
1 1023 . 2 1 1 A 89 89 VAL H H 89 7.390 7.805 -0.415 1
1 1024 . 2 1 1 A 89 89 VAL HA H 89 3.910 4.376 -0.466 1
1 1032 . 2 1 1 A 89 89 VAL C C 89 177.370 175.604 1.766 1
1 1033 . 2 1 1 A 89 89 VAL CA C 89 64.170 61.316 2.854 1
1 1034 . 2 1 1 A 89 89 VAL CB C 89 32.070 33.642 -1.572 1
1 1037 . 2 1 1 A 89 89 VAL N N 89 117.900 118.304 -0.404 1
1 1038 . 2 1 1 A 90 90 MET H H 90 9.290 8.444 0.846 1
1 1039 . 2 1 1 A 90 90 MET HA H 90 4.340 4.062 0.278 1
1 1047 . 2 1 1 A 90 90 MET C C 90 175.800 176.046 -0.246 1
1 1048 . 2 1 1 A 90 90 MET CA C 90 56.440 56.826 -0.386 1
1 1049 . 2 1 1 A 90 90 MET CB C 90 34.160 33.179 0.981 1
1 1052 . 2 1 1 A 90 90 MET N N 90 128.200 126.260 1.940 1
1 1053 . 2 1 1 A 91 91 GLY H H 91 7.130 7.164 -0.034 1
1 1054 . 2 1 1 A 91 91 GLY HA2 H 91 3.340 3.921 -0.581 1
1 1055 . 2 1 1 A 91 91 GLY HA3 H 91 4.410 4.004 0.406 1
1 1056 . 2 1 1 A 91 91 GLY C C 91 170.920 171.250 -0.330 1
1 1057 . 2 1 1 A 91 91 GLY CA C 91 44.440 45.832 -1.392 1
1 1058 . 2 1 1 A 91 91 GLY N N 91 104.320 103.778 0.542 1
1 1059 . 2 1 1 A 92 92 PHE H H 92 8.790 8.404 0.386 1
1 1060 . 2 1 1 A 92 92 PHE HA H 92 5.270 5.210 0.060 1
1 1068 . 2 1 1 A 92 92 PHE C C 92 176.230 175.116 1.114 1
1 1069 . 2 1 1 A 92 92 PHE CA C 92 57.480 56.905 0.575 1
1 1070 . 2 1 1 A 92 92 PHE CB C 92 42.190 43.166 -0.976 1
1 1075 . 2 1 1 A 92 92 PHE N N 92 118.770 119.205 -0.435 1
1 1076 . 2 1 1 A 93 93 ILE H H 93 8.800 8.883 -0.083 1
1 1077 . 2 1 1 A 93 93 ILE HA H 93 4.310 5.222 -0.912 1
1 1087 . 2 1 1 A 93 93 ILE C C 93 176.380 175.708 0.672 1
1 1088 . 2 1 1 A 93 93 ILE CA C 93 60.480 59.922 0.558 1
1 1089 . 2 1 1 A 93 93 ILE CB C 93 38.010 41.070 -3.060 1
1 1093 . 2 1 1 A 93 93 ILE N N 93 122.300 121.767 0.533 1
1 1094 . 2 1 1 A 94 94 GLY H H 94 8.640 8.521 0.119 1
1 1095 . 2 1 1 A 94 94 GLY HA2 H 94 3.830 4.290 -0.460 1
1 1096 . 2 1 1 A 94 94 GLY HA3 H 94 4.600 4.296 0.304 1
1 1097 . 2 1 1 A 94 94 GLY C C 94 175.080 174.383 0.697 1
1 1098 . 2 1 1 A 94 94 GLY CA C 94 44.530 45.661 -1.131 1
1 1099 . 2 1 1 A 94 94 GLY N N 94 116.550 112.954 3.596 1
1 1100 . 2 1 1 A 95 95 GLY H H 95 8.900 8.893 0.007 1
1 1101 . 2 1 1 A 95 95 GLY HA2 H 95 3.970 3.903 0.067 1
1 1102 . 2 1 1 A 95 95 GLY HA3 H 95 4.370 3.910 0.460 1
1 1103 . 2 1 1 A 95 95 GLY C C 95 174.560 174.167 0.393 1
1 1104 . 2 1 1 A 95 95 GLY CA C 95 45.640 46.862 -1.222 1
1 1105 . 2 1 1 A 95 95 GLY N N 95 112.960 110.278 2.682 1
1 1106 . 2 1 1 A 96 96 THR H H 96 7.830 7.680 0.150 1
1 1107 . 2 1 1 A 96 96 THR HA H 96 4.720 4.837 -0.117 1
1 1112 . 2 1 1 A 96 96 THR C C 96 176.260 174.259 2.001 1
1 1113 . 2 1 1 A 96 96 THR CA C 96 60.360 59.520 0.840 1
1 1114 . 2 1 1 A 96 96 THR CB C 96 70.960 71.898 -0.938 1
1 1116 . 2 1 1 A 96 96 THR N N 96 113.350 110.718 2.632 1
1 1117 . 2 1 1 A 97 97 SER H H 97 8.850 8.721 0.129 1
1 1118 . 2 1 1 A 97 97 SER HA H 97 4.310 4.791 -0.481 1
1 1121 . 2 1 1 A 97 97 SER C C 97 175.570 174.845 0.725 1
1 1122 . 2 1 1 A 97 97 SER CA C 97 60.850 58.350 2.500 1
1 1123 . 2 1 1 A 97 97 SER CB C 97 63.000 63.924 -0.924 1
1 1124 . 2 1 1 A 97 97 SER N N 97 116.420 117.201 -0.781 1
1 1125 . 2 1 1 A 98 98 ASP H H 98 8.360 7.897 0.463 1
1 1126 . 2 1 1 A 98 98 ASP HA H 98 4.310 5.241 -0.931 1
1 1129 . 2 1 1 A 98 98 ASP C C 98 175.380 175.877 -0.497 1
1 1130 . 2 1 1 A 98 98 ASP CA C 98 54.190 55.295 -1.105 1
1 1131 . 2 1 1 A 98 98 ASP CB C 98 40.740 43.725 -2.985 1
1 1132 . 2 1 1 A 98 98 ASP N N 98 116.320 119.905 -3.585 1
1 1133 . 2 1 1 A 99 99 ARG H H 99 7.450 8.220 -0.770 1
1 1134 . 2 1 1 A 99 99 ARG HA H 99 4.350 4.702 -0.352 1
1 1141 . 2 1 1 A 99 99 ARG CA C 99 52.920 53.559 -0.639 1
1 1142 . 2 1 1 A 99 99 ARG CB C 99 30.340 30.754 -0.414 1
1 1145 . 2 1 1 A 99 99 ARG N N 99 119.960 118.424 1.536 1
1 1146 . 2 1 1 A 100 100 PRO HA H 100 4.750 4.474 0.276 1
1 1153 . 2 1 1 A 100 100 PRO C C 100 175.220 177.229 -2.009 1
1 1154 . 2 1 1 A 100 100 PRO CA C 100 62.680 62.728 -0.048 1
1 1155 . 2 1 1 A 100 100 PRO CB C 100 32.820 32.120 0.700 1
1 1158 . 2 1 1 A 101 101 ALA H H 101 7.210 8.435 -1.225 1
1 1159 . 2 1 1 A 101 101 ALA HA H 101 5.030 4.602 0.428 1
1 1163 . 2 1 1 A 101 101 ALA CA C 101 48.570 50.290 -1.720 1
1 1164 . 2 1 1 A 101 101 ALA CB C 101 19.660 17.533 2.127 1
1 1165 . 2 1 1 A 101 101 ALA N N 101 124.490 124.713 -0.223 1
1 1166 . 2 1 1 A 102 102 PRO HA H 102 4.440 4.233 0.207 1
1 1173 . 2 1 1 A 102 102 PRO C C 102 177.200 176.433 0.767 1
1 1174 . 2 1 1 A 102 102 PRO CA C 102 62.190 62.555 -0.365 1
1 1175 . 2 1 1 A 102 102 PRO CB C 102 32.310 32.375 -0.065 1
1 1178 . 2 1 1 A 103 103 ILE H H 103 8.550 8.162 0.388 1
1 1179 . 2 1 1 A 103 103 ILE HA H 103 4.630 4.781 -0.151 1
1 1189 . 2 1 1 A 103 103 ILE C C 103 175.460 175.469 -0.009 1
1 1190 . 2 1 1 A 103 103 ILE CA C 103 59.730 58.397 1.333 1
1 1191 . 2 1 1 A 103 103 ILE CB C 103 40.140 41.227 -1.087 1
1 1195 . 2 1 1 A 103 103 ILE N N 103 115.670 116.250 -0.580 1
1 1196 . 2 1 1 A 104 104 SER H H 104 8.730 8.598 0.132 1
1 1197 . 2 1 1 A 104 104 SER HA H 104 4.500 4.454 0.046 1
1 1200 . 2 1 1 A 104 104 SER C C 104 174.840 175.226 -0.386 1
1 1201 . 2 1 1 A 104 104 SER CA C 104 58.010 59.063 -1.053 1
1 1202 . 2 1 1 A 104 104 SER CB C 104 65.470 63.514 1.956 1
1 1203 . 2 1 1 A 104 104 SER N N 104 119.170 120.053 -0.883 1
1 1204 . 2 1 1 A 105 105 ASP H H 105 8.830 9.023 -0.193 1
1 1205 . 2 1 1 A 105 105 ASP HA H 105 4.200 4.331 -0.131 1
1 1208 . 2 1 1 A 105 105 ASP C C 105 178.520 178.385 0.135 1
1 1209 . 2 1 1 A 105 105 ASP CA C 105 57.870 58.114 -0.244 1
1 1210 . 2 1 1 A 105 105 ASP CB C 105 40.040 40.552 -0.512 1
1 1211 . 2 1 1 A 105 105 ASP N N 105 121.640 125.309 -3.669 1
1 1212 . 2 1 1 A 106 106 LYS H H 106 8.130 8.054 0.076 1
1 1213 . 2 1 1 A 106 106 LYS HA H 106 4.100 3.912 0.188 1
1 1222 . 2 1 1 A 106 106 LYS C C 106 179.400 178.817 0.583 1
1 1223 . 2 1 1 A 106 106 LYS CA C 106 58.980 59.834 -0.854 1
1 1224 . 2 1 1 A 106 106 LYS CB C 106 32.330 32.276 0.054 1
1 1228 . 2 1 1 A 106 106 LYS N N 106 118.300 120.794 -2.494 1
1 1229 . 2 1 1 A 107 107 GLU H H 107 7.670 8.099 -0.429 1
1 1230 . 2 1 1 A 107 107 GLU HA H 107 4.020 4.028 -0.008 1
1 1235 . 2 1 1 A 107 107 GLU C C 107 178.750 179.142 -0.392 1
1 1236 . 2 1 1 A 107 107 GLU CA C 107 59.210 59.372 -0.162 1
1 1237 . 2 1 1 A 107 107 GLU CB C 107 29.780 29.382 0.398 1
1 1239 . 2 1 1 A 107 107 GLU N N 107 121.270 118.976 2.294 1
1 1240 . 2 1 1 A 108 108 VAL H H 108 7.790 7.802 -0.012 1
1 1241 . 2 1 1 A 108 108 VAL HA H 108 3.050 3.380 -0.330 1
1 1249 . 2 1 1 A 108 108 VAL C C 108 177.550 177.361 0.189 1
1 1250 . 2 1 1 A 108 108 VAL CA C 108 67.080 66.276 0.804 1
1 1251 . 2 1 1 A 108 108 VAL CB C 108 31.220 30.956 0.264 1
1 1254 . 2 1 1 A 108 108 VAL N N 108 120.940 119.675 1.265 1
1 1255 . 2 1 1 A 109 109 ASP H H 109 7.840 7.969 -0.129 1
1 1256 . 2 1 1 A 109 109 ASP HA H 109 4.110 4.212 -0.102 1
1 1259 . 2 1 1 A 109 109 ASP C C 109 178.190 178.501 -0.311 1
1 1260 . 2 1 1 A 109 109 ASP CA C 109 57.470 57.047 0.423 1
1 1261 . 2 1 1 A 109 109 ASP CB C 109 40.480 40.148 0.332 1
1 1262 . 2 1 1 A 109 109 ASP N N 109 118.780 120.704 -1.924 1
1 1263 . 2 1 1 A 110 110 ALA H H 110 7.520 7.789 -0.269 1
1 1264 . 2 1 1 A 110 110 ALA HA H 110 4.110 4.044 0.066 1
1 1268 . 2 1 1 A 110 110 ALA C C 110 180.550 179.793 0.757 1
1 1269 . 2 1 1 A 110 110 ALA CA C 110 54.880 55.139 -0.259 1
1 1270 . 2 1 1 A 110 110 ALA CB C 110 18.440 18.085 0.355 1
1 1271 . 2 1 1 A 110 110 ALA N N 110 120.640 122.673 -2.033 1
1 1272 . 2 1 1 A 111 111 ILE H H 111 7.840 7.701 0.139 1
1 1273 . 2 1 1 A 111 111 ILE HA H 111 3.580 3.599 -0.019 1
1 1281 . 2 1 1 A 111 111 ILE C C 111 177.470 177.863 -0.393 1
1 1282 . 2 1 1 A 111 111 ILE CA C 111 64.620 64.927 -0.307 1
1 1283 . 2 1 1 A 111 111 ILE CB C 111 38.600 37.433 1.167 1
1 1286 . 2 1 1 A 111 111 ILE N N 111 119.840 119.185 0.655 1
1 1287 . 2 1 1 A 112 112 MET H H 112 8.100 7.578 0.522 1
1 1288 . 2 1 1 A 112 112 MET HA H 112 4.400 4.073 0.327 1
1 1296 . 2 1 1 A 112 112 MET C C 112 177.710 178.654 -0.944 1
1 1297 . 2 1 1 A 112 112 MET CA C 112 55.300 58.701 -3.401 1
1 1298 . 2 1 1 A 112 112 MET CB C 112 30.510 32.562 -2.052 1
1 1301 . 2 1 1 A 112 112 MET N N 112 115.180 118.099 -2.919 1
1 1302 . 2 1 1 A 113 113 ASN H H 113 8.070 8.081 -0.011 1
1 1303 . 2 1 1 A 113 113 ASN HA H 113 4.570 4.432 0.138 1
1 1308 . 2 1 1 A 113 113 ASN C C 113 175.530 178.554 -3.024 1
1 1309 . 2 1 1 A 113 113 ASN CA C 113 54.420 56.314 -1.894 1
1 1310 . 2 1 1 A 113 113 ASN CB C 113 38.350 37.665 0.685 1
1 1311 . 2 1 1 A 113 113 ASN N N 113 117.190 117.189 0.001 1
1 1313 . 2 1 1 A 114 114 ARG H H 114 8.070 7.995 0.075 1
1 1314 . 2 1 1 A 114 114 ARG HA H 114 4.280 3.921 0.359 1
1 1321 . 2 1 1 A 114 114 ARG C C 114 176.620 178.467 -1.847 1
1 1322 . 2 1 1 A 114 114 ARG CA C 114 56.910 58.836 -1.926 1
1 1323 . 2 1 1 A 114 114 ARG CB C 114 30.370 29.574 0.796 1
1 1326 . 2 1 1 A 114 114 ARG N N 114 118.360 119.640 -1.280 1
1 1327 . 2 1 1 A 115 115 LEU H H 115 8.100 7.569 0.531 1
1 1328 . 2 1 1 A 115 115 LEU HA H 115 4.310 3.709 0.601 1
1 1338 . 2 1 1 A 115 115 LEU C C 115 177.440 179.238 -1.798 1
1 1339 . 2 1 1 A 115 115 LEU CA C 115 55.440 57.880 -2.440 1
1 1340 . 2 1 1 A 115 115 LEU CB C 115 42.250 41.551 0.699 1
1 1344 . 2 1 1 A 115 115 LEU N N 115 120.580 120.086 0.494 1
1 1345 . 2 1 1 A 116 116 GLN H H 116 8.180 7.816 0.364 1
1 1346 . 2 1 1 A 116 116 GLN HA H 116 4.360 4.004 0.356 1
1 1353 . 2 1 1 A 116 116 GLN C C 116 175.890 176.975 -1.085 1
1 1354 . 2 1 1 A 116 116 GLN CA C 116 55.810 58.890 -3.080 1
1 1355 . 2 1 1 A 116 116 GLN CB C 116 29.500 28.310 1.190 1
1 1357 . 2 1 1 A 116 116 GLN N N 116 119.770 118.831 0.939 1
1 1358 . 2 1 1 A 117 117 GLN H H 117 8.350 7.478 0.872 1
1 1359 . 2 1 1 A 117 117 GLN HA H 117 4.380 4.201 0.179 1
1 1366 . 2 1 1 A 117 117 GLN C C 117 176.130 175.166 0.964 1
1 1367 . 2 1 1 A 117 117 GLN CA C 117 55.810 56.145 -0.335 1
1 1368 . 2 1 1 A 117 117 GLN CB C 117 29.500 29.415 0.085 1
1 1370 . 2 1 1 A 117 117 GLN N N 117 121.440 119.606 1.834 1
1 1371 . 2 1 1 A 118 118 VAL H H 118 8.240 8.734 -0.494 1
1 1372 . 2 1 1 A 118 118 VAL HA H 118 4.120 4.579 -0.459 1
1 1380 . 2 1 1 A 118 118 VAL C C 118 176.650 177.304 -0.654 1
1 1381 . 2 1 1 A 118 118 VAL CA C 118 62.720 60.635 2.085 1
1 1382 . 2 1 1 A 118 118 VAL CB C 118 32.730 35.158 -2.428 1
1 1385 . 2 1 1 A 118 118 VAL N N 118 121.250 126.425 -5.175 1
1 1386 . 2 1 1 A 119 119 GLY H H 119 8.460 8.658 -0.198 1
1 1387 . 2 1 1 A 119 119 GLY HA2 H 119 3.990 3.824 0.166 1
1 1388 . 2 1 1 A 119 119 GLY HA3 H 119 3.990 3.828 0.162 1
1 1389 . 2 1 1 A 119 119 GLY C C 119 173.770 174.111 -0.341 1
1 1390 . 2 1 1 A 119 119 GLY CA C 119 45.260 47.458 -2.198 1
1 1391 . 2 1 1 A 119 119 GLY N N 119 112.300 113.819 -1.519 1
1 1392 . 2 1 1 A 120 120 ASP H H 120 8.230 8.075 0.155 1
1 1393 . 2 1 1 A 120 120 ASP HA H 120 4.580 4.962 -0.382 1
1 1396 . 2 1 1 A 120 120 ASP C C 120 175.180 174.132 1.048 1
1 1397 . 2 1 1 A 120 120 ASP CA C 120 54.340 53.367 0.973 1
1 1398 . 2 1 1 A 120 120 ASP CB C 120 41.390 41.415 -0.025 1
1 1399 . 2 1 1 A 120 120 ASP N N 120 120.420 119.649 0.771 1
1 1400 . 2 1 1 A 121 121 LYS H H 121 7.950 8.419 -0.469 1
1 1401 . 2 1 1 A 121 121 LYS HA H 121 4.240 4.617 -0.377 1
1 1402 . 2 1 1 A 121 121 LYS CA C 121 53.620 53.365 0.255 1
1 1403 . 2 1 1 A 121 121 LYS N N 121 119.110 125.370 -6.260 1
1 1404 . 2 1 1 A 122 122 PRO HA H 122 4.410 4.623 -0.213 1
1 1405 . 2 1 1 A 122 122 PRO C C 122 176.560 176.365 0.195 1
1 1406 . 2 1 1 A 122 122 PRO CA C 122 63.130 64.236 -1.106 1
1 2 . 3 1 1 A 2 2 SER H H 2 7.890 8.588 -0.698 1
1 3 . 3 1 1 A 2 2 SER HA H 2 4.270 4.269 0.001 1
1 4 . 3 1 1 A 2 2 SER C C 2 173.960 176.701 -2.741 1
1 5 . 3 1 1 A 2 2 SER CA C 2 60.800 60.814 -0.014 1
1 6 . 3 1 1 A 2 2 SER N N 2 111.940 114.477 -2.537 1
1 7 . 3 1 1 A 3 3 GLU H H 3 8.010 7.792 0.218 1
1 8 . 3 1 1 A 3 3 GLU HA H 3 4.360 4.048 0.312 1
1 9 . 3 1 1 A 3 3 GLU C C 3 175.710 176.224 -0.514 1
1 10 . 3 1 1 A 3 3 GLU CA C 3 56.310 59.180 -2.870 1
1 11 . 3 1 1 A 3 3 GLU N N 3 121.280 122.125 -0.845 1
1 12 . 3 1 1 A 4 4 ALA H H 4 8.540 7.343 1.197 1
1 13 . 3 1 1 A 4 4 ALA HA H 4 4.560 4.622 -0.062 1
1 14 . 3 1 1 A 4 4 ALA CA C 4 50.630 50.358 0.272 1
1 15 . 3 1 1 A 4 4 ALA N N 4 127.840 119.268 8.572 1
1 16 . 3 1 1 A 5 5 PRO HA H 5 4.420 4.575 -0.155 1
1 17 . 3 1 1 A 5 5 PRO C C 5 174.240 175.595 -1.355 1
1 18 . 3 1 1 A 5 5 PRO CA C 5 62.840 62.593 0.247 1
1 19 . 3 1 1 A 6 6 LYS H H 6 8.320 8.489 -0.169 1
1 20 . 3 1 1 A 6 6 LYS HA H 6 4.290 4.891 -0.601 1
1 21 . 3 1 1 A 6 6 LYS C C 6 176.100 175.130 0.970 1
1 22 . 3 1 1 A 6 6 LYS CA C 6 55.540 54.856 0.684 1
1 23 . 3 1 1 A 6 6 LYS N N 6 121.910 121.164 0.746 1
1 24 . 3 1 1 A 7 7 LYS H H 7 8.450 8.554 -0.104 1
1 25 . 3 1 1 A 7 7 LYS HA H 7 3.940 4.921 -0.981 1
1 26 . 3 1 1 A 7 7 LYS C C 7 175.700 175.473 0.227 1
1 27 . 3 1 1 A 7 7 LYS CA C 7 56.440 54.407 2.033 1
1 28 . 3 1 1 A 7 7 LYS N N 7 122.250 122.888 -0.638 1
1 29 . 3 1 1 A 8 8 ARG H H 8 8.210 8.695 -0.485 1
1 30 . 3 1 1 A 8 8 ARG HA H 8 4.670 4.676 -0.006 1
1 31 . 3 1 1 A 8 8 ARG C C 8 173.760 174.721 -0.961 1
1 32 . 3 1 1 A 8 8 ARG CA C 8 53.420 53.825 -0.405 1
1 33 . 3 1 1 A 8 8 ARG N N 8 122.560 122.526 0.034 1
1 34 . 3 1 1 A 9 9 TRP H H 9 8.610 8.777 -0.167 1
1 35 . 3 1 1 A 9 9 TRP HA H 9 4.910 5.136 -0.226 1
1 44 . 3 1 1 A 9 9 TRP C C 9 174.610 175.652 -1.042 1
1 45 . 3 1 1 A 9 9 TRP CA C 9 57.630 55.940 1.690 1
1 46 . 3 1 1 A 9 9 TRP CB C 9 31.020 30.446 0.574 1
1 52 . 3 1 1 A 9 9 TRP N N 9 120.540 121.003 -0.463 1
1 54 . 3 1 1 A 10 10 TYR H H 10 9.260 9.164 0.096 1
1 55 . 3 1 1 A 10 10 TYR HA H 10 4.820 5.298 -0.478 1
1 62 . 3 1 1 A 10 10 TYR C C 10 174.340 175.357 -1.017 1
1 63 . 3 1 1 A 10 10 TYR CA C 10 57.050 56.489 0.561 1
1 64 . 3 1 1 A 10 10 TYR CB C 10 41.920 42.520 -0.600 1
1 69 . 3 1 1 A 10 10 TYR N N 10 118.990 122.240 -3.250 1
1 70 . 3 1 1 A 11 11 VAL H H 11 9.450 9.156 0.294 1
1 71 . 3 1 1 A 11 11 VAL HA H 11 4.470 4.833 -0.363 1
1 79 . 3 1 1 A 11 11 VAL C C 11 175.030 175.491 -0.461 1
1 80 . 3 1 1 A 11 11 VAL CA C 11 62.320 61.766 0.554 1
1 81 . 3 1 1 A 11 11 VAL CB C 11 32.400 33.498 -1.098 1
1 84 . 3 1 1 A 11 11 VAL N N 11 120.930 122.169 -1.239 1
1 85 . 3 1 1 A 12 12 VAL H H 12 9.320 9.533 -0.213 1
1 86 . 3 1 1 A 12 12 VAL HA H 12 3.940 4.273 -0.333 1
1 94 . 3 1 1 A 12 12 VAL C C 12 173.870 173.927 -0.057 1
1 95 . 3 1 1 A 12 12 VAL CA C 12 61.330 60.774 0.556 1
1 96 . 3 1 1 A 12 12 VAL CB C 12 33.500 34.187 -0.687 1
1 99 . 3 1 1 A 12 12 VAL N N 12 128.860 128.540 0.320 1
1 100 . 3 1 1 A 13 13 GLN H H 13 8.830 8.613 0.217 1
1 101 . 3 1 1 A 13 13 GLN HA H 13 4.710 4.677 0.033 1
1 108 . 3 1 1 A 13 13 GLN C C 13 174.230 174.942 -0.712 1
1 109 . 3 1 1 A 13 13 GLN CA C 13 54.800 54.712 0.088 1
1 110 . 3 1 1 A 13 13 GLN CB C 13 29.450 29.597 -0.147 1
1 111 . 3 1 1 A 13 13 GLN N N 13 126.050 127.891 -1.841 1
1 113 . 3 1 1 A 14 14 ALA H H 14 9.420 8.772 0.648 1
1 114 . 3 1 1 A 14 14 ALA HA H 14 5.150 4.803 0.347 1
1 118 . 3 1 1 A 14 14 ALA C C 14 176.400 176.241 0.159 1
1 119 . 3 1 1 A 14 14 ALA CA C 14 49.660 50.655 -0.995 1
1 120 . 3 1 1 A 14 14 ALA CB C 14 22.840 23.138 -0.298 1
1 121 . 3 1 1 A 14 14 ALA N N 14 131.620 127.969 3.651 1
1 122 . 3 1 1 A 15 15 PHE H H 15 8.070 8.531 -0.461 1
1 123 . 3 1 1 A 15 15 PHE HA H 15 4.410 4.643 -0.233 1
1 128 . 3 1 1 A 15 15 PHE C C 15 176.130 176.034 0.096 1
1 129 . 3 1 1 A 15 15 PHE CA C 15 58.550 58.982 -0.432 1
1 130 . 3 1 1 A 15 15 PHE CB C 15 39.780 39.635 0.145 1
1 133 . 3 1 1 A 15 15 PHE N N 15 119.680 119.627 0.053 1
1 134 . 3 1 1 A 16 16 SER H H 16 8.370 8.827 -0.457 1
1 135 . 3 1 1 A 16 16 SER HA H 16 4.140 4.208 -0.068 1
1 138 . 3 1 1 A 16 16 SER C C 16 175.820 175.255 0.565 1
1 139 . 3 1 1 A 16 16 SER CA C 16 60.570 59.783 0.787 1
1 140 . 3 1 1 A 16 16 SER CB C 16 63.030 63.191 -0.161 1
1 141 . 3 1 1 A 16 16 SER N N 16 119.700 117.577 2.123 1
1 142 . 3 1 1 A 17 17 GLY H H 17 9.130 8.749 0.381 1
1 143 . 3 1 1 A 17 17 GLY HA2 H 17 3.640 3.635 0.005 1
1 144 . 3 1 1 A 17 17 GLY HA3 H 17 4.200 3.778 0.422 1
1 145 . 3 1 1 A 17 17 GLY C C 17 175.520 174.706 0.814 1
1 146 . 3 1 1 A 17 17 GLY CA C 17 45.260 45.338 -0.078 1
1 147 . 3 1 1 A 17 17 GLY N N 17 115.850 114.877 0.973 1
1 148 . 3 1 1 A 18 18 PHE H H 18 8.480 7.595 0.885 1
1 149 . 3 1 1 A 18 18 PHE HA H 18 4.740 4.625 0.115 1
1 154 . 3 1 1 A 18 18 PHE C C 18 175.430 176.352 -0.922 1
1 155 . 3 1 1 A 18 18 PHE CA C 18 58.240 57.914 0.326 1
1 156 . 3 1 1 A 18 18 PHE CB C 18 39.010 38.604 0.406 1
1 159 . 3 1 1 A 18 18 PHE N N 18 118.550 119.752 -1.202 1
1 160 . 3 1 1 A 19 19 GLU H H 19 10.690 8.571 2.119 1
1 161 . 3 1 1 A 19 19 GLU HA H 19 3.490 4.137 -0.647 1
1 166 . 3 1 1 A 19 19 GLU C C 19 177.650 178.926 -1.276 1
1 167 . 3 1 1 A 19 19 GLU CA C 19 62.280 58.924 3.356 1
1 168 . 3 1 1 A 19 19 GLU CB C 19 28.380 29.429 -1.049 1
1 170 . 3 1 1 A 19 19 GLU N N 19 123.470 119.718 3.752 1
1 171 . 3 1 1 A 20 20 GLY H H 20 8.740 8.183 0.557 1
1 172 . 3 1 1 A 20 20 GLY HA2 H 20 3.840 3.744 0.096 1
1 173 . 3 1 1 A 20 20 GLY HA3 H 20 3.940 3.757 0.183 1
1 174 . 3 1 1 A 20 20 GLY C C 20 176.860 175.742 1.118 1
1 175 . 3 1 1 A 20 20 GLY CA C 20 47.140 46.992 0.148 1
1 176 . 3 1 1 A 20 20 GLY N N 20 105.480 108.555 -3.075 1
1 177 . 3 1 1 A 21 21 ARG H H 21 7.690 8.274 -0.584 1
1 178 . 3 1 1 A 21 21 ARG HA H 21 4.180 4.116 0.064 1
1 185 . 3 1 1 A 21 21 ARG C C 21 179.490 178.482 1.008 1
1 186 . 3 1 1 A 21 21 ARG CA C 21 58.660 59.073 -0.413 1
1 187 . 3 1 1 A 21 21 ARG CB C 21 30.100 29.924 0.176 1
1 190 . 3 1 1 A 21 21 ARG N N 21 123.120 122.086 1.034 1
1 191 . 3 1 1 A 22 22 VAL H H 22 8.980 9.098 -0.118 1
1 192 . 3 1 1 A 22 22 VAL HA H 22 3.560 3.670 -0.110 1
1 200 . 3 1 1 A 22 22 VAL C C 22 177.320 178.342 -1.022 1
1 201 . 3 1 1 A 22 22 VAL CA C 22 66.960 66.155 0.805 1
1 202 . 3 1 1 A 22 22 VAL CB C 22 31.050 31.552 -0.502 1
1 205 . 3 1 1 A 22 22 VAL N N 22 122.760 119.946 2.814 1
1 206 . 3 1 1 A 23 23 ALA H H 23 8.280 7.956 0.324 1
1 207 . 3 1 1 A 23 23 ALA HA H 23 3.850 4.042 -0.192 1
1 211 . 3 1 1 A 23 23 ALA C C 23 179.340 179.504 -0.164 1
1 212 . 3 1 1 A 23 23 ALA CA C 23 56.260 55.233 1.027 1
1 213 . 3 1 1 A 23 23 ALA CB C 23 18.260 18.115 0.145 1
1 214 . 3 1 1 A 23 23 ALA N N 23 122.120 121.862 0.258 1
1 215 . 3 1 1 A 24 24 THR H H 24 8.020 7.548 0.472 1
1 216 . 3 1 1 A 24 24 THR HA H 24 3.920 3.980 -0.060 1
1 221 . 3 1 1 A 24 24 THR C C 24 176.940 176.686 0.254 1
1 222 . 3 1 1 A 24 24 THR CA C 24 66.820 66.736 0.084 1
1 223 . 3 1 1 A 24 24 THR CB C 24 68.930 68.331 0.599 1
1 225 . 3 1 1 A 24 24 THR N N 24 113.410 115.502 -2.092 1
1 226 . 3 1 1 A 25 25 SER H H 25 8.570 8.077 0.493 1
1 227 . 3 1 1 A 25 25 SER HA H 25 4.400 4.087 0.313 1
1 230 . 3 1 1 A 25 25 SER C C 25 177.610 176.006 1.604 1
1 231 . 3 1 1 A 25 25 SER CA C 25 61.920 62.182 -0.262 1
1 232 . 3 1 1 A 25 25 SER CB C 25 63.540 63.007 0.533 1
1 233 . 3 1 1 A 25 25 SER N N 25 118.260 117.620 0.640 1
1 234 . 3 1 1 A 26 26 LEU H H 26 9.430 7.841 1.589 1
1 235 . 3 1 1 A 26 26 LEU HA H 26 3.900 4.203 -0.303 1
1 245 . 3 1 1 A 26 26 LEU C C 26 177.710 178.555 -0.845 1
1 246 . 3 1 1 A 26 26 LEU CA C 26 58.910 57.718 1.192 1
1 247 . 3 1 1 A 26 26 LEU CB C 26 41.300 41.635 -0.335 1
1 251 . 3 1 1 A 26 26 LEU N N 26 124.120 122.675 1.445 1
1 252 . 3 1 1 A 27 27 ARG H H 27 7.790 7.734 0.056 1
1 253 . 3 1 1 A 27 27 ARG HA H 27 3.880 3.733 0.147 1
1 260 . 3 1 1 A 27 27 ARG C C 27 179.380 178.583 0.797 1
1 261 . 3 1 1 A 27 27 ARG CA C 27 60.510 59.050 1.460 1
1 262 . 3 1 1 A 27 27 ARG CB C 27 29.670 29.781 -0.111 1
1 265 . 3 1 1 A 27 27 ARG N N 27 116.710 118.850 -2.140 1
1 266 . 3 1 1 A 28 28 GLU H H 28 7.900 7.817 0.083 1
1 267 . 3 1 1 A 28 28 GLU HA H 28 4.070 3.964 0.106 1
1 272 . 3 1 1 A 28 28 GLU C C 28 179.450 179.413 0.037 1
1 273 . 3 1 1 A 28 28 GLU CA C 28 59.450 58.861 0.589 1
1 274 . 3 1 1 A 28 28 GLU CB C 28 29.610 29.469 0.141 1
1 276 . 3 1 1 A 28 28 GLU N N 28 118.340 118.928 -0.588 1
1 277 . 3 1 1 A 29 29 HIS H H 29 8.940 7.233 1.707 1
1 278 . 3 1 1 A 29 29 HIS HA H 29 4.160 4.493 -0.333 1
1 283 . 3 1 1 A 29 29 HIS C C 29 177.750 177.921 -0.171 1
1 284 . 3 1 1 A 29 29 HIS CA C 29 61.260 59.837 1.423 1
1 285 . 3 1 1 A 29 29 HIS CB C 29 29.870 30.279 -0.409 1
1 287 . 3 1 1 A 29 29 HIS N N 29 120.440 118.745 1.695 1
1 288 . 3 1 1 A 30 30 ILE H H 30 8.580 8.431 0.149 1
1 289 . 3 1 1 A 30 30 ILE HA H 30 3.160 3.680 -0.520 1
1 299 . 3 1 1 A 30 30 ILE C C 30 177.230 178.127 -0.897 1
1 300 . 3 1 1 A 30 30 ILE CA C 30 66.460 65.410 1.050 1
1 301 . 3 1 1 A 30 30 ILE CB C 30 38.630 37.585 1.045 1
1 305 . 3 1 1 A 30 30 ILE N N 30 121.010 120.254 0.756 1
1 306 . 3 1 1 A 31 31 LYS H H 31 7.020 8.164 -1.144 1
1 307 . 3 1 1 A 31 31 LYS HA H 31 4.170 4.006 0.164 1
1 316 . 3 1 1 A 31 31 LYS C C 31 180.570 178.715 1.855 1
1 317 . 3 1 1 A 31 31 LYS CA C 31 58.920 59.790 -0.870 1
1 318 . 3 1 1 A 31 31 LYS CB C 31 32.490 31.996 0.494 1
1 322 . 3 1 1 A 31 31 LYS N N 31 117.400 121.091 -3.691 1
1 323 . 3 1 1 A 32 32 LEU H H 32 8.400 8.033 0.367 1
1 324 . 3 1 1 A 32 32 LEU HA H 32 3.990 3.981 0.009 1
1 334 . 3 1 1 A 32 32 LEU C C 32 178.230 178.874 -0.644 1
1 335 . 3 1 1 A 32 32 LEU CA C 32 57.700 57.822 -0.122 1
1 336 . 3 1 1 A 32 32 LEU CB C 32 42.540 41.898 0.642 1
1 340 . 3 1 1 A 32 32 LEU N N 32 121.180 119.446 1.734 1
1 341 . 3 1 1 A 33 33 HIS H H 33 7.620 8.553 -0.933 1
1 342 . 3 1 1 A 33 33 HIS HA H 33 4.600 4.649 -0.049 1
1 347 . 3 1 1 A 33 33 HIS C C 33 177.090 174.675 2.415 1
1 348 . 3 1 1 A 33 33 HIS CA C 33 55.840 55.981 -0.141 1
1 349 . 3 1 1 A 33 33 HIS CB C 33 29.330 29.844 -0.514 1
1 351 . 3 1 1 A 33 33 HIS N N 33 112.220 116.328 -4.108 1
1 352 . 3 1 1 A 34 34 ASN H H 34 8.030 8.392 -0.362 1
1 353 . 3 1 1 A 34 34 ASN HA H 34 4.890 4.387 0.503 1
1 358 . 3 1 1 A 34 34 ASN C C 34 175.910 175.934 -0.024 1
1 359 . 3 1 1 A 34 34 ASN CA C 34 54.530 54.165 0.365 1
1 360 . 3 1 1 A 34 34 ASN CB C 34 37.380 37.328 0.052 1
1 361 . 3 1 1 A 34 34 ASN N N 34 117.600 116.425 1.175 1
1 363 . 3 1 1 A 35 35 MET H H 35 8.330 8.643 -0.313 1
1 364 . 3 1 1 A 35 35 MET HA H 35 4.940 4.758 0.182 1
1 372 . 3 1 1 A 35 35 MET C C 35 176.880 176.902 -0.022 1
1 373 . 3 1 1 A 35 35 MET CA C 35 55.600 54.877 0.723 1
1 374 . 3 1 1 A 35 35 MET CB C 35 33.790 32.314 1.476 1
1 377 . 3 1 1 A 35 35 MET N N 35 116.190 117.284 -1.094 1
1 378 . 3 1 1 A 36 36 GLU H H 36 9.730 8.211 1.519 1
1 379 . 3 1 1 A 36 36 GLU HA H 36 3.850 4.177 -0.327 1
1 384 . 3 1 1 A 36 36 GLU C C 36 178.290 178.768 -0.478 1
1 385 . 3 1 1 A 36 36 GLU CA C 36 61.280 59.631 1.649 1
1 386 . 3 1 1 A 36 36 GLU CB C 36 29.270 29.357 -0.087 1
1 388 . 3 1 1 A 36 36 GLU N N 36 121.630 120.676 0.954 1
1 389 . 3 1 1 A 37 37 ASP H H 37 8.850 8.124 0.726 1
1 390 . 3 1 1 A 37 37 ASP HA H 37 4.470 4.400 0.070 1
1 393 . 3 1 1 A 37 37 ASP C C 37 177.190 178.960 -1.770 1
1 394 . 3 1 1 A 37 37 ASP CA C 37 56.140 57.390 -1.250 1
1 395 . 3 1 1 A 37 37 ASP CB C 37 40.050 40.593 -0.543 1
1 396 . 3 1 1 A 37 37 ASP N N 37 114.390 119.741 -5.351 1
1 397 . 3 1 1 A 38 38 LEU H H 38 7.880 7.865 0.015 1
1 398 . 3 1 1 A 38 38 LEU HA H 38 4.290 4.034 0.256 1
1 408 . 3 1 1 A 38 38 LEU C C 38 175.090 177.610 -2.520 1
1 409 . 3 1 1 A 38 38 LEU CA C 38 54.670 57.897 -3.227 1
1 410 . 3 1 1 A 38 38 LEU CB C 38 42.940 41.999 0.941 1
1 414 . 3 1 1 A 38 38 LEU N N 38 116.550 119.047 -2.497 1
1 415 . 3 1 1 A 39 39 PHE H H 39 7.500 7.659 -0.159 1
1 416 . 3 1 1 A 39 39 PHE HA H 39 4.970 4.581 0.389 1
1 424 . 3 1 1 A 39 39 PHE C C 39 175.380 175.692 -0.312 1
1 425 . 3 1 1 A 39 39 PHE CA C 39 57.580 58.797 -1.217 1
1 426 . 3 1 1 A 39 39 PHE CB C 39 44.990 39.215 5.775 1
1 432 . 3 1 1 A 39 39 PHE N N 39 115.370 116.915 -1.545 1
1 433 . 3 1 1 A 40 40 GLY H H 40 8.680 8.774 -0.094 1
1 434 . 3 1 1 A 40 40 GLY HA2 H 40 3.370 3.963 -0.593 1
1 435 . 3 1 1 A 40 40 GLY HA3 H 40 4.550 4.047 0.503 1
1 436 . 3 1 1 A 40 40 GLY C C 40 173.090 173.706 -0.616 1
1 437 . 3 1 1 A 40 40 GLY CA C 40 44.180 46.444 -2.264 1
1 438 . 3 1 1 A 40 40 GLY N N 40 110.930 111.814 -0.884 1
1 439 . 3 1 1 A 41 41 GLU H H 41 8.320 7.665 0.655 1
1 440 . 3 1 1 A 41 41 GLU HA H 41 4.280 4.837 -0.557 1
1 445 . 3 1 1 A 41 41 GLU C C 41 173.900 174.922 -1.022 1
1 446 . 3 1 1 A 41 41 GLU CA C 41 56.900 54.590 2.310 1
1 447 . 3 1 1 A 41 41 GLU CB C 41 32.110 34.187 -2.077 1
1 449 . 3 1 1 A 41 41 GLU N N 41 126.730 116.862 9.868 1
1 450 . 3 1 1 A 42 42 VAL H H 42 8.100 8.677 -0.577 1
1 451 . 3 1 1 A 42 42 VAL HA H 42 5.160 5.286 -0.126 1
1 459 . 3 1 1 A 42 42 VAL C C 42 176.340 175.118 1.222 1
1 460 . 3 1 1 A 42 42 VAL CA C 42 61.200 61.023 0.177 1
1 461 . 3 1 1 A 42 42 VAL CB C 42 34.770 34.801 -0.031 1
1 464 . 3 1 1 A 42 42 VAL N N 42 119.360 121.969 -2.609 1
1 465 . 3 1 1 A 43 43 MET H H 43 9.870 9.789 0.081 1
1 466 . 3 1 1 A 43 43 MET HA H 43 5.070 5.141 -0.071 1
1 474 . 3 1 1 A 43 43 MET C C 43 173.890 174.366 -0.476 1
1 475 . 3 1 1 A 43 43 MET CA C 43 54.740 54.503 0.237 1
1 476 . 3 1 1 A 43 43 MET CB C 43 37.500 37.075 0.425 1
1 479 . 3 1 1 A 43 43 MET N N 43 125.720 124.152 1.568 1
1 480 . 3 1 1 A 44 44 VAL H H 44 8.800 9.016 -0.216 1
1 481 . 3 1 1 A 44 44 VAL HA H 44 4.720 4.788 -0.068 1
1 489 . 3 1 1 A 44 44 VAL CA C 44 59.090 59.182 -0.092 1
1 490 . 3 1 1 A 44 44 VAL CB C 44 33.710 33.558 0.152 1
1 493 . 3 1 1 A 44 44 VAL N N 44 122.340 123.324 -0.984 1
1 494 . 3 1 1 A 45 45 PRO HA H 45 4.480 4.502 -0.022 1
1 501 . 3 1 1 A 45 45 PRO C C 45 177.080 177.692 -0.612 1
1 502 . 3 1 1 A 45 45 PRO CA C 45 63.240 64.511 -1.271 1
1 503 . 3 1 1 A 45 45 PRO CB C 45 32.170 32.064 0.106 1
1 506 . 3 1 1 A 46 46 THR H H 46 8.200 7.912 0.288 1
1 507 . 3 1 1 A 46 46 THR HA H 46 4.290 4.228 0.062 1
1 512 . 3 1 1 A 46 46 THR C C 46 174.600 174.717 -0.117 1
1 513 . 3 1 1 A 46 46 THR CA C 46 62.100 63.781 -1.681 1
1 514 . 3 1 1 A 46 46 THR CB C 46 69.990 68.583 1.407 1
1 516 . 3 1 1 A 46 46 THR N N 46 113.410 108.132 5.278 1
1 517 . 3 1 1 A 47 47 GLU H H 47 8.380 7.512 0.868 1
1 518 . 3 1 1 A 47 47 GLU HA H 47 4.400 4.538 -0.138 1
1 521 . 3 1 1 A 47 47 GLU C C 47 175.970 176.491 -0.521 1
1 522 . 3 1 1 A 47 47 GLU CA C 47 55.200 55.220 -0.020 1
1 523 . 3 1 1 A 47 47 GLU CB C 47 32.300 31.450 0.850 1
1 524 . 3 1 1 A 47 47 GLU N N 47 122.830 122.982 -0.152 1
1 525 . 3 1 1 A 48 48 GLU H H 48 8.400 8.980 -0.580 1
1 526 . 3 1 1 A 48 48 GLU HA H 48 4.280 4.146 0.134 1
1 531 . 3 1 1 A 48 48 GLU C C 48 175.750 175.800 -0.050 1
1 532 . 3 1 1 A 48 48 GLU CA C 48 55.190 59.062 -3.872 1
1 533 . 3 1 1 A 48 48 GLU CB C 48 31.980 30.400 1.580 1
1 535 . 3 1 1 A 48 48 GLU N N 48 121.950 127.162 -5.212 1
1 536 . 3 1 1 A 49 49 VAL H H 49 8.240 8.032 0.208 1
1 537 . 3 1 1 A 49 49 VAL HA H 49 4.170 4.597 -0.427 1
1 542 . 3 1 1 A 49 49 VAL C C 49 174.610 176.264 -1.654 1
1 543 . 3 1 1 A 49 49 VAL CA C 49 62.280 60.241 2.039 1
1 544 . 3 1 1 A 49 49 VAL CB C 49 32.930 34.491 -1.561 1
1 546 . 3 1 1 A 49 49 VAL N N 49 123.990 115.923 8.067 1
1 547 . 3 1 1 A 50 50 VAL H H 50 8.230 8.428 -0.198 1
1 548 . 3 1 1 A 50 50 VAL HA H 50 4.220 3.885 0.335 1
1 553 . 3 1 1 A 50 50 VAL C C 50 175.770 175.087 0.683 1
1 554 . 3 1 1 A 50 50 VAL CA C 50 62.170 65.058 -2.888 1
1 555 . 3 1 1 A 50 50 VAL CB C 50 33.110 32.093 1.017 1
1 557 . 3 1 1 A 50 50 VAL N N 50 123.960 125.091 -1.131 1
1 558 . 3 1 1 A 51 51 GLU H H 51 8.570 7.846 0.724 1
1 559 . 3 1 1 A 51 51 GLU HA H 51 4.380 4.940 -0.560 1
1 564 . 3 1 1 A 51 51 GLU C C 51 175.920 175.224 0.696 1
1 565 . 3 1 1 A 51 51 GLU CA C 51 56.050 55.249 0.801 1
1 566 . 3 1 1 A 51 51 GLU CB C 51 31.080 32.915 -1.835 1
1 568 . 3 1 1 A 51 51 GLU N N 51 125.070 120.950 4.120 1
1 569 . 3 1 1 A 52 52 ILE H H 52 8.320 8.959 -0.639 1
1 570 . 3 1 1 A 52 52 ILE HA H 52 4.290 4.666 -0.376 1
1 580 . 3 1 1 A 52 52 ILE C C 52 176.330 175.462 0.868 1
1 581 . 3 1 1 A 52 52 ILE CA C 52 60.940 60.329 0.611 1
1 582 . 3 1 1 A 52 52 ILE CB C 52 38.510 39.212 -0.702 1
1 586 . 3 1 1 A 52 52 ILE N N 52 122.760 125.801 -3.041 1
1 587 . 3 1 1 A 53 53 ARG H H 53 8.500 8.651 -0.151 1
1 588 . 3 1 1 A 53 53 ARG HA H 53 4.430 4.213 0.217 1
1 595 . 3 1 1 A 53 53 ARG C C 53 176.950 178.077 -1.127 1
1 596 . 3 1 1 A 53 53 ARG CA C 53 56.150 56.867 -0.717 1
1 597 . 3 1 1 A 53 53 ARG CB C 53 30.200 30.702 -0.502 1
1 600 . 3 1 1 A 53 53 ARG N N 53 125.250 127.701 -2.451 1
1 601 . 3 1 1 A 54 54 GLY H H 54 8.760 8.879 -0.119 1
1 602 . 3 1 1 A 54 54 GLY HA2 H 54 3.920 3.825 0.095 1
1 603 . 3 1 1 A 54 54 GLY HA3 H 54 4.010 3.827 0.183 1
1 604 . 3 1 1 A 54 54 GLY C C 54 175.110 174.647 0.463 1
1 605 . 3 1 1 A 54 54 GLY CA C 54 46.030 47.136 -1.106 1
1 606 . 3 1 1 A 54 54 GLY N N 54 112.510 111.187 1.323 1
1 607 . 3 1 1 A 55 55 GLY H H 55 8.350 7.967 0.383 1
1 608 . 3 1 1 A 55 55 GLY HA2 H 55 3.980 3.852 0.128 1
1 609 . 3 1 1 A 55 55 GLY HA3 H 55 3.980 3.854 0.126 1
1 610 . 3 1 1 A 55 55 GLY C C 55 173.920 173.555 0.365 1
1 611 . 3 1 1 A 55 55 GLY CA C 55 45.200 47.488 -2.288 1
1 612 . 3 1 1 A 55 55 GLY N N 55 107.940 106.287 1.653 1
1 613 . 3 1 1 A 56 56 GLN H H 56 8.100 8.495 -0.395 1
1 614 . 3 1 1 A 56 56 GLN HA H 56 4.420 4.638 -0.218 1
1 619 . 3 1 1 A 56 56 GLN C C 56 175.570 177.018 -1.448 1
1 620 . 3 1 1 A 56 56 GLN CA C 56 55.420 54.204 1.216 1
1 621 . 3 1 1 A 56 56 GLN CB C 56 30.100 30.966 -0.866 1
1 623 . 3 1 1 A 56 56 GLN N N 56 119.350 123.846 -4.496 1
1 624 . 3 1 1 A 57 57 ARG H H 57 8.520 8.501 0.019 1
1 625 . 3 1 1 A 57 57 ARG HA H 57 4.400 4.056 0.344 1
1 632 . 3 1 1 A 57 57 ARG C C 57 176.210 176.399 -0.189 1
1 633 . 3 1 1 A 57 57 ARG CA C 57 56.440 58.975 -2.535 1
1 634 . 3 1 1 A 57 57 ARG CB C 57 30.930 30.193 0.737 1
1 637 . 3 1 1 A 57 57 ARG N N 57 122.610 122.503 0.107 1
1 638 . 3 1 1 A 58 58 ARG H H 58 8.630 7.657 0.973 1
1 639 . 3 1 1 A 58 58 ARG HA H 58 4.430 4.914 -0.484 1
1 646 . 3 1 1 A 58 58 ARG C C 58 175.950 174.230 1.720 1
1 647 . 3 1 1 A 58 58 ARG CA C 58 55.450 54.526 0.924 1
1 648 . 3 1 1 A 58 58 ARG CB C 58 31.300 33.580 -2.280 1
1 651 . 3 1 1 A 58 58 ARG N N 58 123.320 119.660 3.660 1
1 652 . 3 1 1 A 59 59 LYS H H 59 8.560 8.839 -0.279 1
1 653 . 3 1 1 A 59 59 LYS HA H 59 4.410 4.677 -0.267 1
1 662 . 3 1 1 A 59 59 LYS C C 59 176.590 177.187 -0.597 1
1 663 . 3 1 1 A 59 59 LYS CA C 59 56.720 54.759 1.961 1
1 664 . 3 1 1 A 59 59 LYS CB C 59 33.150 34.092 -0.942 1
1 668 . 3 1 1 A 59 59 LYS N N 59 123.380 126.825 -3.445 1
1 669 . 3 1 1 A 60 60 SER H H 60 8.450 8.644 -0.194 1
1 670 . 3 1 1 A 60 60 SER HA H 60 4.480 4.267 0.213 1
1 673 . 3 1 1 A 60 60 SER C C 60 174.280 175.171 -0.891 1
1 674 . 3 1 1 A 60 60 SER CA C 60 58.140 61.306 -3.166 1
1 675 . 3 1 1 A 60 60 SER CB C 60 64.160 63.296 0.864 1
1 676 . 3 1 1 A 60 60 SER N N 60 117.320 117.241 0.079 1
1 677 . 3 1 1 A 61 61 GLU H H 61 8.550 7.938 0.612 1
1 678 . 3 1 1 A 61 61 GLU HA H 61 4.400 4.326 0.074 1
1 683 . 3 1 1 A 61 61 GLU C C 61 176.150 176.233 -0.083 1
1 684 . 3 1 1 A 61 61 GLU CA C 61 56.300 57.396 -1.096 1
1 685 . 3 1 1 A 61 61 GLU CB C 61 30.790 30.231 0.559 1
1 687 . 3 1 1 A 61 61 GLU N N 61 122.810 120.316 2.494 1
1 688 . 3 1 1 A 62 62 ARG H H 62 8.310 8.673 -0.363 1
1 689 . 3 1 1 A 62 62 ARG HA H 62 4.340 4.931 -0.591 1
1 692 . 3 1 1 A 62 62 ARG C C 62 176.140 175.018 1.122 1
1 693 . 3 1 1 A 62 62 ARG CA C 62 56.230 54.001 2.229 1
1 694 . 3 1 1 A 62 62 ARG CB C 62 30.780 33.322 -2.542 1
1 695 . 3 1 1 A 62 62 ARG N N 62 122.080 122.078 0.002 1
1 696 . 3 1 1 A 63 63 LYS H H 63 8.470 8.680 -0.210 1
1 697 . 3 1 1 A 63 63 LYS HA H 63 4.300 4.241 0.059 1
1 700 . 3 1 1 A 63 63 LYS C C 63 175.490 175.904 -0.414 1
1 701 . 3 1 1 A 63 63 LYS CA C 63 56.200 55.344 0.856 1
1 702 . 3 1 1 A 63 63 LYS CB C 63 30.730 32.085 -1.355 1
1 703 . 3 1 1 A 63 63 LYS N N 63 123.450 122.101 1.349 1
1 704 . 3 1 1 A 64 64 PHE H H 64 8.200 8.254 -0.054 1
1 705 . 3 1 1 A 64 64 PHE HA H 64 4.450 4.141 0.309 1
1 710 . 3 1 1 A 64 64 PHE C C 64 174.250 176.154 -1.904 1
1 711 . 3 1 1 A 64 64 PHE CA C 64 57.430 59.933 -2.503 1
1 712 . 3 1 1 A 64 64 PHE CB C 64 40.330 38.609 1.721 1
1 715 . 3 1 1 A 64 64 PHE N N 64 121.740 124.079 -2.339 1
1 716 . 3 1 1 A 65 65 PHE H H 65 8.130 6.787 1.343 1
1 717 . 3 1 1 A 65 65 PHE HA H 65 4.440 4.917 -0.477 1
1 725 . 3 1 1 A 65 65 PHE CA C 65 55.650 54.568 1.082 1
1 726 . 3 1 1 A 65 65 PHE CB C 65 38.900 38.802 0.098 1
1 731 . 3 1 1 A 65 65 PHE N N 65 120.910 114.116 6.794 1
1 732 . 3 1 1 A 66 66 PRO C C 66 176.780 177.707 -0.927 1
1 733 . 3 1 1 A 67 67 GLY H H 67 9.970 9.374 0.596 1
1 734 . 3 1 1 A 67 67 GLY HA2 H 67 3.820 3.959 -0.139 1
1 735 . 3 1 1 A 67 67 GLY HA3 H 67 4.400 3.987 0.413 1
1 736 . 3 1 1 A 67 67 GLY C C 67 173.670 173.364 0.306 1
1 737 . 3 1 1 A 67 67 GLY CA C 67 45.900 45.615 0.285 1
1 738 . 3 1 1 A 67 67 GLY N N 67 111.550 111.679 -0.129 1
1 739 . 3 1 1 A 68 68 TYR H H 68 7.650 8.123 -0.473 1
1 740 . 3 1 1 A 68 68 TYR HA H 68 5.000 5.014 -0.014 1
1 747 . 3 1 1 A 68 68 TYR C C 68 175.220 174.845 0.375 1
1 748 . 3 1 1 A 68 68 TYR CA C 68 57.940 56.756 1.184 1
1 753 . 3 1 1 A 68 68 TYR N N 68 118.800 118.779 0.021 1
1 754 . 3 1 1 A 69 69 VAL H H 69 9.090 8.912 0.178 1
1 755 . 3 1 1 A 69 69 VAL HA H 69 4.330 4.872 -0.542 1
1 763 . 3 1 1 A 69 69 VAL C C 69 174.250 174.947 -0.697 1
1 764 . 3 1 1 A 69 69 VAL CA C 69 62.120 60.345 1.775 1
1 765 . 3 1 1 A 69 69 VAL CB C 69 35.240 35.873 -0.633 1
1 768 . 3 1 1 A 69 69 VAL N N 69 119.300 122.975 -3.675 1
1 769 . 3 1 1 A 70 70 LEU H H 70 9.190 8.907 0.283 1
1 770 . 3 1 1 A 70 70 LEU HA H 70 5.460 5.421 0.039 1
1 780 . 3 1 1 A 70 70 LEU C C 70 176.130 176.261 -0.131 1
1 781 . 3 1 1 A 70 70 LEU CA C 70 54.120 53.246 0.874 1
1 782 . 3 1 1 A 70 70 LEU CB C 70 43.330 43.276 0.054 1
1 786 . 3 1 1 A 70 70 LEU N N 70 126.710 126.797 -0.087 1
1 787 . 3 1 1 A 71 71 VAL H H 71 9.350 9.512 -0.162 1
1 788 . 3 1 1 A 71 71 VAL HA H 71 5.040 4.799 0.241 1
1 796 . 3 1 1 A 71 71 VAL C C 71 173.670 174.494 -0.824 1
1 797 . 3 1 1 A 71 71 VAL CA C 71 61.090 61.182 -0.092 1
1 798 . 3 1 1 A 71 71 VAL CB C 71 35.800 35.625 0.175 1
1 801 . 3 1 1 A 71 71 VAL N N 71 121.920 124.419 -2.499 1
1 802 . 3 1 1 A 72 72 GLN H H 72 8.390 9.206 -0.816 1
1 803 . 3 1 1 A 72 72 GLN HA H 72 4.610 4.358 0.252 1
1 810 . 3 1 1 A 72 72 GLN C C 72 175.920 174.438 1.482 1
1 811 . 3 1 1 A 72 72 GLN CA C 72 53.810 54.967 -1.157 1
1 812 . 3 1 1 A 72 72 GLN CB C 72 28.850 28.721 0.129 1
1 814 . 3 1 1 A 72 72 GLN N N 72 130.760 128.003 2.757 1
1 816 . 3 1 1 A 73 73 MET H H 73 9.750 8.570 1.180 1
1 817 . 3 1 1 A 73 73 MET HA H 73 5.060 5.201 -0.141 1
1 825 . 3 1 1 A 73 73 MET C C 73 175.500 173.996 1.504 1
1 826 . 3 1 1 A 73 73 MET CA C 73 55.520 54.407 1.113 1
1 827 . 3 1 1 A 73 73 MET CB C 73 35.350 35.727 -0.377 1
1 830 . 3 1 1 A 73 73 MET N N 73 121.070 124.986 -3.916 1
1 831 . 3 1 1 A 74 74 VAL H H 74 8.530 8.354 0.176 1
1 832 . 3 1 1 A 74 74 VAL HA H 74 3.970 4.597 -0.627 1
1 840 . 3 1 1 A 74 74 VAL C C 74 174.900 175.408 -0.508 1
1 841 . 3 1 1 A 74 74 VAL CA C 74 62.150 61.314 0.836 1
1 842 . 3 1 1 A 74 74 VAL CB C 74 32.480 33.240 -0.760 1
1 845 . 3 1 1 A 74 74 VAL N N 74 124.120 121.099 3.021 1
1 846 . 3 1 1 A 75 75 MET H H 75 8.600 8.462 0.138 1
1 847 . 3 1 1 A 75 75 MET HA H 75 4.360 4.639 -0.279 1
1 855 . 3 1 1 A 75 75 MET C C 75 173.480 175.630 -2.150 1
1 856 . 3 1 1 A 75 75 MET CA C 75 53.830 54.798 -0.968 1
1 857 . 3 1 1 A 75 75 MET CB C 75 29.960 33.031 -3.071 1
1 860 . 3 1 1 A 75 75 MET N N 75 128.250 128.051 0.199 1
1 861 . 3 1 1 A 76 76 ASN H H 76 8.410 8.463 -0.053 1
1 862 . 3 1 1 A 76 76 ASN HA H 76 4.540 5.017 -0.477 1
1 867 . 3 1 1 A 76 76 ASN C C 76 173.950 175.154 -1.204 1
1 868 . 3 1 1 A 76 76 ASN CA C 76 51.720 51.411 0.309 1
1 869 . 3 1 1 A 76 76 ASN CB C 76 38.430 41.358 -2.928 1
1 870 . 3 1 1 A 76 76 ASN N N 76 127.500 124.143 3.357 1
1 872 . 3 1 1 A 77 77 ASP H H 77 8.470 9.006 -0.536 1
1 873 . 3 1 1 A 77 77 ASP HA H 77 4.410 4.088 0.322 1
1 876 . 3 1 1 A 77 77 ASP C C 77 178.530 178.193 0.337 1
1 877 . 3 1 1 A 77 77 ASP CA C 77 58.730 57.220 1.510 1
1 878 . 3 1 1 A 77 77 ASP CB C 77 40.940 40.525 0.415 1
1 879 . 3 1 1 A 77 77 ASP N N 77 117.090 121.389 -4.299 1
1 880 . 3 1 1 A 78 78 ALA H H 78 8.160 8.124 0.036 1
1 881 . 3 1 1 A 78 78 ALA HA H 78 4.350 4.130 0.220 1
1 885 . 3 1 1 A 78 78 ALA C C 78 181.250 180.136 1.114 1
1 886 . 3 1 1 A 78 78 ALA CA C 78 55.190 55.391 -0.201 1
1 887 . 3 1 1 A 78 78 ALA CB C 78 18.260 19.096 -0.836 1
1 888 . 3 1 1 A 78 78 ALA N N 78 122.500 123.598 -1.098 1
1 889 . 3 1 1 A 79 79 SER H H 79 9.320 8.380 0.940 1
1 890 . 3 1 1 A 79 79 SER HA H 79 4.290 4.242 0.048 1
1 893 . 3 1 1 A 79 79 SER C C 79 176.570 176.237 0.333 1
1 894 . 3 1 1 A 79 79 SER CA C 79 61.080 62.495 -1.415 1
1 895 . 3 1 1 A 79 79 SER CB C 79 62.200 62.654 -0.454 1
1 896 . 3 1 1 A 79 79 SER N N 79 119.280 114.079 5.201 1
1 897 . 3 1 1 A 80 80 TRP H H 80 8.900 7.976 0.924 1
1 898 . 3 1 1 A 80 80 TRP HA H 80 4.020 4.182 -0.162 1
1 907 . 3 1 1 A 80 80 TRP C C 80 178.210 178.320 -0.110 1
1 908 . 3 1 1 A 80 80 TRP CA C 80 62.490 61.288 1.202 1
1 909 . 3 1 1 A 80 80 TRP CB C 80 29.800 29.327 0.473 1
1 915 . 3 1 1 A 80 80 TRP N N 80 125.870 123.608 2.262 1
1 917 . 3 1 1 A 81 81 HIS H H 81 8.190 8.042 0.148 1
1 918 . 3 1 1 A 81 81 HIS HA H 81 3.930 4.492 -0.562 1
1 923 . 3 1 1 A 81 81 HIS C C 81 177.740 177.759 -0.019 1
1 924 . 3 1 1 A 81 81 HIS CA C 81 61.020 59.965 1.055 1
1 925 . 3 1 1 A 81 81 HIS CB C 81 28.910 29.933 -1.023 1
1 927 . 3 1 1 A 81 81 HIS N N 81 114.080 117.445 -3.365 1
1 928 . 3 1 1 A 82 82 LEU H H 82 8.080 8.288 -0.208 1
1 929 . 3 1 1 A 82 82 LEU HA H 82 3.900 3.842 0.058 1
1 939 . 3 1 1 A 82 82 LEU C C 82 180.330 178.544 1.786 1
1 940 . 3 1 1 A 82 82 LEU CA C 82 58.590 57.807 0.783 1
1 941 . 3 1 1 A 82 82 LEU CB C 82 41.350 41.739 -0.389 1
1 945 . 3 1 1 A 82 82 LEU N N 82 121.320 121.465 -0.145 1
1 946 . 3 1 1 A 83 83 VAL H H 83 8.000 8.054 -0.054 1
1 947 . 3 1 1 A 83 83 VAL HA H 83 3.210 3.434 -0.224 1
1 955 . 3 1 1 A 83 83 VAL C C 83 177.060 178.224 -1.164 1
1 956 . 3 1 1 A 83 83 VAL CA C 83 67.430 66.996 0.434 1
1 957 . 3 1 1 A 83 83 VAL CB C 83 31.680 31.363 0.317 1
1 960 . 3 1 1 A 83 83 VAL N N 83 118.850 119.385 -0.535 1
1 961 . 3 1 1 A 84 84 ARG H H 84 7.540 7.329 0.211 1
1 962 . 3 1 1 A 84 84 ARG HA H 84 3.590 3.858 -0.268 1
1 969 . 3 1 1 A 84 84 ARG C C 84 177.240 178.339 -1.099 1
1 970 . 3 1 1 A 84 84 ARG CA C 84 56.050 59.502 -3.452 1
1 971 . 3 1 1 A 84 84 ARG CB C 84 28.190 29.829 -1.639 1
1 974 . 3 1 1 A 84 84 ARG N N 84 111.460 120.698 -9.238 1
1 975 . 3 1 1 A 85 85 SER H H 85 7.530 8.122 -0.592 1
1 976 . 3 1 1 A 85 85 SER HA H 85 4.280 4.084 0.196 1
1 979 . 3 1 1 A 85 85 SER C C 85 173.930 175.336 -1.406 1
1 980 . 3 1 1 A 85 85 SER CA C 85 59.220 61.408 -2.188 1
1 981 . 3 1 1 A 85 85 SER CB C 85 63.830 62.902 0.928 1
1 982 . 3 1 1 A 85 85 SER N N 85 113.660 114.951 -1.291 1
1 983 . 3 1 1 A 86 86 VAL H H 86 7.230 6.621 0.609 1
1 984 . 3 1 1 A 86 86 VAL HA H 86 3.480 4.329 -0.849 1
1 992 . 3 1 1 A 86 86 VAL CA C 86 61.300 60.382 0.918 1
1 993 . 3 1 1 A 86 86 VAL CB C 86 31.780 32.843 -1.063 1
1 996 . 3 1 1 A 86 86 VAL N N 86 128.120 119.961 8.159 1
1 997 . 3 1 1 A 87 87 PRO HA H 87 4.140 4.437 -0.297 1
1 1004 . 3 1 1 A 87 87 PRO C C 87 176.400 176.580 -0.180 1
1 1005 . 3 1 1 A 87 87 PRO CA C 87 64.100 62.706 1.394 1
1 1006 . 3 1 1 A 87 87 PRO CB C 87 31.710 32.662 -0.952 1
1 1009 . 3 1 1 A 88 88 ARG H H 88 8.320 8.809 -0.489 1
1 1010 . 3 1 1 A 88 88 ARG HA H 88 3.030 4.115 -1.085 1
1 1017 . 3 1 1 A 88 88 ARG C C 88 174.630 174.913 -0.283 1
1 1018 . 3 1 1 A 88 88 ARG CA C 88 57.620 57.961 -0.341 1
1 1019 . 3 1 1 A 88 88 ARG CB C 88 26.960 28.239 -1.279 1
1 1022 . 3 1 1 A 88 88 ARG N N 88 111.360 116.070 -4.710 1
1 1023 . 3 1 1 A 89 89 VAL H H 89 7.390 7.770 -0.380 1
1 1024 . 3 1 1 A 89 89 VAL HA H 89 3.910 4.172 -0.262 1
1 1032 . 3 1 1 A 89 89 VAL C C 89 177.370 175.717 1.653 1
1 1033 . 3 1 1 A 89 89 VAL CA C 89 64.170 61.546 2.624 1
1 1034 . 3 1 1 A 89 89 VAL CB C 89 32.070 33.268 -1.198 1
1 1037 . 3 1 1 A 89 89 VAL N N 89 117.900 118.947 -1.047 1
1 1038 . 3 1 1 A 90 90 MET H H 90 9.290 8.913 0.377 1
1 1039 . 3 1 1 A 90 90 MET HA H 90 4.340 4.070 0.270 1
1 1047 . 3 1 1 A 90 90 MET C C 90 175.800 176.039 -0.239 1
1 1048 . 3 1 1 A 90 90 MET CA C 90 56.440 56.972 -0.532 1
1 1049 . 3 1 1 A 90 90 MET CB C 90 34.160 32.917 1.243 1
1 1052 . 3 1 1 A 90 90 MET N N 90 128.200 126.493 1.707 1
1 1053 . 3 1 1 A 91 91 GLY H H 91 7.130 6.706 0.424 1
1 1054 . 3 1 1 A 91 91 GLY HA2 H 91 3.340 3.938 -0.598 1
1 1055 . 3 1 1 A 91 91 GLY HA3 H 91 4.410 4.039 0.371 1
1 1056 . 3 1 1 A 91 91 GLY C C 91 170.920 171.636 -0.716 1
1 1057 . 3 1 1 A 91 91 GLY CA C 91 44.440 45.460 -1.020 1
1 1058 . 3 1 1 A 91 91 GLY N N 91 104.320 103.891 0.429 1
1 1059 . 3 1 1 A 92 92 PHE H H 92 8.790 8.506 0.284 1
1 1060 . 3 1 1 A 92 92 PHE HA H 92 5.270 5.250 0.020 1
1 1068 . 3 1 1 A 92 92 PHE C C 92 176.230 175.165 1.065 1
1 1069 . 3 1 1 A 92 92 PHE CA C 92 57.480 56.824 0.656 1
1 1070 . 3 1 1 A 92 92 PHE CB C 92 42.190 42.705 -0.515 1
1 1075 . 3 1 1 A 92 92 PHE N N 92 118.770 119.836 -1.066 1
1 1076 . 3 1 1 A 93 93 ILE H H 93 8.800 8.300 0.500 1
1 1077 . 3 1 1 A 93 93 ILE HA H 93 4.310 5.071 -0.761 1
1 1087 . 3 1 1 A 93 93 ILE C C 93 176.380 176.113 0.267 1
1 1088 . 3 1 1 A 93 93 ILE CA C 93 60.480 59.809 0.671 1
1 1089 . 3 1 1 A 93 93 ILE CB C 93 38.010 40.409 -2.399 1
1 1093 . 3 1 1 A 93 93 ILE N N 93 122.300 121.386 0.914 1
1 1094 . 3 1 1 A 94 94 GLY H H 94 8.640 8.375 0.265 1
1 1095 . 3 1 1 A 94 94 GLY HA2 H 94 3.830 4.267 -0.437 1
1 1096 . 3 1 1 A 94 94 GLY HA3 H 94 4.600 4.279 0.321 1
1 1097 . 3 1 1 A 94 94 GLY C C 94 175.080 174.596 0.484 1
1 1098 . 3 1 1 A 94 94 GLY CA C 94 44.530 46.160 -1.630 1
1 1099 . 3 1 1 A 94 94 GLY N N 94 116.550 113.661 2.889 1
1 1100 . 3 1 1 A 95 95 GLY H H 95 8.900 8.773 0.127 1
1 1101 . 3 1 1 A 95 95 GLY HA2 H 95 3.970 3.883 0.087 1
1 1102 . 3 1 1 A 95 95 GLY HA3 H 95 4.370 3.893 0.477 1
1 1103 . 3 1 1 A 95 95 GLY C C 95 174.560 173.937 0.623 1
1 1104 . 3 1 1 A 95 95 GLY CA C 95 45.640 47.168 -1.528 1
1 1105 . 3 1 1 A 95 95 GLY N N 95 112.960 109.227 3.733 1
1 1106 . 3 1 1 A 96 96 THR H H 96 7.830 7.672 0.158 1
1 1107 . 3 1 1 A 96 96 THR HA H 96 4.720 4.824 -0.104 1
1 1112 . 3 1 1 A 96 96 THR C C 96 176.260 174.213 2.047 1
1 1113 . 3 1 1 A 96 96 THR CA C 96 60.360 59.421 0.939 1
1 1114 . 3 1 1 A 96 96 THR CB C 96 70.960 71.993 -1.033 1
1 1116 . 3 1 1 A 96 96 THR N N 96 113.350 110.600 2.750 1
1 1117 . 3 1 1 A 97 97 SER H H 97 8.850 8.853 -0.003 1
1 1118 . 3 1 1 A 97 97 SER HA H 97 4.310 4.617 -0.307 1
1 1121 . 3 1 1 A 97 97 SER C C 97 175.570 174.043 1.527 1
1 1122 . 3 1 1 A 97 97 SER CA C 97 60.850 59.240 1.610 1
1 1123 . 3 1 1 A 97 97 SER CB C 97 63.000 63.182 -0.182 1
1 1124 . 3 1 1 A 97 97 SER N N 97 116.420 116.228 0.192 1
1 1125 . 3 1 1 A 98 98 ASP H H 98 8.360 7.909 0.451 1
1 1126 . 3 1 1 A 98 98 ASP HA H 98 4.310 5.022 -0.712 1
1 1129 . 3 1 1 A 98 98 ASP C C 98 175.380 175.820 -0.440 1
1 1130 . 3 1 1 A 98 98 ASP CA C 98 54.190 54.801 -0.611 1
1 1131 . 3 1 1 A 98 98 ASP CB C 98 40.740 43.349 -2.609 1
1 1132 . 3 1 1 A 98 98 ASP N N 98 116.320 119.482 -3.162 1
1 1133 . 3 1 1 A 99 99 ARG H H 99 7.450 7.445 0.005 1
1 1134 . 3 1 1 A 99 99 ARG HA H 99 4.350 4.688 -0.338 1
1 1141 . 3 1 1 A 99 99 ARG CA C 99 52.920 53.057 -0.137 1
1 1142 . 3 1 1 A 99 99 ARG CB C 99 30.340 32.232 -1.892 1
1 1145 . 3 1 1 A 99 99 ARG N N 99 119.960 119.837 0.123 1
1 1146 . 3 1 1 A 100 100 PRO HA H 100 4.750 4.621 0.129 1
1 1153 . 3 1 1 A 100 100 PRO C C 100 175.220 176.894 -1.674 1
1 1154 . 3 1 1 A 100 100 PRO CA C 100 62.680 62.539 0.141 1
1 1155 . 3 1 1 A 100 100 PRO CB C 100 32.820 31.533 1.287 1
1 1158 . 3 1 1 A 101 101 ALA H H 101 7.210 8.329 -1.119 1
1 1159 . 3 1 1 A 101 101 ALA HA H 101 5.030 4.433 0.597 1
1 1163 . 3 1 1 A 101 101 ALA CA C 101 48.570 50.523 -1.953 1
1 1164 . 3 1 1 A 101 101 ALA CB C 101 19.660 17.710 1.950 1
1 1165 . 3 1 1 A 101 101 ALA N N 101 124.490 125.486 -0.996 1
1 1166 . 3 1 1 A 102 102 PRO HA H 102 4.440 4.947 -0.507 1
1 1173 . 3 1 1 A 102 102 PRO C C 102 177.200 176.615 0.585 1
1 1174 . 3 1 1 A 102 102 PRO CA C 102 62.190 62.949 -0.759 1
1 1175 . 3 1 1 A 102 102 PRO CB C 102 32.310 32.866 -0.556 1
1 1178 . 3 1 1 A 103 103 ILE H H 103 8.550 8.386 0.164 1
1 1179 . 3 1 1 A 103 103 ILE HA H 103 4.630 4.969 -0.339 1
1 1189 . 3 1 1 A 103 103 ILE C C 103 175.460 175.242 0.218 1
1 1190 . 3 1 1 A 103 103 ILE CA C 103 59.730 58.557 1.173 1
1 1191 . 3 1 1 A 103 103 ILE CB C 103 40.140 42.102 -1.962 1
1 1195 . 3 1 1 A 103 103 ILE N N 103 115.670 116.665 -0.995 1
1 1196 . 3 1 1 A 104 104 SER H H 104 8.730 8.675 0.055 1
1 1197 . 3 1 1 A 104 104 SER HA H 104 4.500 4.551 -0.051 1
1 1200 . 3 1 1 A 104 104 SER C C 104 174.840 175.546 -0.706 1
1 1201 . 3 1 1 A 104 104 SER CA C 104 58.010 58.345 -0.335 1
1 1202 . 3 1 1 A 104 104 SER CB C 104 65.470 63.978 1.492 1
1 1203 . 3 1 1 A 104 104 SER N N 104 119.170 120.113 -0.943 1
1 1204 . 3 1 1 A 105 105 ASP H H 105 8.830 9.036 -0.206 1
1 1205 . 3 1 1 A 105 105 ASP HA H 105 4.200 4.252 -0.052 1
1 1208 . 3 1 1 A 105 105 ASP C C 105 178.520 178.384 0.136 1
1 1209 . 3 1 1 A 105 105 ASP CA C 105 57.870 58.014 -0.144 1
1 1210 . 3 1 1 A 105 105 ASP CB C 105 40.040 40.218 -0.178 1
1 1211 . 3 1 1 A 105 105 ASP N N 105 121.640 125.197 -3.557 1
1 1212 . 3 1 1 A 106 106 LYS H H 106 8.130 8.053 0.077 1
1 1213 . 3 1 1 A 106 106 LYS HA H 106 4.100 3.881 0.219 1
1 1222 . 3 1 1 A 106 106 LYS C C 106 179.400 178.707 0.693 1
1 1223 . 3 1 1 A 106 106 LYS CA C 106 58.980 59.761 -0.781 1
1 1224 . 3 1 1 A 106 106 LYS CB C 106 32.330 32.144 0.186 1
1 1228 . 3 1 1 A 106 106 LYS N N 106 118.300 120.770 -2.470 1
1 1229 . 3 1 1 A 107 107 GLU H H 107 7.670 8.069 -0.399 1
1 1230 . 3 1 1 A 107 107 GLU HA H 107 4.020 3.974 0.046 1
1 1235 . 3 1 1 A 107 107 GLU C C 107 178.750 179.219 -0.469 1
1 1236 . 3 1 1 A 107 107 GLU CA C 107 59.210 59.149 0.061 1
1 1237 . 3 1 1 A 107 107 GLU CB C 107 29.780 29.214 0.566 1
1 1239 . 3 1 1 A 107 107 GLU N N 107 121.270 118.418 2.852 1
1 1240 . 3 1 1 A 108 108 VAL H H 108 7.790 7.702 0.088 1
1 1241 . 3 1 1 A 108 108 VAL HA H 108 3.050 3.406 -0.356 1
1 1249 . 3 1 1 A 108 108 VAL C C 108 177.550 177.204 0.346 1
1 1250 . 3 1 1 A 108 108 VAL CA C 108 67.080 66.249 0.831 1
1 1251 . 3 1 1 A 108 108 VAL CB C 108 31.220 31.070 0.150 1
1 1254 . 3 1 1 A 108 108 VAL N N 108 120.940 121.066 -0.126 1
1 1255 . 3 1 1 A 109 109 ASP H H 109 7.840 7.848 -0.008 1
1 1256 . 3 1 1 A 109 109 ASP HA H 109 4.110 4.233 -0.123 1
1 1259 . 3 1 1 A 109 109 ASP C C 109 178.190 178.535 -0.345 1
1 1260 . 3 1 1 A 109 109 ASP CA C 109 57.470 57.097 0.373 1
1 1261 . 3 1 1 A 109 109 ASP CB C 109 40.480 39.914 0.566 1
1 1262 . 3 1 1 A 109 109 ASP N N 109 118.780 120.802 -2.022 1
1 1263 . 3 1 1 A 110 110 ALA H H 110 7.520 7.897 -0.377 1
1 1264 . 3 1 1 A 110 110 ALA HA H 110 4.110 4.044 0.066 1
1 1268 . 3 1 1 A 110 110 ALA C C 110 180.550 179.746 0.804 1
1 1269 . 3 1 1 A 110 110 ALA CA C 110 54.880 55.220 -0.340 1
1 1270 . 3 1 1 A 110 110 ALA CB C 110 18.440 17.857 0.583 1
1 1271 . 3 1 1 A 110 110 ALA N N 110 120.640 122.343 -1.703 1
1 1272 . 3 1 1 A 111 111 ILE H H 111 7.840 7.583 0.257 1
1 1273 . 3 1 1 A 111 111 ILE HA H 111 3.580 3.411 0.169 1
1 1281 . 3 1 1 A 111 111 ILE C C 111 177.470 177.892 -0.422 1
1 1282 . 3 1 1 A 111 111 ILE CA C 111 64.620 64.950 -0.330 1
1 1283 . 3 1 1 A 111 111 ILE CB C 111 38.600 37.617 0.983 1
1 1286 . 3 1 1 A 111 111 ILE N N 111 119.840 118.653 1.187 1
1 1287 . 3 1 1 A 112 112 MET H H 112 8.100 7.660 0.440 1
1 1288 . 3 1 1 A 112 112 MET HA H 112 4.400 4.264 0.136 1
1 1296 . 3 1 1 A 112 112 MET C C 112 177.710 178.451 -0.741 1
1 1297 . 3 1 1 A 112 112 MET CA C 112 55.300 58.703 -3.403 1
1 1298 . 3 1 1 A 112 112 MET CB C 112 30.510 32.457 -1.947 1
1 1301 . 3 1 1 A 112 112 MET N N 112 115.180 118.429 -3.249 1
1 1302 . 3 1 1 A 113 113 ASN H H 113 8.070 8.425 -0.355 1
1 1303 . 3 1 1 A 113 113 ASN HA H 113 4.570 4.441 0.129 1
1 1308 . 3 1 1 A 113 113 ASN C C 113 175.530 177.660 -2.130 1
1 1309 . 3 1 1 A 113 113 ASN CA C 113 54.420 56.299 -1.879 1
1 1310 . 3 1 1 A 113 113 ASN CB C 113 38.350 39.282 -0.932 1
1 1311 . 3 1 1 A 113 113 ASN N N 113 117.190 118.838 -1.648 1
1 1313 . 3 1 1 A 114 114 ARG H H 114 8.070 7.884 0.186 1
1 1314 . 3 1 1 A 114 114 ARG HA H 114 4.280 3.956 0.324 1
1 1321 . 3 1 1 A 114 114 ARG C C 114 176.620 178.588 -1.968 1
1 1322 . 3 1 1 A 114 114 ARG CA C 114 56.910 58.676 -1.766 1
1 1323 . 3 1 1 A 114 114 ARG CB C 114 30.370 30.207 0.163 1
1 1326 . 3 1 1 A 114 114 ARG N N 114 118.360 119.797 -1.437 1
1 1327 . 3 1 1 A 115 115 LEU H H 115 8.100 8.012 0.088 1
1 1328 . 3 1 1 A 115 115 LEU HA H 115 4.310 3.658 0.652 1
1 1338 . 3 1 1 A 115 115 LEU C C 115 177.440 179.358 -1.918 1
1 1339 . 3 1 1 A 115 115 LEU CA C 115 55.440 57.857 -2.417 1
1 1340 . 3 1 1 A 115 115 LEU CB C 115 42.250 41.581 0.669 1
1 1344 . 3 1 1 A 115 115 LEU N N 115 120.580 119.716 0.864 1
1 1345 . 3 1 1 A 116 116 GLN H H 116 8.180 7.493 0.687 1
1 1346 . 3 1 1 A 116 116 GLN HA H 116 4.360 4.066 0.294 1
1 1353 . 3 1 1 A 116 116 GLN C C 116 175.890 176.584 -0.694 1
1 1354 . 3 1 1 A 116 116 GLN CA C 116 55.810 58.990 -3.180 1
1 1355 . 3 1 1 A 116 116 GLN CB C 116 29.500 28.473 1.027 1
1 1357 . 3 1 1 A 116 116 GLN N N 116 119.770 117.082 2.688 1
1 1358 . 3 1 1 A 117 117 GLN H H 117 8.350 7.181 1.169 1
1 1359 . 3 1 1 A 117 117 GLN HA H 117 4.380 4.179 0.201 1
1 1366 . 3 1 1 A 117 117 GLN C C 117 176.130 177.020 -0.890 1
1 1367 . 3 1 1 A 117 117 GLN CA C 117 55.810 56.046 -0.236 1
1 1368 . 3 1 1 A 117 117 GLN CB C 117 29.500 30.258 -0.758 1
1 1370 . 3 1 1 A 117 117 GLN N N 117 121.440 118.609 2.831 1
1 1371 . 3 1 1 A 118 118 VAL H H 118 8.240 8.845 -0.605 1
1 1372 . 3 1 1 A 118 118 VAL HA H 118 4.120 3.791 0.329 1
1 1380 . 3 1 1 A 118 118 VAL C C 118 176.650 176.152 0.498 1
1 1381 . 3 1 1 A 118 118 VAL CA C 118 62.720 64.464 -1.744 1
1 1382 . 3 1 1 A 118 118 VAL CB C 118 32.730 32.136 0.594 1
1 1385 . 3 1 1 A 118 118 VAL N N 118 121.250 125.585 -4.335 1
1 1386 . 3 1 1 A 119 119 GLY H H 119 8.460 7.725 0.735 1
1 1387 . 3 1 1 A 119 119 GLY HA2 H 119 3.990 3.927 0.063 1
1 1388 . 3 1 1 A 119 119 GLY HA3 H 119 3.990 4.010 -0.020 1
1 1389 . 3 1 1 A 119 119 GLY C C 119 173.770 175.127 -1.357 1
1 1390 . 3 1 1 A 119 119 GLY CA C 119 45.260 45.479 -0.219 1
1 1391 . 3 1 1 A 119 119 GLY N N 119 112.300 109.407 2.893 1
1 1392 . 3 1 1 A 120 120 ASP H H 120 8.230 8.331 -0.101 1
1 1393 . 3 1 1 A 120 120 ASP HA H 120 4.580 4.350 0.230 1
1 1396 . 3 1 1 A 120 120 ASP C C 120 175.180 176.302 -1.122 1
1 1397 . 3 1 1 A 120 120 ASP CA C 120 54.340 56.847 -2.507 1
1 1398 . 3 1 1 A 120 120 ASP CB C 120 41.390 40.014 1.376 1
1 1399 . 3 1 1 A 120 120 ASP N N 120 120.420 120.389 0.031 1
1 1400 . 3 1 1 A 121 121 LYS H H 121 7.950 7.850 0.100 1
1 1401 . 3 1 1 A 121 121 LYS HA H 121 4.240 4.661 -0.421 1
1 1402 . 3 1 1 A 121 121 LYS CA C 121 53.620 53.211 0.409 1
1 1403 . 3 1 1 A 121 121 LYS N N 121 119.110 119.140 -0.030 1
1 1404 . 3 1 1 A 122 122 PRO HA H 122 4.410 4.667 -0.257 1
1 1405 . 3 1 1 A 122 122 PRO C C 122 176.560 176.249 0.311 1
1 1406 . 3 1 1 A 122 122 PRO CA C 122 63.130 64.207 -1.077 1
1 2 . 4 1 1 A 2 2 SER H H 2 7.890 8.076 -0.186 1
1 3 . 4 1 1 A 2 2 SER HA H 2 4.270 4.071 0.199 1
1 4 . 4 1 1 A 2 2 SER C C 2 173.960 177.274 -3.314 1
1 5 . 4 1 1 A 2 2 SER CA C 2 60.800 61.445 -0.645 1
1 6 . 4 1 1 A 2 2 SER N N 2 111.940 114.274 -2.334 1
1 7 . 4 1 1 A 3 3 GLU H H 3 8.010 8.048 -0.038 1
1 8 . 4 1 1 A 3 3 GLU HA H 3 4.360 4.149 0.211 1
1 9 . 4 1 1 A 3 3 GLU C C 3 175.710 176.853 -1.143 1
1 10 . 4 1 1 A 3 3 GLU CA C 3 56.310 58.913 -2.603 1
1 11 . 4 1 1 A 3 3 GLU N N 3 121.280 120.876 0.404 1
1 12 . 4 1 1 A 4 4 ALA H H 4 8.540 7.660 0.880 1
1 13 . 4 1 1 A 4 4 ALA HA H 4 4.560 4.703 -0.143 1
1 14 . 4 1 1 A 4 4 ALA CA C 4 50.630 49.403 1.227 1
1 15 . 4 1 1 A 4 4 ALA N N 4 127.840 121.809 6.031 1
1 16 . 4 1 1 A 5 5 PRO HA H 5 4.420 4.615 -0.195 1
1 17 . 4 1 1 A 5 5 PRO C C 5 174.240 176.127 -1.887 1
1 18 . 4 1 1 A 5 5 PRO CA C 5 62.840 62.724 0.116 1
1 19 . 4 1 1 A 6 6 LYS H H 6 8.320 8.451 -0.131 1
1 20 . 4 1 1 A 6 6 LYS HA H 6 4.290 4.826 -0.536 1
1 21 . 4 1 1 A 6 6 LYS C C 6 176.100 175.041 1.059 1
1 22 . 4 1 1 A 6 6 LYS CA C 6 55.540 54.781 0.759 1
1 23 . 4 1 1 A 6 6 LYS N N 6 121.910 121.061 0.849 1
1 24 . 4 1 1 A 7 7 LYS H H 7 8.450 8.462 -0.012 1
1 25 . 4 1 1 A 7 7 LYS HA H 7 3.940 4.935 -0.995 1
1 26 . 4 1 1 A 7 7 LYS C C 7 175.700 175.708 -0.008 1
1 27 . 4 1 1 A 7 7 LYS CA C 7 56.440 55.005 1.435 1
1 28 . 4 1 1 A 7 7 LYS N N 7 122.250 121.961 0.289 1
1 29 . 4 1 1 A 8 8 ARG H H 8 8.210 8.951 -0.741 1
1 30 . 4 1 1 A 8 8 ARG HA H 8 4.670 4.758 -0.088 1
1 31 . 4 1 1 A 8 8 ARG C C 8 173.760 174.403 -0.643 1
1 32 . 4 1 1 A 8 8 ARG CA C 8 53.420 53.978 -0.558 1
1 33 . 4 1 1 A 8 8 ARG N N 8 122.560 123.244 -0.684 1
1 34 . 4 1 1 A 9 9 TRP H H 9 8.610 8.597 0.013 1
1 35 . 4 1 1 A 9 9 TRP HA H 9 4.910 5.426 -0.516 1
1 44 . 4 1 1 A 9 9 TRP C C 9 174.610 175.165 -0.555 1
1 45 . 4 1 1 A 9 9 TRP CA C 9 57.630 55.406 2.224 1
1 46 . 4 1 1 A 9 9 TRP CB C 9 31.020 30.689 0.331 1
1 52 . 4 1 1 A 9 9 TRP N N 9 120.540 119.798 0.742 1
1 54 . 4 1 1 A 10 10 TYR H H 10 9.260 9.063 0.197 1
1 55 . 4 1 1 A 10 10 TYR HA H 10 4.820 5.302 -0.482 1
1 62 . 4 1 1 A 10 10 TYR C C 10 174.340 174.917 -0.577 1
1 63 . 4 1 1 A 10 10 TYR CA C 10 57.050 56.454 0.596 1
1 64 . 4 1 1 A 10 10 TYR CB C 10 41.920 43.621 -1.701 1
1 69 . 4 1 1 A 10 10 TYR N N 10 118.990 121.242 -2.252 1
1 70 . 4 1 1 A 11 11 VAL H H 11 9.450 8.957 0.493 1
1 71 . 4 1 1 A 11 11 VAL HA H 11 4.470 4.726 -0.256 1
1 79 . 4 1 1 A 11 11 VAL C C 11 175.030 175.268 -0.238 1
1 80 . 4 1 1 A 11 11 VAL CA C 11 62.320 61.642 0.678 1
1 81 . 4 1 1 A 11 11 VAL CB C 11 32.400 33.204 -0.804 1
1 84 . 4 1 1 A 11 11 VAL N N 11 120.930 122.658 -1.728 1
1 85 . 4 1 1 A 12 12 VAL H H 12 9.320 9.802 -0.482 1
1 86 . 4 1 1 A 12 12 VAL HA H 12 3.940 4.268 -0.328 1
1 94 . 4 1 1 A 12 12 VAL C C 12 173.870 173.651 0.219 1
1 95 . 4 1 1 A 12 12 VAL CA C 12 61.330 61.028 0.302 1
1 96 . 4 1 1 A 12 12 VAL CB C 12 33.500 34.160 -0.660 1
1 99 . 4 1 1 A 12 12 VAL N N 12 128.860 126.848 2.012 1
1 100 . 4 1 1 A 13 13 GLN H H 13 8.830 8.664 0.166 1
1 101 . 4 1 1 A 13 13 GLN HA H 13 4.710 5.263 -0.553 1
1 108 . 4 1 1 A 13 13 GLN C C 13 174.230 175.175 -0.945 1
1 109 . 4 1 1 A 13 13 GLN CA C 13 54.800 54.730 0.070 1
1 110 . 4 1 1 A 13 13 GLN CB C 13 29.450 29.835 -0.385 1
1 111 . 4 1 1 A 13 13 GLN N N 13 126.050 127.912 -1.862 1
1 113 . 4 1 1 A 14 14 ALA H H 14 9.420 9.880 -0.460 1
1 114 . 4 1 1 A 14 14 ALA HA H 14 5.150 4.764 0.386 1
1 118 . 4 1 1 A 14 14 ALA C C 14 176.400 175.121 1.279 1
1 119 . 4 1 1 A 14 14 ALA CA C 14 49.660 50.990 -1.330 1
1 120 . 4 1 1 A 14 14 ALA CB C 14 22.840 21.244 1.596 1
1 121 . 4 1 1 A 14 14 ALA N N 14 131.620 127.395 4.225 1
1 122 . 4 1 1 A 15 15 PHE H H 15 8.070 8.917 -0.847 1
1 123 . 4 1 1 A 15 15 PHE HA H 15 4.410 5.083 -0.673 1
1 128 . 4 1 1 A 15 15 PHE C C 15 176.130 174.904 1.226 1
1 129 . 4 1 1 A 15 15 PHE CA C 15 58.550 57.102 1.448 1
1 130 . 4 1 1 A 15 15 PHE CB C 15 39.780 40.971 -1.191 1
1 133 . 4 1 1 A 15 15 PHE N N 15 119.680 119.330 0.350 1
1 134 . 4 1 1 A 16 16 SER H H 16 8.370 8.022 0.348 1
1 135 . 4 1 1 A 16 16 SER HA H 16 4.140 4.064 0.076 1
1 138 . 4 1 1 A 16 16 SER C C 16 175.820 174.819 1.001 1
1 139 . 4 1 1 A 16 16 SER CA C 16 60.570 59.671 0.899 1
1 140 . 4 1 1 A 16 16 SER CB C 16 63.030 62.375 0.655 1
1 141 . 4 1 1 A 16 16 SER N N 16 119.700 120.779 -1.079 1
1 142 . 4 1 1 A 17 17 GLY H H 17 9.130 8.857 0.273 1
1 143 . 4 1 1 A 17 17 GLY HA2 H 17 3.640 3.752 -0.112 1
1 144 . 4 1 1 A 17 17 GLY HA3 H 17 4.200 3.931 0.269 1
1 145 . 4 1 1 A 17 17 GLY C C 17 175.520 175.260 0.260 1
1 146 . 4 1 1 A 17 17 GLY CA C 17 45.260 45.215 0.045 1
1 147 . 4 1 1 A 17 17 GLY N N 17 115.850 115.164 0.686 1
1 148 . 4 1 1 A 18 18 PHE H H 18 8.480 8.111 0.369 1
1 149 . 4 1 1 A 18 18 PHE HA H 18 4.740 4.578 0.162 1
1 154 . 4 1 1 A 18 18 PHE C C 18 175.430 176.502 -1.072 1
1 155 . 4 1 1 A 18 18 PHE CA C 18 58.240 58.419 -0.179 1
1 156 . 4 1 1 A 18 18 PHE CB C 18 39.010 38.590 0.420 1
1 159 . 4 1 1 A 18 18 PHE N N 18 118.550 119.940 -1.390 1
1 160 . 4 1 1 A 19 19 GLU H H 19 10.690 8.623 2.067 1
1 161 . 4 1 1 A 19 19 GLU HA H 19 3.490 4.216 -0.726 1
1 166 . 4 1 1 A 19 19 GLU C C 19 177.650 178.820 -1.170 1
1 167 . 4 1 1 A 19 19 GLU CA C 19 62.280 58.773 3.507 1
1 168 . 4 1 1 A 19 19 GLU CB C 19 28.380 29.116 -0.736 1
1 170 . 4 1 1 A 19 19 GLU N N 19 123.470 119.412 4.058 1
1 171 . 4 1 1 A 20 20 GLY H H 20 8.740 8.239 0.501 1
1 172 . 4 1 1 A 20 20 GLY HA2 H 20 3.840 3.785 0.055 1
1 173 . 4 1 1 A 20 20 GLY HA3 H 20 3.940 3.797 0.143 1
1 174 . 4 1 1 A 20 20 GLY C C 20 176.860 175.565 1.295 1
1 175 . 4 1 1 A 20 20 GLY CA C 20 47.140 47.126 0.014 1
1 176 . 4 1 1 A 20 20 GLY N N 20 105.480 108.580 -3.100 1
1 177 . 4 1 1 A 21 21 ARG H H 21 7.690 8.241 -0.551 1
1 178 . 4 1 1 A 21 21 ARG HA H 21 4.180 4.103 0.077 1
1 185 . 4 1 1 A 21 21 ARG C C 21 179.490 178.982 0.508 1
1 186 . 4 1 1 A 21 21 ARG CA C 21 58.660 59.574 -0.914 1
1 187 . 4 1 1 A 21 21 ARG CB C 21 30.100 29.944 0.156 1
1 190 . 4 1 1 A 21 21 ARG N N 21 123.120 122.101 1.019 1
1 191 . 4 1 1 A 22 22 VAL H H 22 8.980 8.200 0.780 1
1 192 . 4 1 1 A 22 22 VAL HA H 22 3.560 3.751 -0.191 1
1 200 . 4 1 1 A 22 22 VAL C C 22 177.320 178.388 -1.068 1
1 201 . 4 1 1 A 22 22 VAL CA C 22 66.960 66.196 0.764 1
1 202 . 4 1 1 A 22 22 VAL CB C 22 31.050 31.608 -0.558 1
1 205 . 4 1 1 A 22 22 VAL N N 22 122.760 120.100 2.660 1
1 206 . 4 1 1 A 23 23 ALA H H 23 8.280 7.827 0.453 1
1 207 . 4 1 1 A 23 23 ALA HA H 23 3.850 4.036 -0.186 1
1 211 . 4 1 1 A 23 23 ALA C C 23 179.340 179.878 -0.538 1
1 212 . 4 1 1 A 23 23 ALA CA C 23 56.260 55.197 1.063 1
1 213 . 4 1 1 A 23 23 ALA CB C 23 18.260 18.080 0.180 1
1 214 . 4 1 1 A 23 23 ALA N N 23 122.120 121.596 0.524 1
1 215 . 4 1 1 A 24 24 THR H H 24 8.020 7.571 0.449 1
1 216 . 4 1 1 A 24 24 THR HA H 24 3.920 3.920 0.000 1
1 221 . 4 1 1 A 24 24 THR C C 24 176.940 176.413 0.527 1
1 222 . 4 1 1 A 24 24 THR CA C 24 66.820 66.445 0.375 1
1 223 . 4 1 1 A 24 24 THR CB C 24 68.930 68.499 0.431 1
1 225 . 4 1 1 A 24 24 THR N N 24 113.410 115.132 -1.722 1
1 226 . 4 1 1 A 25 25 SER H H 25 8.570 8.409 0.161 1
1 227 . 4 1 1 A 25 25 SER HA H 25 4.400 3.941 0.459 1
1 230 . 4 1 1 A 25 25 SER C C 25 177.610 176.028 1.582 1
1 231 . 4 1 1 A 25 25 SER CA C 25 61.920 62.192 -0.272 1
1 232 . 4 1 1 A 25 25 SER CB C 25 63.540 62.968 0.572 1
1 233 . 4 1 1 A 25 25 SER N N 25 118.260 117.701 0.559 1
1 234 . 4 1 1 A 26 26 LEU H H 26 9.430 8.364 1.066 1
1 235 . 4 1 1 A 26 26 LEU HA H 26 3.900 4.201 -0.301 1
1 245 . 4 1 1 A 26 26 LEU C C 26 177.710 178.593 -0.883 1
1 246 . 4 1 1 A 26 26 LEU CA C 26 58.910 57.766 1.144 1
1 247 . 4 1 1 A 26 26 LEU CB C 26 41.300 41.488 -0.188 1
1 251 . 4 1 1 A 26 26 LEU N N 26 124.120 122.814 1.306 1
1 252 . 4 1 1 A 27 27 ARG H H 27 7.790 7.720 0.070 1
1 253 . 4 1 1 A 27 27 ARG HA H 27 3.880 3.643 0.237 1
1 260 . 4 1 1 A 27 27 ARG C C 27 179.380 178.611 0.769 1
1 261 . 4 1 1 A 27 27 ARG CA C 27 60.510 59.464 1.046 1
1 262 . 4 1 1 A 27 27 ARG CB C 27 29.670 29.757 -0.087 1
1 265 . 4 1 1 A 27 27 ARG N N 27 116.710 118.911 -2.201 1
1 266 . 4 1 1 A 28 28 GLU H H 28 7.900 7.523 0.377 1
1 267 . 4 1 1 A 28 28 GLU HA H 28 4.070 3.927 0.143 1
1 272 . 4 1 1 A 28 28 GLU C C 28 179.450 179.069 0.381 1
1 273 . 4 1 1 A 28 28 GLU CA C 28 59.450 58.861 0.589 1
1 274 . 4 1 1 A 28 28 GLU CB C 28 29.610 29.354 0.256 1
1 276 . 4 1 1 A 28 28 GLU N N 28 118.340 118.815 -0.475 1
1 277 . 4 1 1 A 29 29 HIS H H 29 8.940 7.422 1.518 1
1 278 . 4 1 1 A 29 29 HIS HA H 29 4.160 4.481 -0.321 1
1 283 . 4 1 1 A 29 29 HIS C C 29 177.750 177.797 -0.047 1
1 284 . 4 1 1 A 29 29 HIS CA C 29 61.260 59.108 2.152 1
1 285 . 4 1 1 A 29 29 HIS CB C 29 29.870 30.165 -0.295 1
1 287 . 4 1 1 A 29 29 HIS N N 29 120.440 118.406 2.034 1
1 288 . 4 1 1 A 30 30 ILE H H 30 8.580 8.643 -0.063 1
1 289 . 4 1 1 A 30 30 ILE HA H 30 3.160 3.655 -0.495 1
1 299 . 4 1 1 A 30 30 ILE C C 30 177.230 178.146 -0.916 1
1 300 . 4 1 1 A 30 30 ILE CA C 30 66.460 65.345 1.115 1
1 301 . 4 1 1 A 30 30 ILE CB C 30 38.630 37.751 0.879 1
1 305 . 4 1 1 A 30 30 ILE N N 30 121.010 119.833 1.177 1
1 306 . 4 1 1 A 31 31 LYS H H 31 7.020 8.246 -1.226 1
1 307 . 4 1 1 A 31 31 LYS HA H 31 4.170 3.999 0.171 1
1 316 . 4 1 1 A 31 31 LYS C C 31 180.570 178.629 1.941 1
1 317 . 4 1 1 A 31 31 LYS CA C 31 58.920 59.896 -0.976 1
1 318 . 4 1 1 A 31 31 LYS CB C 31 32.490 31.847 0.643 1
1 322 . 4 1 1 A 31 31 LYS N N 31 117.400 121.122 -3.722 1
1 323 . 4 1 1 A 32 32 LEU H H 32 8.400 8.392 0.008 1
1 324 . 4 1 1 A 32 32 LEU HA H 32 3.990 3.953 0.037 1
1 334 . 4 1 1 A 32 32 LEU C C 32 178.230 178.285 -0.055 1
1 335 . 4 1 1 A 32 32 LEU CA C 32 57.700 57.824 -0.124 1
1 336 . 4 1 1 A 32 32 LEU CB C 32 42.540 41.797 0.743 1
1 340 . 4 1 1 A 32 32 LEU N N 32 121.180 119.669 1.511 1
1 341 . 4 1 1 A 33 33 HIS H H 33 7.620 8.615 -0.995 1
1 342 . 4 1 1 A 33 33 HIS HA H 33 4.600 4.646 -0.046 1
1 347 . 4 1 1 A 33 33 HIS C C 33 177.090 174.571 2.519 1
1 348 . 4 1 1 A 33 33 HIS CA C 33 55.840 55.654 0.186 1
1 349 . 4 1 1 A 33 33 HIS CB C 33 29.330 29.907 -0.577 1
1 351 . 4 1 1 A 33 33 HIS N N 33 112.220 115.796 -3.576 1
1 352 . 4 1 1 A 34 34 ASN H H 34 8.030 8.017 0.013 1
1 353 . 4 1 1 A 34 34 ASN HA H 34 4.890 4.386 0.504 1
1 358 . 4 1 1 A 34 34 ASN C C 34 175.910 175.850 0.060 1
1 359 . 4 1 1 A 34 34 ASN CA C 34 54.530 54.066 0.464 1
1 360 . 4 1 1 A 34 34 ASN CB C 34 37.380 37.103 0.277 1
1 361 . 4 1 1 A 34 34 ASN N N 34 117.600 116.663 0.937 1
1 363 . 4 1 1 A 35 35 MET H H 35 8.330 8.661 -0.331 1
1 364 . 4 1 1 A 35 35 MET HA H 35 4.940 4.856 0.084 1
1 372 . 4 1 1 A 35 35 MET C C 35 176.880 176.762 0.118 1
1 373 . 4 1 1 A 35 35 MET CA C 35 55.600 54.373 1.227 1
1 374 . 4 1 1 A 35 35 MET CB C 35 33.790 33.432 0.358 1
1 377 . 4 1 1 A 35 35 MET N N 35 116.190 116.962 -0.772 1
1 378 . 4 1 1 A 36 36 GLU H H 36 9.730 8.211 1.519 1
1 379 . 4 1 1 A 36 36 GLU HA H 36 3.850 4.150 -0.300 1
1 384 . 4 1 1 A 36 36 GLU C C 36 178.290 179.049 -0.759 1
1 385 . 4 1 1 A 36 36 GLU CA C 36 61.280 59.657 1.623 1
1 386 . 4 1 1 A 36 36 GLU CB C 36 29.270 29.136 0.134 1
1 388 . 4 1 1 A 36 36 GLU N N 36 121.630 120.766 0.864 1
1 389 . 4 1 1 A 37 37 ASP H H 37 8.850 8.083 0.767 1
1 390 . 4 1 1 A 37 37 ASP HA H 37 4.470 4.433 0.037 1
1 393 . 4 1 1 A 37 37 ASP C C 37 177.190 178.840 -1.650 1
1 394 . 4 1 1 A 37 37 ASP CA C 37 56.140 57.309 -1.169 1
1 395 . 4 1 1 A 37 37 ASP CB C 37 40.050 40.888 -0.838 1
1 396 . 4 1 1 A 37 37 ASP N N 37 114.390 119.828 -5.438 1
1 397 . 4 1 1 A 38 38 LEU H H 38 7.880 7.802 0.078 1
1 398 . 4 1 1 A 38 38 LEU HA H 38 4.290 4.080 0.210 1
1 408 . 4 1 1 A 38 38 LEU C C 38 175.090 177.603 -2.513 1
1 409 . 4 1 1 A 38 38 LEU CA C 38 54.670 57.936 -3.266 1
1 410 . 4 1 1 A 38 38 LEU CB C 38 42.940 42.038 0.902 1
1 414 . 4 1 1 A 38 38 LEU N N 38 116.550 119.253 -2.703 1
1 415 . 4 1 1 A 39 39 PHE H H 39 7.500 7.705 -0.205 1
1 416 . 4 1 1 A 39 39 PHE HA H 39 4.970 4.502 0.468 1
1 424 . 4 1 1 A 39 39 PHE C C 39 175.380 175.687 -0.307 1
1 425 . 4 1 1 A 39 39 PHE CA C 39 57.580 58.757 -1.177 1
1 426 . 4 1 1 A 39 39 PHE CB C 39 44.990 39.139 5.851 1
1 432 . 4 1 1 A 39 39 PHE N N 39 115.370 117.059 -1.689 1
1 433 . 4 1 1 A 40 40 GLY H H 40 8.680 8.977 -0.297 1
1 434 . 4 1 1 A 40 40 GLY HA2 H 40 3.370 3.961 -0.591 1
1 435 . 4 1 1 A 40 40 GLY HA3 H 40 4.550 4.050 0.500 1
1 436 . 4 1 1 A 40 40 GLY C C 40 173.090 174.181 -1.091 1
1 437 . 4 1 1 A 40 40 GLY CA C 40 44.180 46.278 -2.098 1
1 438 . 4 1 1 A 40 40 GLY N N 40 110.930 111.733 -0.803 1
1 439 . 4 1 1 A 41 41 GLU H H 41 8.320 7.839 0.481 1
1 440 . 4 1 1 A 41 41 GLU HA H 41 4.280 4.898 -0.618 1
1 445 . 4 1 1 A 41 41 GLU C C 41 173.900 174.344 -0.444 1
1 446 . 4 1 1 A 41 41 GLU CA C 41 56.900 55.215 1.685 1
1 447 . 4 1 1 A 41 41 GLU CB C 41 32.110 33.002 -0.892 1
1 449 . 4 1 1 A 41 41 GLU N N 41 126.730 119.201 7.529 1
1 450 . 4 1 1 A 42 42 VAL H H 42 8.100 8.821 -0.721 1
1 451 . 4 1 1 A 42 42 VAL HA H 42 5.160 4.800 0.360 1
1 459 . 4 1 1 A 42 42 VAL C C 42 176.340 174.260 2.080 1
1 460 . 4 1 1 A 42 42 VAL CA C 42 61.200 60.686 0.514 1
1 461 . 4 1 1 A 42 42 VAL CB C 42 34.770 33.717 1.053 1
1 464 . 4 1 1 A 42 42 VAL N N 42 119.360 126.697 -7.337 1
1 465 . 4 1 1 A 43 43 MET H H 43 9.870 10.054 -0.184 1
1 466 . 4 1 1 A 43 43 MET HA H 43 5.070 5.336 -0.266 1
1 474 . 4 1 1 A 43 43 MET C C 43 173.890 174.709 -0.819 1
1 475 . 4 1 1 A 43 43 MET CA C 43 54.740 54.185 0.555 1
1 476 . 4 1 1 A 43 43 MET CB C 43 37.500 35.048 2.452 1
1 479 . 4 1 1 A 43 43 MET N N 43 125.720 127.272 -1.552 1
1 480 . 4 1 1 A 44 44 VAL H H 44 8.800 9.033 -0.233 1
1 481 . 4 1 1 A 44 44 VAL HA H 44 4.720 4.666 0.054 1
1 489 . 4 1 1 A 44 44 VAL CA C 44 59.090 59.243 -0.153 1
1 490 . 4 1 1 A 44 44 VAL CB C 44 33.710 33.078 0.632 1
1 493 . 4 1 1 A 44 44 VAL N N 44 122.340 123.828 -1.488 1
1 494 . 4 1 1 A 45 45 PRO HA H 45 4.480 4.604 -0.124 1
1 501 . 4 1 1 A 45 45 PRO C C 45 177.080 177.108 -0.028 1
1 502 . 4 1 1 A 45 45 PRO CA C 45 63.240 62.775 0.465 1
1 503 . 4 1 1 A 45 45 PRO CB C 45 32.170 32.011 0.159 1
1 506 . 4 1 1 A 46 46 THR H H 46 8.200 8.755 -0.555 1
1 507 . 4 1 1 A 46 46 THR HA H 46 4.290 4.704 -0.414 1
1 512 . 4 1 1 A 46 46 THR C C 46 174.600 174.651 -0.051 1
1 513 . 4 1 1 A 46 46 THR CA C 46 62.100 61.454 0.646 1
1 514 . 4 1 1 A 46 46 THR CB C 46 69.990 70.553 -0.563 1
1 516 . 4 1 1 A 46 46 THR N N 46 113.410 111.174 2.236 1
1 517 . 4 1 1 A 47 47 GLU H H 47 8.380 8.177 0.203 1
1 518 . 4 1 1 A 47 47 GLU HA H 47 4.400 4.048 0.352 1
1 521 . 4 1 1 A 47 47 GLU C C 47 175.970 175.558 0.412 1
1 522 . 4 1 1 A 47 47 GLU CA C 47 55.200 57.355 -2.155 1
1 523 . 4 1 1 A 47 47 GLU CB C 47 32.300 28.188 4.112 1
1 524 . 4 1 1 A 47 47 GLU N N 47 122.830 121.379 1.451 1
1 525 . 4 1 1 A 48 48 GLU H H 48 8.400 8.173 0.227 1
1 526 . 4 1 1 A 48 48 GLU HA H 48 4.280 4.340 -0.060 1
1 531 . 4 1 1 A 48 48 GLU C C 48 175.750 175.421 0.329 1
1 532 . 4 1 1 A 48 48 GLU CA C 48 55.190 56.977 -1.787 1
1 533 . 4 1 1 A 48 48 GLU CB C 48 31.980 30.463 1.517 1
1 535 . 4 1 1 A 48 48 GLU N N 48 121.950 122.588 -0.638 1
1 536 . 4 1 1 A 49 49 VAL H H 49 8.240 8.555 -0.315 1
1 537 . 4 1 1 A 49 49 VAL HA H 49 4.170 4.906 -0.736 1
1 542 . 4 1 1 A 49 49 VAL C C 49 174.610 173.365 1.245 1
1 543 . 4 1 1 A 49 49 VAL CA C 49 62.280 59.830 2.450 1
1 544 . 4 1 1 A 49 49 VAL CB C 49 32.930 35.434 -2.504 1
1 546 . 4 1 1 A 49 49 VAL N N 49 123.990 121.375 2.615 1
1 547 . 4 1 1 A 50 50 VAL H H 50 8.230 8.957 -0.727 1
1 548 . 4 1 1 A 50 50 VAL HA H 50 4.220 4.961 -0.741 1
1 553 . 4 1 1 A 50 50 VAL C C 50 175.770 173.003 2.767 1
1 554 . 4 1 1 A 50 50 VAL CA C 50 62.170 59.675 2.495 1
1 555 . 4 1 1 A 50 50 VAL CB C 50 33.110 35.866 -2.756 1
1 557 . 4 1 1 A 50 50 VAL N N 50 123.960 126.395 -2.435 1
1 558 . 4 1 1 A 51 51 GLU H H 51 8.570 8.938 -0.368 1
1 559 . 4 1 1 A 51 51 GLU HA H 51 4.380 5.114 -0.734 1
1 564 . 4 1 1 A 51 51 GLU C C 51 175.920 174.915 1.005 1
1 565 . 4 1 1 A 51 51 GLU CA C 51 56.050 54.667 1.383 1
1 566 . 4 1 1 A 51 51 GLU CB C 51 31.080 33.431 -2.351 1
1 568 . 4 1 1 A 51 51 GLU N N 51 125.070 127.096 -2.026 1
1 569 . 4 1 1 A 52 52 ILE H H 52 8.320 8.670 -0.350 1
1 570 . 4 1 1 A 52 52 ILE HA H 52 4.290 4.466 -0.176 1
1 580 . 4 1 1 A 52 52 ILE C C 52 176.330 175.670 0.660 1
1 581 . 4 1 1 A 52 52 ILE CA C 52 60.940 60.349 0.591 1
1 582 . 4 1 1 A 52 52 ILE CB C 52 38.510 40.252 -1.742 1
1 586 . 4 1 1 A 52 52 ILE N N 52 122.760 124.121 -1.361 1
1 587 . 4 1 1 A 53 53 ARG H H 53 8.500 9.440 -0.940 1
1 588 . 4 1 1 A 53 53 ARG HA H 53 4.430 4.166 0.264 1
1 595 . 4 1 1 A 53 53 ARG C C 53 176.950 176.000 0.950 1
1 596 . 4 1 1 A 53 53 ARG CA C 53 56.150 57.455 -1.305 1
1 597 . 4 1 1 A 53 53 ARG CB C 53 30.200 29.213 0.987 1
1 600 . 4 1 1 A 53 53 ARG N N 53 125.250 126.855 -1.605 1
1 601 . 4 1 1 A 54 54 GLY H H 54 8.760 8.646 0.114 1
1 602 . 4 1 1 A 54 54 GLY HA2 H 54 3.920 4.137 -0.217 1
1 603 . 4 1 1 A 54 54 GLY HA3 H 54 4.010 4.137 -0.127 1
1 604 . 4 1 1 A 54 54 GLY C C 54 175.110 172.700 2.410 1
1 605 . 4 1 1 A 54 54 GLY CA C 54 46.030 44.533 1.497 1
1 606 . 4 1 1 A 54 54 GLY N N 54 112.510 109.227 3.283 1
1 607 . 4 1 1 A 55 55 GLY H H 55 8.350 8.158 0.192 1
1 608 . 4 1 1 A 55 55 GLY HA2 H 55 3.980 4.238 -0.258 1
1 609 . 4 1 1 A 55 55 GLY HA3 H 55 3.980 4.239 -0.259 1
1 610 . 4 1 1 A 55 55 GLY C C 55 173.920 171.570 2.350 1
1 611 . 4 1 1 A 55 55 GLY CA C 55 45.200 45.842 -0.642 1
1 612 . 4 1 1 A 55 55 GLY N N 55 107.940 107.229 0.711 1
1 613 . 4 1 1 A 56 56 GLN H H 56 8.100 8.485 -0.385 1
1 614 . 4 1 1 A 56 56 GLN HA H 56 4.420 4.948 -0.528 1
1 619 . 4 1 1 A 56 56 GLN C C 56 175.570 176.600 -1.030 1
1 620 . 4 1 1 A 56 56 GLN CA C 56 55.420 54.402 1.018 1
1 621 . 4 1 1 A 56 56 GLN CB C 56 30.100 31.378 -1.278 1
1 623 . 4 1 1 A 56 56 GLN N N 56 119.350 119.282 0.068 1
1 624 . 4 1 1 A 57 57 ARG H H 57 8.520 8.530 -0.010 1
1 625 . 4 1 1 A 57 57 ARG HA H 57 4.400 4.090 0.310 1
1 632 . 4 1 1 A 57 57 ARG C C 57 176.210 176.314 -0.104 1
1 633 . 4 1 1 A 57 57 ARG CA C 57 56.440 58.831 -2.391 1
1 634 . 4 1 1 A 57 57 ARG CB C 57 30.930 30.419 0.511 1
1 637 . 4 1 1 A 57 57 ARG N N 57 122.610 123.398 -0.788 1
1 638 . 4 1 1 A 58 58 ARG H H 58 8.630 7.737 0.893 1
1 639 . 4 1 1 A 58 58 ARG HA H 58 4.430 4.821 -0.391 1
1 646 . 4 1 1 A 58 58 ARG C C 58 175.950 174.223 1.727 1
1 647 . 4 1 1 A 58 58 ARG CA C 58 55.450 54.376 1.074 1
1 648 . 4 1 1 A 58 58 ARG CB C 58 31.300 33.685 -2.385 1
1 651 . 4 1 1 A 58 58 ARG N N 58 123.320 117.496 5.824 1
1 652 . 4 1 1 A 59 59 LYS H H 59 8.560 8.518 0.042 1
1 653 . 4 1 1 A 59 59 LYS HA H 59 4.410 4.616 -0.206 1
1 662 . 4 1 1 A 59 59 LYS C C 59 176.590 175.186 1.404 1
1 663 . 4 1 1 A 59 59 LYS CA C 59 56.720 56.210 0.510 1
1 664 . 4 1 1 A 59 59 LYS CB C 59 33.150 33.337 -0.187 1
1 668 . 4 1 1 A 59 59 LYS N N 59 123.380 123.838 -0.458 1
1 669 . 4 1 1 A 60 60 SER H H 60 8.450 8.952 -0.502 1
1 670 . 4 1 1 A 60 60 SER HA H 60 4.480 5.226 -0.746 1
1 673 . 4 1 1 A 60 60 SER C C 60 174.280 172.939 1.341 1
1 674 . 4 1 1 A 60 60 SER CA C 60 58.140 56.762 1.378 1
1 675 . 4 1 1 A 60 60 SER CB C 60 64.160 65.164 -1.004 1
1 676 . 4 1 1 A 60 60 SER N N 60 117.320 120.978 -3.658 1
1 677 . 4 1 1 A 61 61 GLU H H 61 8.550 8.720 -0.170 1
1 678 . 4 1 1 A 61 61 GLU HA H 61 4.400 4.614 -0.214 1
1 683 . 4 1 1 A 61 61 GLU C C 61 176.150 176.669 -0.519 1
1 684 . 4 1 1 A 61 61 GLU CA C 61 56.300 54.702 1.598 1
1 685 . 4 1 1 A 61 61 GLU CB C 61 30.790 32.476 -1.686 1
1 687 . 4 1 1 A 61 61 GLU N N 61 122.810 125.580 -2.770 1
1 688 . 4 1 1 A 62 62 ARG H H 62 8.310 8.792 -0.482 1
1 689 . 4 1 1 A 62 62 ARG HA H 62 4.340 3.587 0.753 1
1 692 . 4 1 1 A 62 62 ARG C C 62 176.140 175.741 0.399 1
1 693 . 4 1 1 A 62 62 ARG CA C 62 56.230 59.349 -3.119 1
1 694 . 4 1 1 A 62 62 ARG CB C 62 30.780 30.090 0.690 1
1 695 . 4 1 1 A 62 62 ARG N N 62 122.080 123.703 -1.623 1
1 696 . 4 1 1 A 63 63 LYS H H 63 8.470 7.654 0.816 1
1 697 . 4 1 1 A 63 63 LYS HA H 63 4.300 3.795 0.505 1
1 700 . 4 1 1 A 63 63 LYS C C 63 175.490 176.175 -0.685 1
1 701 . 4 1 1 A 63 63 LYS CA C 63 56.200 57.055 -0.855 1
1 702 . 4 1 1 A 63 63 LYS CB C 63 30.730 29.712 1.018 1
1 703 . 4 1 1 A 63 63 LYS N N 63 123.450 115.696 7.754 1
1 704 . 4 1 1 A 64 64 PHE H H 64 8.200 7.726 0.474 1
1 705 . 4 1 1 A 64 64 PHE HA H 64 4.450 4.066 0.384 1
1 710 . 4 1 1 A 64 64 PHE C C 64 174.250 175.490 -1.240 1
1 711 . 4 1 1 A 64 64 PHE CA C 64 57.430 59.954 -2.524 1
1 712 . 4 1 1 A 64 64 PHE CB C 64 40.330 38.621 1.709 1
1 715 . 4 1 1 A 64 64 PHE N N 64 121.740 117.601 4.139 1
1 716 . 4 1 1 A 65 65 PHE H H 65 8.130 8.007 0.123 1
1 717 . 4 1 1 A 65 65 PHE HA H 65 4.440 4.859 -0.419 1
1 725 . 4 1 1 A 65 65 PHE CA C 65 55.650 55.057 0.593 1
1 726 . 4 1 1 A 65 65 PHE CB C 65 38.900 39.423 -0.523 1
1 731 . 4 1 1 A 65 65 PHE N N 65 120.910 116.452 4.458 1
1 732 . 4 1 1 A 66 66 PRO C C 66 176.780 177.900 -1.120 1
1 733 . 4 1 1 A 67 67 GLY H H 67 9.970 8.812 1.158 1
1 734 . 4 1 1 A 67 67 GLY HA2 H 67 3.820 4.044 -0.224 1
1 735 . 4 1 1 A 67 67 GLY HA3 H 67 4.400 4.052 0.348 1
1 736 . 4 1 1 A 67 67 GLY C C 67 173.670 174.277 -0.607 1
1 737 . 4 1 1 A 67 67 GLY CA C 67 45.900 46.326 -0.426 1
1 738 . 4 1 1 A 67 67 GLY N N 67 111.550 112.911 -1.361 1
1 739 . 4 1 1 A 68 68 TYR H H 68 7.650 7.953 -0.303 1
1 740 . 4 1 1 A 68 68 TYR HA H 68 5.000 4.857 0.143 1
1 747 . 4 1 1 A 68 68 TYR C C 68 175.220 174.810 0.410 1
1 748 . 4 1 1 A 68 68 TYR CA C 68 57.940 56.885 1.055 1
1 753 . 4 1 1 A 68 68 TYR N N 68 118.800 118.325 0.475 1
1 754 . 4 1 1 A 69 69 VAL H H 69 9.090 9.004 0.086 1
1 755 . 4 1 1 A 69 69 VAL HA H 69 4.330 4.705 -0.375 1
1 763 . 4 1 1 A 69 69 VAL C C 69 174.250 174.726 -0.476 1
1 764 . 4 1 1 A 69 69 VAL CA C 69 62.120 60.215 1.905 1
1 765 . 4 1 1 A 69 69 VAL CB C 69 35.240 35.694 -0.454 1
1 768 . 4 1 1 A 69 69 VAL N N 69 119.300 122.729 -3.429 1
1 769 . 4 1 1 A 70 70 LEU H H 70 9.190 8.873 0.317 1
1 770 . 4 1 1 A 70 70 LEU HA H 70 5.460 5.370 0.090 1
1 780 . 4 1 1 A 70 70 LEU C C 70 176.130 176.108 0.022 1
1 781 . 4 1 1 A 70 70 LEU CA C 70 54.120 53.238 0.882 1
1 782 . 4 1 1 A 70 70 LEU CB C 70 43.330 43.218 0.112 1
1 786 . 4 1 1 A 70 70 LEU N N 70 126.710 126.673 0.037 1
1 787 . 4 1 1 A 71 71 VAL H H 71 9.350 9.476 -0.126 1
1 788 . 4 1 1 A 71 71 VAL HA H 71 5.040 4.900 0.140 1
1 796 . 4 1 1 A 71 71 VAL C C 71 173.670 174.520 -0.850 1
1 797 . 4 1 1 A 71 71 VAL CA C 71 61.090 61.188 -0.098 1
1 798 . 4 1 1 A 71 71 VAL CB C 71 35.800 35.505 0.295 1
1 801 . 4 1 1 A 71 71 VAL N N 71 121.920 124.757 -2.837 1
1 802 . 4 1 1 A 72 72 GLN H H 72 8.390 8.456 -0.066 1
1 803 . 4 1 1 A 72 72 GLN HA H 72 4.610 4.348 0.262 1
1 810 . 4 1 1 A 72 72 GLN C C 72 175.920 174.335 1.585 1
1 811 . 4 1 1 A 72 72 GLN CA C 72 53.810 54.850 -1.040 1
1 812 . 4 1 1 A 72 72 GLN CB C 72 28.850 28.273 0.577 1
1 814 . 4 1 1 A 72 72 GLN N N 72 130.760 127.577 3.183 1
1 816 . 4 1 1 A 73 73 MET H H 73 9.750 8.927 0.823 1
1 817 . 4 1 1 A 73 73 MET HA H 73 5.060 5.205 -0.145 1
1 825 . 4 1 1 A 73 73 MET C C 73 175.500 174.450 1.050 1
1 826 . 4 1 1 A 73 73 MET CA C 73 55.520 54.213 1.307 1
1 827 . 4 1 1 A 73 73 MET CB C 73 35.350 35.694 -0.344 1
1 830 . 4 1 1 A 73 73 MET N N 73 121.070 125.113 -4.043 1
1 831 . 4 1 1 A 74 74 VAL H H 74 8.530 8.582 -0.052 1
1 832 . 4 1 1 A 74 74 VAL HA H 74 3.970 4.486 -0.516 1
1 840 . 4 1 1 A 74 74 VAL C C 74 174.900 175.885 -0.985 1
1 841 . 4 1 1 A 74 74 VAL CA C 74 62.150 61.632 0.518 1
1 842 . 4 1 1 A 74 74 VAL CB C 74 32.480 32.764 -0.284 1
1 845 . 4 1 1 A 74 74 VAL N N 74 124.120 122.653 1.467 1
1 846 . 4 1 1 A 75 75 MET H H 75 8.600 8.558 0.042 1
1 847 . 4 1 1 A 75 75 MET HA H 75 4.360 4.666 -0.306 1
1 855 . 4 1 1 A 75 75 MET C C 75 173.480 175.542 -2.062 1
1 856 . 4 1 1 A 75 75 MET CA C 75 53.830 53.895 -0.065 1
1 857 . 4 1 1 A 75 75 MET CB C 75 29.960 32.841 -2.881 1
1 860 . 4 1 1 A 75 75 MET N N 75 128.250 124.227 4.023 1
1 861 . 4 1 1 A 76 76 ASN H H 76 8.410 7.966 0.444 1
1 862 . 4 1 1 A 76 76 ASN HA H 76 4.540 4.965 -0.425 1
1 867 . 4 1 1 A 76 76 ASN C C 76 173.950 175.132 -1.182 1
1 868 . 4 1 1 A 76 76 ASN CA C 76 51.720 51.433 0.287 1
1 869 . 4 1 1 A 76 76 ASN CB C 76 38.430 41.628 -3.198 1
1 870 . 4 1 1 A 76 76 ASN N N 76 127.500 122.590 4.910 1
1 872 . 4 1 1 A 77 77 ASP H H 77 8.470 8.961 -0.491 1
1 873 . 4 1 1 A 77 77 ASP HA H 77 4.410 4.086 0.324 1
1 876 . 4 1 1 A 77 77 ASP C C 77 178.530 178.201 0.329 1
1 877 . 4 1 1 A 77 77 ASP CA C 77 58.730 56.730 2.000 1
1 878 . 4 1 1 A 77 77 ASP CB C 77 40.940 40.385 0.555 1
1 879 . 4 1 1 A 77 77 ASP N N 77 117.090 121.133 -4.043 1
1 880 . 4 1 1 A 78 78 ALA H H 78 8.160 8.080 0.080 1
1 881 . 4 1 1 A 78 78 ALA HA H 78 4.350 4.154 0.196 1
1 885 . 4 1 1 A 78 78 ALA C C 78 181.250 179.936 1.314 1
1 886 . 4 1 1 A 78 78 ALA CA C 78 55.190 55.217 -0.027 1
1 887 . 4 1 1 A 78 78 ALA CB C 78 18.260 19.118 -0.858 1
1 888 . 4 1 1 A 78 78 ALA N N 78 122.500 123.209 -0.709 1
1 889 . 4 1 1 A 79 79 SER H H 79 9.320 8.603 0.717 1
1 890 . 4 1 1 A 79 79 SER HA H 79 4.290 4.292 -0.002 1
1 893 . 4 1 1 A 79 79 SER C C 79 176.570 176.475 0.095 1
1 894 . 4 1 1 A 79 79 SER CA C 79 61.080 61.496 -0.416 1
1 895 . 4 1 1 A 79 79 SER CB C 79 62.200 62.099 0.101 1
1 896 . 4 1 1 A 79 79 SER N N 79 119.280 111.930 7.350 1
1 897 . 4 1 1 A 80 80 TRP H H 80 8.900 8.062 0.838 1
1 898 . 4 1 1 A 80 80 TRP HA H 80 4.020 4.202 -0.182 1
1 907 . 4 1 1 A 80 80 TRP C C 80 178.210 178.783 -0.573 1
1 908 . 4 1 1 A 80 80 TRP CA C 80 62.490 61.384 1.106 1
1 909 . 4 1 1 A 80 80 TRP CB C 80 29.800 29.456 0.344 1
1 915 . 4 1 1 A 80 80 TRP N N 80 125.870 123.367 2.503 1
1 917 . 4 1 1 A 81 81 HIS H H 81 8.190 7.703 0.487 1
1 918 . 4 1 1 A 81 81 HIS HA H 81 3.930 4.447 -0.517 1
1 923 . 4 1 1 A 81 81 HIS C C 81 177.740 177.800 -0.060 1
1 924 . 4 1 1 A 81 81 HIS CA C 81 61.020 59.713 1.307 1
1 925 . 4 1 1 A 81 81 HIS CB C 81 28.910 31.002 -2.092 1
1 927 . 4 1 1 A 81 81 HIS N N 81 114.080 116.701 -2.621 1
1 928 . 4 1 1 A 82 82 LEU H H 82 8.080 8.155 -0.075 1
1 929 . 4 1 1 A 82 82 LEU HA H 82 3.900 3.800 0.100 1
1 939 . 4 1 1 A 82 82 LEU C C 82 180.330 178.609 1.721 1
1 940 . 4 1 1 A 82 82 LEU CA C 82 58.590 58.147 0.443 1
1 941 . 4 1 1 A 82 82 LEU CB C 82 41.350 41.619 -0.269 1
1 945 . 4 1 1 A 82 82 LEU N N 82 121.320 121.609 -0.289 1
1 946 . 4 1 1 A 83 83 VAL H H 83 8.000 8.284 -0.284 1
1 947 . 4 1 1 A 83 83 VAL HA H 83 3.210 3.415 -0.205 1
1 955 . 4 1 1 A 83 83 VAL C C 83 177.060 177.974 -0.914 1
1 956 . 4 1 1 A 83 83 VAL CA C 83 67.430 66.888 0.542 1
1 957 . 4 1 1 A 83 83 VAL CB C 83 31.680 31.248 0.432 1
1 960 . 4 1 1 A 83 83 VAL N N 83 118.850 119.363 -0.513 1
1 961 . 4 1 1 A 84 84 ARG H H 84 7.540 7.484 0.056 1
1 962 . 4 1 1 A 84 84 ARG HA H 84 3.590 3.810 -0.220 1
1 969 . 4 1 1 A 84 84 ARG C C 84 177.240 178.647 -1.407 1
1 970 . 4 1 1 A 84 84 ARG CA C 84 56.050 59.755 -3.705 1
1 971 . 4 1 1 A 84 84 ARG CB C 84 28.190 29.576 -1.386 1
1 974 . 4 1 1 A 84 84 ARG N N 84 111.460 120.180 -8.720 1
1 975 . 4 1 1 A 85 85 SER H H 85 7.530 7.792 -0.262 1
1 976 . 4 1 1 A 85 85 SER HA H 85 4.280 4.105 0.175 1
1 979 . 4 1 1 A 85 85 SER C C 85 173.930 175.319 -1.389 1
1 980 . 4 1 1 A 85 85 SER CA C 85 59.220 62.248 -3.028 1
1 981 . 4 1 1 A 85 85 SER CB C 85 63.830 62.777 1.053 1
1 982 . 4 1 1 A 85 85 SER N N 85 113.660 114.766 -1.106 1
1 983 . 4 1 1 A 86 86 VAL H H 86 7.230 7.410 -0.180 1
1 984 . 4 1 1 A 86 86 VAL HA H 86 3.480 3.702 -0.222 1
1 992 . 4 1 1 A 86 86 VAL CA C 86 61.300 61.260 0.040 1
1 993 . 4 1 1 A 86 86 VAL CB C 86 31.780 32.001 -0.221 1
1 996 . 4 1 1 A 86 86 VAL N N 86 128.120 121.894 6.226 1
1 997 . 4 1 1 A 87 87 PRO HA H 87 4.140 4.360 -0.220 1
1 1004 . 4 1 1 A 87 87 PRO C C 87 176.400 176.741 -0.341 1
1 1005 . 4 1 1 A 87 87 PRO CA C 87 64.100 63.311 0.789 1
1 1006 . 4 1 1 A 87 87 PRO CB C 87 31.710 32.293 -0.583 1
1 1009 . 4 1 1 A 88 88 ARG H H 88 8.320 8.720 -0.400 1
1 1010 . 4 1 1 A 88 88 ARG HA H 88 3.030 3.826 -0.796 1
1 1017 . 4 1 1 A 88 88 ARG C C 88 174.630 174.538 0.092 1
1 1018 . 4 1 1 A 88 88 ARG CA C 88 57.620 57.342 0.278 1
1 1019 . 4 1 1 A 88 88 ARG CB C 88 26.960 27.753 -0.793 1
1 1022 . 4 1 1 A 88 88 ARG N N 88 111.360 116.071 -4.711 1
1 1023 . 4 1 1 A 89 89 VAL H H 89 7.390 7.801 -0.411 1
1 1024 . 4 1 1 A 89 89 VAL HA H 89 3.910 4.535 -0.625 1
1 1032 . 4 1 1 A 89 89 VAL C C 89 177.370 175.395 1.975 1
1 1033 . 4 1 1 A 89 89 VAL CA C 89 64.170 59.593 4.577 1
1 1034 . 4 1 1 A 89 89 VAL CB C 89 32.070 34.590 -2.520 1
1 1037 . 4 1 1 A 89 89 VAL N N 89 117.900 118.461 -0.561 1
1 1038 . 4 1 1 A 90 90 MET H H 90 9.290 9.136 0.154 1
1 1039 . 4 1 1 A 90 90 MET HA H 90 4.340 4.331 0.009 1
1 1047 . 4 1 1 A 90 90 MET C C 90 175.800 176.186 -0.386 1
1 1048 . 4 1 1 A 90 90 MET CA C 90 56.440 57.274 -0.834 1
1 1049 . 4 1 1 A 90 90 MET CB C 90 34.160 33.497 0.663 1
1 1052 . 4 1 1 A 90 90 MET N N 90 128.200 127.702 0.498 1
1 1053 . 4 1 1 A 91 91 GLY H H 91 7.130 6.937 0.193 1
1 1054 . 4 1 1 A 91 91 GLY HA2 H 91 3.340 3.917 -0.577 1
1 1055 . 4 1 1 A 91 91 GLY HA3 H 91 4.410 4.038 0.372 1
1 1056 . 4 1 1 A 91 91 GLY C C 91 170.920 171.670 -0.750 1
1 1057 . 4 1 1 A 91 91 GLY CA C 91 44.440 45.798 -1.358 1
1 1058 . 4 1 1 A 91 91 GLY N N 91 104.320 103.748 0.572 1
1 1059 . 4 1 1 A 92 92 PHE H H 92 8.790 8.554 0.236 1
1 1060 . 4 1 1 A 92 92 PHE HA H 92 5.270 5.013 0.257 1
1 1068 . 4 1 1 A 92 92 PHE C C 92 176.230 175.205 1.025 1
1 1069 . 4 1 1 A 92 92 PHE CA C 92 57.480 57.287 0.193 1
1 1070 . 4 1 1 A 92 92 PHE CB C 92 42.190 41.977 0.213 1
1 1075 . 4 1 1 A 92 92 PHE N N 92 118.770 120.067 -1.297 1
1 1076 . 4 1 1 A 93 93 ILE H H 93 8.800 8.372 0.428 1
1 1077 . 4 1 1 A 93 93 ILE HA H 93 4.310 4.978 -0.668 1
1 1087 . 4 1 1 A 93 93 ILE C C 93 176.380 176.005 0.375 1
1 1088 . 4 1 1 A 93 93 ILE CA C 93 60.480 59.757 0.723 1
1 1089 . 4 1 1 A 93 93 ILE CB C 93 38.010 40.325 -2.315 1
1 1093 . 4 1 1 A 93 93 ILE N N 93 122.300 121.295 1.005 1
1 1094 . 4 1 1 A 94 94 GLY H H 94 8.640 8.387 0.253 1
1 1095 . 4 1 1 A 94 94 GLY HA2 H 94 3.830 4.362 -0.532 1
1 1096 . 4 1 1 A 94 94 GLY HA3 H 94 4.600 4.365 0.235 1
1 1097 . 4 1 1 A 94 94 GLY C C 94 175.080 174.488 0.592 1
1 1098 . 4 1 1 A 94 94 GLY CA C 94 44.530 46.223 -1.693 1
1 1099 . 4 1 1 A 94 94 GLY N N 94 116.550 114.156 2.394 1
1 1100 . 4 1 1 A 95 95 GLY H H 95 8.900 8.772 0.128 1
1 1101 . 4 1 1 A 95 95 GLY HA2 H 95 3.970 3.932 0.038 1
1 1102 . 4 1 1 A 95 95 GLY HA3 H 95 4.370 3.940 0.430 1
1 1103 . 4 1 1 A 95 95 GLY C C 95 174.560 173.895 0.665 1
1 1104 . 4 1 1 A 95 95 GLY CA C 95 45.640 46.875 -1.235 1
1 1105 . 4 1 1 A 95 95 GLY N N 95 112.960 110.537 2.423 1
1 1106 . 4 1 1 A 96 96 THR H H 96 7.830 7.752 0.078 1
1 1107 . 4 1 1 A 96 96 THR HA H 96 4.720 4.862 -0.142 1
1 1112 . 4 1 1 A 96 96 THR C C 96 176.260 173.412 2.848 1
1 1113 . 4 1 1 A 96 96 THR CA C 96 60.360 60.130 0.230 1
1 1114 . 4 1 1 A 96 96 THR CB C 96 70.960 71.154 -0.194 1
1 1116 . 4 1 1 A 96 96 THR N N 96 113.350 113.145 0.205 1
1 1117 . 4 1 1 A 97 97 SER H H 97 8.850 8.889 -0.039 1
1 1118 . 4 1 1 A 97 97 SER HA H 97 4.310 4.677 -0.367 1
1 1121 . 4 1 1 A 97 97 SER C C 97 175.570 174.807 0.763 1
1 1122 . 4 1 1 A 97 97 SER CA C 97 60.850 58.490 2.360 1
1 1123 . 4 1 1 A 97 97 SER CB C 97 63.000 63.547 -0.547 1
1 1124 . 4 1 1 A 97 97 SER N N 97 116.420 118.671 -2.251 1
1 1125 . 4 1 1 A 98 98 ASP H H 98 8.360 8.524 -0.164 1
1 1126 . 4 1 1 A 98 98 ASP HA H 98 4.310 5.156 -0.846 1
1 1129 . 4 1 1 A 98 98 ASP C C 98 175.380 175.377 0.003 1
1 1130 . 4 1 1 A 98 98 ASP CA C 98 54.190 53.286 0.904 1
1 1131 . 4 1 1 A 98 98 ASP CB C 98 40.740 42.092 -1.352 1
1 1132 . 4 1 1 A 98 98 ASP N N 98 116.320 119.091 -2.771 1
1 1133 . 4 1 1 A 99 99 ARG H H 99 7.450 7.764 -0.314 1
1 1134 . 4 1 1 A 99 99 ARG HA H 99 4.350 4.591 -0.241 1
1 1141 . 4 1 1 A 99 99 ARG CA C 99 52.920 53.658 -0.738 1
1 1142 . 4 1 1 A 99 99 ARG CB C 99 30.340 31.384 -1.044 1
1 1145 . 4 1 1 A 99 99 ARG N N 99 119.960 119.901 0.059 1
1 1146 . 4 1 1 A 100 100 PRO HA H 100 4.750 4.572 0.178 1
1 1153 . 4 1 1 A 100 100 PRO C C 100 175.220 177.086 -1.866 1
1 1154 . 4 1 1 A 100 100 PRO CA C 100 62.680 62.736 -0.056 1
1 1155 . 4 1 1 A 100 100 PRO CB C 100 32.820 31.870 0.950 1
1 1158 . 4 1 1 A 101 101 ALA H H 101 7.210 8.365 -1.155 1
1 1159 . 4 1 1 A 101 101 ALA HA H 101 5.030 4.573 0.457 1
1 1163 . 4 1 1 A 101 101 ALA CA C 101 48.570 50.496 -1.926 1
1 1164 . 4 1 1 A 101 101 ALA CB C 101 19.660 17.585 2.075 1
1 1165 . 4 1 1 A 101 101 ALA N N 101 124.490 125.064 -0.574 1
1 1166 . 4 1 1 A 102 102 PRO HA H 102 4.440 4.464 -0.024 1
1 1173 . 4 1 1 A 102 102 PRO C C 102 177.200 176.477 0.723 1
1 1174 . 4 1 1 A 102 102 PRO CA C 102 62.190 62.721 -0.531 1
1 1175 . 4 1 1 A 102 102 PRO CB C 102 32.310 32.735 -0.425 1
1 1178 . 4 1 1 A 103 103 ILE H H 103 8.550 8.134 0.416 1
1 1179 . 4 1 1 A 103 103 ILE HA H 103 4.630 4.924 -0.294 1
1 1189 . 4 1 1 A 103 103 ILE C C 103 175.460 175.236 0.224 1
1 1190 . 4 1 1 A 103 103 ILE CA C 103 59.730 58.479 1.251 1
1 1191 . 4 1 1 A 103 103 ILE CB C 103 40.140 42.073 -1.933 1
1 1195 . 4 1 1 A 103 103 ILE N N 103 115.670 116.469 -0.799 1
1 1196 . 4 1 1 A 104 104 SER H H 104 8.730 8.762 -0.032 1
1 1197 . 4 1 1 A 104 104 SER HA H 104 4.500 4.530 -0.030 1
1 1200 . 4 1 1 A 104 104 SER C C 104 174.840 175.279 -0.439 1
1 1201 . 4 1 1 A 104 104 SER CA C 104 58.010 58.507 -0.497 1
1 1202 . 4 1 1 A 104 104 SER CB C 104 65.470 64.032 1.438 1
1 1203 . 4 1 1 A 104 104 SER N N 104 119.170 120.183 -1.013 1
1 1204 . 4 1 1 A 105 105 ASP H H 105 8.830 8.958 -0.128 1
1 1205 . 4 1 1 A 105 105 ASP HA H 105 4.200 4.187 0.013 1
1 1208 . 4 1 1 A 105 105 ASP C C 105 178.520 178.316 0.204 1
1 1209 . 4 1 1 A 105 105 ASP CA C 105 57.870 57.949 -0.079 1
1 1210 . 4 1 1 A 105 105 ASP CB C 105 40.040 40.338 -0.298 1
1 1211 . 4 1 1 A 105 105 ASP N N 105 121.640 125.313 -3.673 1
1 1212 . 4 1 1 A 106 106 LYS H H 106 8.130 7.999 0.131 1
1 1213 . 4 1 1 A 106 106 LYS HA H 106 4.100 3.897 0.203 1
1 1222 . 4 1 1 A 106 106 LYS C C 106 179.400 178.697 0.703 1
1 1223 . 4 1 1 A 106 106 LYS CA C 106 58.980 59.659 -0.679 1
1 1224 . 4 1 1 A 106 106 LYS CB C 106 32.330 32.244 0.086 1
1 1228 . 4 1 1 A 106 106 LYS N N 106 118.300 120.719 -2.419 1
1 1229 . 4 1 1 A 107 107 GLU H H 107 7.670 8.192 -0.522 1
1 1230 . 4 1 1 A 107 107 GLU HA H 107 4.020 4.021 -0.001 1
1 1235 . 4 1 1 A 107 107 GLU C C 107 178.750 179.320 -0.570 1
1 1236 . 4 1 1 A 107 107 GLU CA C 107 59.210 59.167 0.043 1
1 1237 . 4 1 1 A 107 107 GLU CB C 107 29.780 29.482 0.298 1
1 1239 . 4 1 1 A 107 107 GLU N N 107 121.270 119.152 2.118 1
1 1240 . 4 1 1 A 108 108 VAL H H 108 7.790 7.720 0.070 1
1 1241 . 4 1 1 A 108 108 VAL HA H 108 3.050 3.393 -0.343 1
1 1249 . 4 1 1 A 108 108 VAL C C 108 177.550 177.599 -0.049 1
1 1250 . 4 1 1 A 108 108 VAL CA C 108 67.080 66.203 0.877 1
1 1251 . 4 1 1 A 108 108 VAL CB C 108 31.220 31.006 0.214 1
1 1254 . 4 1 1 A 108 108 VAL N N 108 120.940 120.967 -0.027 1
1 1255 . 4 1 1 A 109 109 ASP H H 109 7.840 7.709 0.131 1
1 1256 . 4 1 1 A 109 109 ASP HA H 109 4.110 4.253 -0.143 1
1 1259 . 4 1 1 A 109 109 ASP C C 109 178.190 178.400 -0.210 1
1 1260 . 4 1 1 A 109 109 ASP CA C 109 57.470 56.911 0.559 1
1 1261 . 4 1 1 A 109 109 ASP CB C 109 40.480 40.032 0.448 1
1 1262 . 4 1 1 A 109 109 ASP N N 109 118.780 120.909 -2.129 1
1 1263 . 4 1 1 A 110 110 ALA H H 110 7.520 7.916 -0.396 1
1 1264 . 4 1 1 A 110 110 ALA HA H 110 4.110 4.089 0.021 1
1 1268 . 4 1 1 A 110 110 ALA C C 110 180.550 179.700 0.850 1
1 1269 . 4 1 1 A 110 110 ALA CA C 110 54.880 55.044 -0.164 1
1 1270 . 4 1 1 A 110 110 ALA CB C 110 18.440 18.344 0.096 1
1 1271 . 4 1 1 A 110 110 ALA N N 110 120.640 122.986 -2.346 1
1 1272 . 4 1 1 A 111 111 ILE H H 111 7.840 8.225 -0.385 1
1 1273 . 4 1 1 A 111 111 ILE HA H 111 3.580 3.760 -0.180 1
1 1281 . 4 1 1 A 111 111 ILE C C 111 177.470 178.240 -0.770 1
1 1282 . 4 1 1 A 111 111 ILE CA C 111 64.620 64.900 -0.280 1
1 1283 . 4 1 1 A 111 111 ILE CB C 111 38.600 37.767 0.833 1
1 1286 . 4 1 1 A 111 111 ILE N N 111 119.840 118.968 0.872 1
1 1287 . 4 1 1 A 112 112 MET H H 112 8.100 7.752 0.348 1
1 1288 . 4 1 1 A 112 112 MET HA H 112 4.400 4.228 0.172 1
1 1296 . 4 1 1 A 112 112 MET C C 112 177.710 178.973 -1.263 1
1 1297 . 4 1 1 A 112 112 MET CA C 112 55.300 58.946 -3.646 1
1 1298 . 4 1 1 A 112 112 MET CB C 112 30.510 32.769 -2.259 1
1 1301 . 4 1 1 A 112 112 MET N N 112 115.180 118.577 -3.397 1
1 1302 . 4 1 1 A 113 113 ASN H H 113 8.070 8.035 0.035 1
1 1303 . 4 1 1 A 113 113 ASN HA H 113 4.570 4.431 0.139 1
1 1308 . 4 1 1 A 113 113 ASN C C 113 175.530 178.437 -2.907 1
1 1309 . 4 1 1 A 113 113 ASN CA C 113 54.420 56.590 -2.170 1
1 1310 . 4 1 1 A 113 113 ASN CB C 113 38.350 37.658 0.692 1
1 1311 . 4 1 1 A 113 113 ASN N N 113 117.190 117.454 -0.264 1
1 1313 . 4 1 1 A 114 114 ARG H H 114 8.070 8.016 0.054 1
1 1314 . 4 1 1 A 114 114 ARG HA H 114 4.280 3.909 0.371 1
1 1321 . 4 1 1 A 114 114 ARG C C 114 176.620 178.467 -1.847 1
1 1322 . 4 1 1 A 114 114 ARG CA C 114 56.910 59.061 -2.151 1
1 1323 . 4 1 1 A 114 114 ARG CB C 114 30.370 29.870 0.500 1
1 1326 . 4 1 1 A 114 114 ARG N N 114 118.360 119.732 -1.372 1
1 1327 . 4 1 1 A 115 115 LEU H H 115 8.100 7.856 0.244 1
1 1328 . 4 1 1 A 115 115 LEU HA H 115 4.310 3.612 0.698 1
1 1338 . 4 1 1 A 115 115 LEU C C 115 177.440 178.262 -0.822 1
1 1339 . 4 1 1 A 115 115 LEU CA C 115 55.440 57.985 -2.545 1
1 1340 . 4 1 1 A 115 115 LEU CB C 115 42.250 41.732 0.518 1
1 1344 . 4 1 1 A 115 115 LEU N N 115 120.580 121.316 -0.736 1
1 1345 . 4 1 1 A 116 116 GLN H H 116 8.180 7.433 0.747 1
1 1346 . 4 1 1 A 116 116 GLN HA H 116 4.360 3.920 0.440 1
1 1353 . 4 1 1 A 116 116 GLN C C 116 175.890 176.120 -0.230 1
1 1354 . 4 1 1 A 116 116 GLN CA C 116 55.810 58.341 -2.531 1
1 1355 . 4 1 1 A 116 116 GLN CB C 116 29.500 28.272 1.228 1
1 1357 . 4 1 1 A 116 116 GLN N N 116 119.770 117.639 2.131 1
1 1358 . 4 1 1 A 117 117 GLN H H 117 8.350 7.818 0.532 1
1 1359 . 4 1 1 A 117 117 GLN HA H 117 4.380 4.461 -0.081 1
1 1366 . 4 1 1 A 117 117 GLN C C 117 176.130 174.587 1.543 1
1 1367 . 4 1 1 A 117 117 GLN CA C 117 55.810 55.474 0.336 1
1 1368 . 4 1 1 A 117 117 GLN CB C 117 29.500 30.007 -0.507 1
1 1370 . 4 1 1 A 117 117 GLN N N 117 121.440 119.572 1.868 1
1 1371 . 4 1 1 A 118 118 VAL H H 118 8.240 8.632 -0.392 1
1 1372 . 4 1 1 A 118 118 VAL HA H 118 4.120 4.368 -0.248 1
1 1380 . 4 1 1 A 118 118 VAL C C 118 176.650 177.299 -0.649 1
1 1381 . 4 1 1 A 118 118 VAL CA C 118 62.720 60.483 2.237 1
1 1382 . 4 1 1 A 118 118 VAL CB C 118 32.730 35.396 -2.666 1
1 1385 . 4 1 1 A 118 118 VAL N N 118 121.250 126.242 -4.992 1
1 1386 . 4 1 1 A 119 119 GLY H H 119 8.460 8.696 -0.236 1
1 1387 . 4 1 1 A 119 119 GLY HA2 H 119 3.990 3.812 0.178 1
1 1388 . 4 1 1 A 119 119 GLY HA3 H 119 3.990 3.832 0.158 1
1 1389 . 4 1 1 A 119 119 GLY C C 119 173.770 174.216 -0.446 1
1 1390 . 4 1 1 A 119 119 GLY CA C 119 45.260 47.485 -2.225 1
1 1391 . 4 1 1 A 119 119 GLY N N 119 112.300 113.377 -1.077 1
1 1392 . 4 1 1 A 120 120 ASP H H 120 8.230 7.940 0.290 1
1 1393 . 4 1 1 A 120 120 ASP HA H 120 4.580 4.850 -0.270 1
1 1396 . 4 1 1 A 120 120 ASP C C 120 175.180 175.718 -0.538 1
1 1397 . 4 1 1 A 120 120 ASP CA C 120 54.340 53.405 0.935 1
1 1398 . 4 1 1 A 120 120 ASP CB C 120 41.390 41.440 -0.050 1
1 1399 . 4 1 1 A 120 120 ASP N N 120 120.420 118.230 2.190 1
1 1400 . 4 1 1 A 121 121 LYS H H 121 7.950 8.827 -0.877 1
1 1401 . 4 1 1 A 121 121 LYS HA H 121 4.240 4.155 0.085 1
1 1402 . 4 1 1 A 121 121 LYS CA C 121 53.620 61.416 -7.796 1
1 1403 . 4 1 1 A 121 121 LYS N N 121 119.110 125.745 -6.635 1
1 1404 . 4 1 1 A 122 122 PRO HA H 122 4.410 4.448 -0.038 1
1 1405 . 4 1 1 A 122 122 PRO C C 122 176.560 177.343 -0.783 1
1 1406 . 4 1 1 A 122 122 PRO CA C 122 63.130 63.690 -0.560 1
1 2 . 5 1 1 A 2 2 SER H H 2 7.890 7.700 0.190 1
1 3 . 5 1 1 A 2 2 SER HA H 2 4.270 4.388 -0.118 1
1 4 . 5 1 1 A 2 2 SER C C 2 173.960 174.913 -0.953 1
1 5 . 5 1 1 A 2 2 SER CA C 2 60.800 59.509 1.291 1
1 6 . 5 1 1 A 2 2 SER N N 2 111.940 116.004 -4.064 1
1 7 . 5 1 1 A 3 3 GLU H H 3 8.010 8.815 -0.805 1
1 8 . 5 1 1 A 3 3 GLU HA H 3 4.360 4.041 0.319 1
1 9 . 5 1 1 A 3 3 GLU C C 3 175.710 177.602 -1.892 1
1 10 . 5 1 1 A 3 3 GLU CA C 3 56.310 59.631 -3.321 1
1 11 . 5 1 1 A 3 3 GLU N N 3 121.280 123.503 -2.223 1
1 12 . 5 1 1 A 4 4 ALA H H 4 8.540 7.678 0.862 1
1 13 . 5 1 1 A 4 4 ALA HA H 4 4.560 4.359 0.201 1
1 14 . 5 1 1 A 4 4 ALA CA C 4 50.630 51.019 -0.389 1
1 15 . 5 1 1 A 4 4 ALA N N 4 127.840 123.021 4.819 1
1 16 . 5 1 1 A 5 5 PRO HA H 5 4.420 4.625 -0.205 1
1 17 . 5 1 1 A 5 5 PRO C C 5 174.240 176.855 -2.615 1
1 18 . 5 1 1 A 5 5 PRO CA C 5 62.840 62.633 0.207 1
1 19 . 5 1 1 A 6 6 LYS H H 6 8.320 8.374 -0.054 1
1 20 . 5 1 1 A 6 6 LYS HA H 6 4.290 4.554 -0.264 1
1 21 . 5 1 1 A 6 6 LYS C C 6 176.100 176.328 -0.228 1
1 22 . 5 1 1 A 6 6 LYS CA C 6 55.540 55.767 -0.227 1
1 23 . 5 1 1 A 6 6 LYS N N 6 121.910 121.435 0.475 1
1 24 . 5 1 1 A 7 7 LYS H H 7 8.450 7.619 0.831 1
1 25 . 5 1 1 A 7 7 LYS HA H 7 3.940 4.513 -0.573 1
1 26 . 5 1 1 A 7 7 LYS C C 7 175.700 175.829 -0.129 1
1 27 . 5 1 1 A 7 7 LYS CA C 7 56.440 55.282 1.158 1
1 28 . 5 1 1 A 7 7 LYS N N 7 122.250 120.552 1.698 1
1 29 . 5 1 1 A 8 8 ARG H H 8 8.210 8.909 -0.699 1
1 30 . 5 1 1 A 8 8 ARG HA H 8 4.670 4.825 -0.155 1
1 31 . 5 1 1 A 8 8 ARG C C 8 173.760 175.209 -1.449 1
1 32 . 5 1 1 A 8 8 ARG CA C 8 53.420 54.116 -0.696 1
1 33 . 5 1 1 A 8 8 ARG N N 8 122.560 123.386 -0.826 1
1 34 . 5 1 1 A 9 9 TRP H H 9 8.610 8.856 -0.246 1
1 35 . 5 1 1 A 9 9 TRP HA H 9 4.910 5.214 -0.304 1
1 44 . 5 1 1 A 9 9 TRP C C 9 174.610 175.800 -1.190 1
1 45 . 5 1 1 A 9 9 TRP CA C 9 57.630 56.267 1.363 1
1 46 . 5 1 1 A 9 9 TRP CB C 9 31.020 30.366 0.654 1
1 52 . 5 1 1 A 9 9 TRP N N 9 120.540 121.342 -0.802 1
1 54 . 5 1 1 A 10 10 TYR H H 10 9.260 8.922 0.338 1
1 55 . 5 1 1 A 10 10 TYR HA H 10 4.820 5.293 -0.473 1
1 62 . 5 1 1 A 10 10 TYR C C 10 174.340 175.317 -0.977 1
1 63 . 5 1 1 A 10 10 TYR CA C 10 57.050 56.798 0.252 1
1 64 . 5 1 1 A 10 10 TYR CB C 10 41.920 42.646 -0.726 1
1 69 . 5 1 1 A 10 10 TYR N N 10 118.990 122.220 -3.230 1
1 70 . 5 1 1 A 11 11 VAL H H 11 9.450 8.806 0.644 1
1 71 . 5 1 1 A 11 11 VAL HA H 11 4.470 4.854 -0.384 1
1 79 . 5 1 1 A 11 11 VAL C C 11 175.030 175.548 -0.518 1
1 80 . 5 1 1 A 11 11 VAL CA C 11 62.320 61.930 0.390 1
1 81 . 5 1 1 A 11 11 VAL CB C 11 32.400 33.472 -1.072 1
1 84 . 5 1 1 A 11 11 VAL N N 11 120.930 122.152 -1.222 1
1 85 . 5 1 1 A 12 12 VAL H H 12 9.320 8.801 0.519 1
1 86 . 5 1 1 A 12 12 VAL HA H 12 3.940 4.230 -0.290 1
1 94 . 5 1 1 A 12 12 VAL C C 12 173.870 174.935 -1.065 1
1 95 . 5 1 1 A 12 12 VAL CA C 12 61.330 61.157 0.173 1
1 96 . 5 1 1 A 12 12 VAL CB C 12 33.500 35.014 -1.514 1
1 99 . 5 1 1 A 12 12 VAL N N 12 128.860 125.745 3.115 1
1 100 . 5 1 1 A 13 13 GLN H H 13 8.830 8.442 0.388 1
1 101 . 5 1 1 A 13 13 GLN HA H 13 4.710 4.711 -0.001 1
1 108 . 5 1 1 A 13 13 GLN C C 13 174.230 175.271 -1.041 1
1 109 . 5 1 1 A 13 13 GLN CA C 13 54.800 55.560 -0.760 1
1 110 . 5 1 1 A 13 13 GLN CB C 13 29.450 29.823 -0.373 1
1 111 . 5 1 1 A 13 13 GLN N N 13 126.050 126.553 -0.503 1
1 113 . 5 1 1 A 14 14 ALA H H 14 9.420 8.256 1.164 1
1 114 . 5 1 1 A 14 14 ALA HA H 14 5.150 4.588 0.562 1
1 118 . 5 1 1 A 14 14 ALA C C 14 176.400 176.171 0.229 1
1 119 . 5 1 1 A 14 14 ALA CA C 14 49.660 51.219 -1.559 1
1 120 . 5 1 1 A 14 14 ALA CB C 14 22.840 22.735 0.105 1
1 121 . 5 1 1 A 14 14 ALA N N 14 131.620 122.366 9.254 1
1 122 . 5 1 1 A 15 15 PHE H H 15 8.070 8.627 -0.557 1
1 123 . 5 1 1 A 15 15 PHE HA H 15 4.410 4.671 -0.261 1
1 128 . 5 1 1 A 15 15 PHE C C 15 176.130 176.312 -0.182 1
1 129 . 5 1 1 A 15 15 PHE CA C 15 58.550 58.914 -0.364 1
1 130 . 5 1 1 A 15 15 PHE CB C 15 39.780 39.697 0.083 1
1 133 . 5 1 1 A 15 15 PHE N N 15 119.680 119.435 0.245 1
1 134 . 5 1 1 A 16 16 SER H H 16 8.370 8.845 -0.475 1
1 135 . 5 1 1 A 16 16 SER HA H 16 4.140 4.218 -0.078 1
1 138 . 5 1 1 A 16 16 SER C C 16 175.820 175.257 0.563 1
1 139 . 5 1 1 A 16 16 SER CA C 16 60.570 59.798 0.772 1
1 140 . 5 1 1 A 16 16 SER CB C 16 63.030 63.208 -0.178 1
1 141 . 5 1 1 A 16 16 SER N N 16 119.700 118.848 0.852 1
1 142 . 5 1 1 A 17 17 GLY H H 17 9.130 8.756 0.374 1
1 143 . 5 1 1 A 17 17 GLY HA2 H 17 3.640 3.697 -0.057 1
1 144 . 5 1 1 A 17 17 GLY HA3 H 17 4.200 3.798 0.402 1
1 145 . 5 1 1 A 17 17 GLY C C 17 175.520 174.752 0.768 1
1 146 . 5 1 1 A 17 17 GLY CA C 17 45.260 45.365 -0.105 1
1 147 . 5 1 1 A 17 17 GLY N N 17 115.850 114.903 0.947 1
1 148 . 5 1 1 A 18 18 PHE H H 18 8.480 7.649 0.831 1
1 149 . 5 1 1 A 18 18 PHE HA H 18 4.740 4.587 0.153 1
1 154 . 5 1 1 A 18 18 PHE C C 18 175.430 176.241 -0.811 1
1 155 . 5 1 1 A 18 18 PHE CA C 18 58.240 58.006 0.234 1
1 156 . 5 1 1 A 18 18 PHE CB C 18 39.010 38.468 0.542 1
1 159 . 5 1 1 A 18 18 PHE N N 18 118.550 119.785 -1.235 1
1 160 . 5 1 1 A 19 19 GLU H H 19 10.690 8.522 2.168 1
1 161 . 5 1 1 A 19 19 GLU HA H 19 3.490 4.158 -0.668 1
1 166 . 5 1 1 A 19 19 GLU C C 19 177.650 178.626 -0.976 1
1 167 . 5 1 1 A 19 19 GLU CA C 19 62.280 59.006 3.274 1
1 168 . 5 1 1 A 19 19 GLU CB C 19 28.380 29.206 -0.826 1
1 170 . 5 1 1 A 19 19 GLU N N 19 123.470 119.663 3.807 1
1 171 . 5 1 1 A 20 20 GLY H H 20 8.740 8.262 0.478 1
1 172 . 5 1 1 A 20 20 GLY HA2 H 20 3.840 3.752 0.088 1
1 173 . 5 1 1 A 20 20 GLY HA3 H 20 3.940 3.771 0.169 1
1 174 . 5 1 1 A 20 20 GLY C C 20 176.860 175.705 1.155 1
1 175 . 5 1 1 A 20 20 GLY CA C 20 47.140 47.173 -0.033 1
1 176 . 5 1 1 A 20 20 GLY N N 20 105.480 108.467 -2.987 1
1 177 . 5 1 1 A 21 21 ARG H H 21 7.690 8.219 -0.529 1
1 178 . 5 1 1 A 21 21 ARG HA H 21 4.180 4.144 0.036 1
1 185 . 5 1 1 A 21 21 ARG C C 21 179.490 178.277 1.213 1
1 186 . 5 1 1 A 21 21 ARG CA C 21 58.660 58.911 -0.251 1
1 187 . 5 1 1 A 21 21 ARG CB C 21 30.100 29.702 0.398 1
1 190 . 5 1 1 A 21 21 ARG N N 21 123.120 121.896 1.224 1
1 191 . 5 1 1 A 22 22 VAL H H 22 8.980 8.631 0.349 1
1 192 . 5 1 1 A 22 22 VAL HA H 22 3.560 3.708 -0.148 1
1 200 . 5 1 1 A 22 22 VAL C C 22 177.320 178.413 -1.093 1
1 201 . 5 1 1 A 22 22 VAL CA C 22 66.960 66.296 0.664 1
1 202 . 5 1 1 A 22 22 VAL CB C 22 31.050 31.582 -0.532 1
1 205 . 5 1 1 A 22 22 VAL N N 22 122.760 119.755 3.005 1
1 206 . 5 1 1 A 23 23 ALA H H 23 8.280 7.858 0.422 1
1 207 . 5 1 1 A 23 23 ALA HA H 23 3.850 4.072 -0.222 1
1 211 . 5 1 1 A 23 23 ALA C C 23 179.340 179.742 -0.402 1
1 212 . 5 1 1 A 23 23 ALA CA C 23 56.260 55.456 0.804 1
1 213 . 5 1 1 A 23 23 ALA CB C 23 18.260 18.468 -0.208 1
1 214 . 5 1 1 A 23 23 ALA N N 23 122.120 121.815 0.305 1
1 215 . 5 1 1 A 24 24 THR H H 24 8.020 7.664 0.356 1
1 216 . 5 1 1 A 24 24 THR HA H 24 3.920 3.880 0.040 1
1 221 . 5 1 1 A 24 24 THR C C 24 176.940 176.584 0.356 1
1 222 . 5 1 1 A 24 24 THR CA C 24 66.820 66.966 -0.146 1
1 223 . 5 1 1 A 24 24 THR CB C 24 68.930 68.426 0.504 1
1 225 . 5 1 1 A 24 24 THR N N 24 113.410 115.063 -1.653 1
1 226 . 5 1 1 A 25 25 SER H H 25 8.570 8.086 0.484 1
1 227 . 5 1 1 A 25 25 SER HA H 25 4.400 3.974 0.426 1
1 230 . 5 1 1 A 25 25 SER C C 25 177.610 176.164 1.446 1
1 231 . 5 1 1 A 25 25 SER CA C 25 61.920 61.984 -0.064 1
1 232 . 5 1 1 A 25 25 SER CB C 25 63.540 63.062 0.478 1
1 233 . 5 1 1 A 25 25 SER N N 25 118.260 117.394 0.866 1
1 234 . 5 1 1 A 26 26 LEU H H 26 9.430 8.215 1.215 1
1 235 . 5 1 1 A 26 26 LEU HA H 26 3.900 3.984 -0.084 1
1 245 . 5 1 1 A 26 26 LEU C C 26 177.710 178.567 -0.857 1
1 246 . 5 1 1 A 26 26 LEU CA C 26 58.910 57.965 0.945 1
1 247 . 5 1 1 A 26 26 LEU CB C 26 41.300 41.840 -0.540 1
1 251 . 5 1 1 A 26 26 LEU N N 26 124.120 121.185 2.935 1
1 252 . 5 1 1 A 27 27 ARG H H 27 7.790 7.726 0.064 1
1 253 . 5 1 1 A 27 27 ARG HA H 27 3.880 3.850 0.030 1
1 260 . 5 1 1 A 27 27 ARG C C 27 179.380 178.705 0.675 1
1 261 . 5 1 1 A 27 27 ARG CA C 27 60.510 59.585 0.925 1
1 262 . 5 1 1 A 27 27 ARG CB C 27 29.670 29.767 -0.097 1
1 265 . 5 1 1 A 27 27 ARG N N 27 116.710 118.896 -2.186 1
1 266 . 5 1 1 A 28 28 GLU H H 28 7.900 8.235 -0.335 1
1 267 . 5 1 1 A 28 28 GLU HA H 28 4.070 3.952 0.118 1
1 272 . 5 1 1 A 28 28 GLU C C 28 179.450 178.803 0.647 1
1 273 . 5 1 1 A 28 28 GLU CA C 28 59.450 59.025 0.425 1
1 274 . 5 1 1 A 28 28 GLU CB C 28 29.610 29.104 0.506 1
1 276 . 5 1 1 A 28 28 GLU N N 28 118.340 118.703 -0.363 1
1 277 . 5 1 1 A 29 29 HIS H H 29 8.940 7.880 1.060 1
1 278 . 5 1 1 A 29 29 HIS HA H 29 4.160 4.452 -0.292 1
1 283 . 5 1 1 A 29 29 HIS C C 29 177.750 177.913 -0.163 1
1 284 . 5 1 1 A 29 29 HIS CA C 29 61.260 59.990 1.270 1
1 285 . 5 1 1 A 29 29 HIS CB C 29 29.870 30.285 -0.415 1
1 287 . 5 1 1 A 29 29 HIS N N 29 120.440 117.492 2.948 1
1 288 . 5 1 1 A 30 30 ILE H H 30 8.580 8.035 0.545 1
1 289 . 5 1 1 A 30 30 ILE HA H 30 3.160 3.547 -0.387 1
1 299 . 5 1 1 A 30 30 ILE C C 30 177.230 177.860 -0.630 1
1 300 . 5 1 1 A 30 30 ILE CA C 30 66.460 65.351 1.109 1
1 301 . 5 1 1 A 30 30 ILE CB C 30 38.630 37.700 0.930 1
1 305 . 5 1 1 A 30 30 ILE N N 30 121.010 120.580 0.430 1
1 306 . 5 1 1 A 31 31 LYS H H 31 7.020 7.840 -0.820 1
1 307 . 5 1 1 A 31 31 LYS HA H 31 4.170 4.019 0.151 1
1 316 . 5 1 1 A 31 31 LYS C C 31 180.570 179.408 1.162 1
1 317 . 5 1 1 A 31 31 LYS CA C 31 58.920 59.761 -0.841 1
1 318 . 5 1 1 A 31 31 LYS CB C 31 32.490 32.165 0.325 1
1 322 . 5 1 1 A 31 31 LYS N N 31 117.400 119.698 -2.298 1
1 323 . 5 1 1 A 32 32 LEU H H 32 8.400 7.705 0.695 1
1 324 . 5 1 1 A 32 32 LEU HA H 32 3.990 3.932 0.058 1
1 334 . 5 1 1 A 32 32 LEU C C 32 178.230 178.184 0.046 1
1 335 . 5 1 1 A 32 32 LEU CA C 32 57.700 57.869 -0.169 1
1 336 . 5 1 1 A 32 32 LEU CB C 32 42.540 41.652 0.888 1
1 340 . 5 1 1 A 32 32 LEU N N 32 121.180 119.963 1.217 1
1 341 . 5 1 1 A 33 33 HIS H H 33 7.620 8.174 -0.554 1
1 342 . 5 1 1 A 33 33 HIS HA H 33 4.600 4.645 -0.045 1
1 347 . 5 1 1 A 33 33 HIS C C 33 177.090 174.521 2.569 1
1 348 . 5 1 1 A 33 33 HIS CA C 33 55.840 55.529 0.311 1
1 349 . 5 1 1 A 33 33 HIS CB C 33 29.330 29.994 -0.664 1
1 351 . 5 1 1 A 33 33 HIS N N 33 112.220 115.749 -3.529 1
1 352 . 5 1 1 A 34 34 ASN H H 34 8.030 8.125 -0.095 1
1 353 . 5 1 1 A 34 34 ASN HA H 34 4.890 4.379 0.511 1
1 358 . 5 1 1 A 34 34 ASN C C 34 175.910 175.766 0.144 1
1 359 . 5 1 1 A 34 34 ASN CA C 34 54.530 54.078 0.452 1
1 360 . 5 1 1 A 34 34 ASN CB C 34 37.380 37.173 0.207 1
1 361 . 5 1 1 A 34 34 ASN N N 34 117.600 116.759 0.841 1
1 363 . 5 1 1 A 35 35 MET H H 35 8.330 8.391 -0.061 1
1 364 . 5 1 1 A 35 35 MET HA H 35 4.940 4.873 0.067 1
1 372 . 5 1 1 A 35 35 MET C C 35 176.880 176.805 0.075 1
1 373 . 5 1 1 A 35 35 MET CA C 35 55.600 54.568 1.032 1
1 374 . 5 1 1 A 35 35 MET CB C 35 33.790 32.921 0.869 1
1 377 . 5 1 1 A 35 35 MET N N 35 116.190 117.009 -0.819 1
1 378 . 5 1 1 A 36 36 GLU H H 36 9.730 8.215 1.515 1
1 379 . 5 1 1 A 36 36 GLU HA H 36 3.850 4.118 -0.268 1
1 384 . 5 1 1 A 36 36 GLU C C 36 178.290 179.220 -0.930 1
1 385 . 5 1 1 A 36 36 GLU CA C 36 61.280 59.617 1.663 1
1 386 . 5 1 1 A 36 36 GLU CB C 36 29.270 29.226 0.044 1
1 388 . 5 1 1 A 36 36 GLU N N 36 121.630 120.840 0.790 1
1 389 . 5 1 1 A 37 37 ASP H H 37 8.850 8.104 0.746 1
1 390 . 5 1 1 A 37 37 ASP HA H 37 4.470 4.490 -0.020 1
1 393 . 5 1 1 A 37 37 ASP C C 37 177.190 178.926 -1.736 1
1 394 . 5 1 1 A 37 37 ASP CA C 37 56.140 57.277 -1.137 1
1 395 . 5 1 1 A 37 37 ASP CB C 37 40.050 40.862 -0.812 1
1 396 . 5 1 1 A 37 37 ASP N N 37 114.390 120.256 -5.866 1
1 397 . 5 1 1 A 38 38 LEU H H 38 7.880 7.763 0.117 1
1 398 . 5 1 1 A 38 38 LEU HA H 38 4.290 4.039 0.251 1
1 408 . 5 1 1 A 38 38 LEU C C 38 175.090 177.621 -2.531 1
1 409 . 5 1 1 A 38 38 LEU CA C 38 54.670 57.732 -3.062 1
1 410 . 5 1 1 A 38 38 LEU CB C 38 42.940 41.926 1.014 1
1 414 . 5 1 1 A 38 38 LEU N N 38 116.550 119.268 -2.718 1
1 415 . 5 1 1 A 39 39 PHE H H 39 7.500 7.707 -0.207 1
1 416 . 5 1 1 A 39 39 PHE HA H 39 4.970 4.541 0.429 1
1 424 . 5 1 1 A 39 39 PHE C C 39 175.380 175.680 -0.300 1
1 425 . 5 1 1 A 39 39 PHE CA C 39 57.580 58.983 -1.403 1
1 426 . 5 1 1 A 39 39 PHE CB C 39 44.990 39.059 5.931 1
1 432 . 5 1 1 A 39 39 PHE N N 39 115.370 116.645 -1.275 1
1 433 . 5 1 1 A 40 40 GLY H H 40 8.680 8.357 0.323 1
1 434 . 5 1 1 A 40 40 GLY HA2 H 40 3.370 4.022 -0.652 1
1 435 . 5 1 1 A 40 40 GLY HA3 H 40 4.550 4.099 0.451 1
1 436 . 5 1 1 A 40 40 GLY C C 40 173.090 173.743 -0.653 1
1 437 . 5 1 1 A 40 40 GLY CA C 40 44.180 46.303 -2.123 1
1 438 . 5 1 1 A 40 40 GLY N N 40 110.930 111.937 -1.007 1
1 439 . 5 1 1 A 41 41 GLU H H 41 8.320 7.749 0.571 1
1 440 . 5 1 1 A 41 41 GLU HA H 41 4.280 4.866 -0.586 1
1 445 . 5 1 1 A 41 41 GLU C C 41 173.900 174.821 -0.921 1
1 446 . 5 1 1 A 41 41 GLU CA C 41 56.900 54.568 2.332 1
1 447 . 5 1 1 A 41 41 GLU CB C 41 32.110 34.211 -2.101 1
1 449 . 5 1 1 A 41 41 GLU N N 41 126.730 117.344 9.386 1
1 450 . 5 1 1 A 42 42 VAL H H 42 8.100 8.858 -0.758 1
1 451 . 5 1 1 A 42 42 VAL HA H 42 5.160 5.138 0.022 1
1 459 . 5 1 1 A 42 42 VAL C C 42 176.340 175.131 1.209 1
1 460 . 5 1 1 A 42 42 VAL CA C 42 61.200 61.184 0.016 1
1 461 . 5 1 1 A 42 42 VAL CB C 42 34.770 34.489 0.281 1
1 464 . 5 1 1 A 42 42 VAL N N 42 119.360 122.305 -2.945 1
1 465 . 5 1 1 A 43 43 MET H H 43 9.870 9.221 0.649 1
1 466 . 5 1 1 A 43 43 MET HA H 43 5.070 5.423 -0.353 1
1 474 . 5 1 1 A 43 43 MET C C 43 173.890 175.622 -1.732 1
1 475 . 5 1 1 A 43 43 MET CA C 43 54.740 54.178 0.562 1
1 476 . 5 1 1 A 43 43 MET CB C 43 37.500 36.945 0.555 1
1 479 . 5 1 1 A 43 43 MET N N 43 125.720 124.623 1.097 1
1 480 . 5 1 1 A 44 44 VAL H H 44 8.800 8.954 -0.154 1
1 481 . 5 1 1 A 44 44 VAL HA H 44 4.720 4.797 -0.077 1
1 489 . 5 1 1 A 44 44 VAL CA C 44 59.090 59.130 -0.040 1
1 490 . 5 1 1 A 44 44 VAL CB C 44 33.710 33.184 0.526 1
1 493 . 5 1 1 A 44 44 VAL N N 44 122.340 123.726 -1.386 1
1 494 . 5 1 1 A 45 45 PRO HA H 45 4.480 4.440 0.040 1
1 501 . 5 1 1 A 45 45 PRO C C 45 177.080 177.490 -0.410 1
1 502 . 5 1 1 A 45 45 PRO CA C 45 63.240 64.760 -1.520 1
1 503 . 5 1 1 A 45 45 PRO CB C 45 32.170 32.023 0.147 1
1 506 . 5 1 1 A 46 46 THR H H 46 8.200 7.896 0.304 1
1 507 . 5 1 1 A 46 46 THR HA H 46 4.290 4.233 0.057 1
1 512 . 5 1 1 A 46 46 THR C C 46 174.600 174.854 -0.254 1
1 513 . 5 1 1 A 46 46 THR CA C 46 62.100 60.523 1.577 1
1 514 . 5 1 1 A 46 46 THR CB C 46 69.990 66.949 3.041 1
1 516 . 5 1 1 A 46 46 THR N N 46 113.410 111.829 1.581 1
1 517 . 5 1 1 A 47 47 GLU H H 47 8.380 9.017 -0.637 1
1 518 . 5 1 1 A 47 47 GLU HA H 47 4.400 4.169 0.231 1
1 521 . 5 1 1 A 47 47 GLU C C 47 175.970 176.618 -0.648 1
1 522 . 5 1 1 A 47 47 GLU CA C 47 55.200 59.511 -4.311 1
1 523 . 5 1 1 A 47 47 GLU CB C 47 32.300 29.986 2.314 1
1 524 . 5 1 1 A 47 47 GLU N N 47 122.830 128.159 -5.329 1
1 525 . 5 1 1 A 48 48 GLU H H 48 8.400 7.664 0.736 1
1 526 . 5 1 1 A 48 48 GLU HA H 48 4.280 4.714 -0.434 1
1 531 . 5 1 1 A 48 48 GLU C C 48 175.750 175.090 0.660 1
1 532 . 5 1 1 A 48 48 GLU CA C 48 55.190 54.567 0.623 1
1 533 . 5 1 1 A 48 48 GLU CB C 48 31.980 31.920 0.060 1
1 535 . 5 1 1 A 48 48 GLU N N 48 121.950 117.238 4.712 1
1 536 . 5 1 1 A 49 49 VAL H H 49 8.240 8.561 -0.321 1
1 537 . 5 1 1 A 49 49 VAL HA H 49 4.170 4.449 -0.279 1
1 542 . 5 1 1 A 49 49 VAL C C 49 174.610 175.246 -0.636 1
1 543 . 5 1 1 A 49 49 VAL CA C 49 62.280 60.407 1.873 1
1 544 . 5 1 1 A 49 49 VAL CB C 49 32.930 34.816 -1.886 1
1 546 . 5 1 1 A 49 49 VAL N N 49 123.990 121.590 2.400 1
1 547 . 5 1 1 A 50 50 VAL H H 50 8.230 8.503 -0.273 1
1 548 . 5 1 1 A 50 50 VAL HA H 50 4.220 3.942 0.278 1
1 553 . 5 1 1 A 50 50 VAL C C 50 175.770 175.310 0.460 1
1 554 . 5 1 1 A 50 50 VAL CA C 50 62.170 62.275 -0.105 1
1 555 . 5 1 1 A 50 50 VAL CB C 50 33.110 32.555 0.555 1
1 557 . 5 1 1 A 50 50 VAL N N 50 123.960 125.420 -1.460 1
1 558 . 5 1 1 A 51 51 GLU H H 51 8.570 8.368 0.202 1
1 559 . 5 1 1 A 51 51 GLU HA H 51 4.380 4.586 -0.206 1
1 564 . 5 1 1 A 51 51 GLU C C 51 175.920 177.846 -1.926 1
1 565 . 5 1 1 A 51 51 GLU CA C 51 56.050 55.712 0.338 1
1 566 . 5 1 1 A 51 51 GLU CB C 51 31.080 31.632 -0.552 1
1 568 . 5 1 1 A 51 51 GLU N N 51 125.070 124.768 0.302 1
1 569 . 5 1 1 A 52 52 ILE H H 52 8.320 8.532 -0.212 1
1 570 . 5 1 1 A 52 52 ILE HA H 52 4.290 4.021 0.269 1
1 580 . 5 1 1 A 52 52 ILE C C 52 176.330 175.656 0.674 1
1 581 . 5 1 1 A 52 52 ILE CA C 52 60.940 63.275 -2.335 1
1 582 . 5 1 1 A 52 52 ILE CB C 52 38.510 38.003 0.507 1
1 586 . 5 1 1 A 52 52 ILE N N 52 122.760 121.807 0.953 1
1 587 . 5 1 1 A 53 53 ARG H H 53 8.500 7.780 0.720 1
1 588 . 5 1 1 A 53 53 ARG HA H 53 4.430 4.727 -0.297 1
1 595 . 5 1 1 A 53 53 ARG C C 53 176.950 175.214 1.736 1
1 596 . 5 1 1 A 53 53 ARG CA C 53 56.150 54.473 1.677 1
1 597 . 5 1 1 A 53 53 ARG CB C 53 30.200 33.342 -3.142 1
1 600 . 5 1 1 A 53 53 ARG N N 53 125.250 119.763 5.487 1
1 601 . 5 1 1 A 54 54 GLY H H 54 8.760 8.572 0.188 1
1 602 . 5 1 1 A 54 54 GLY HA2 H 54 3.920 4.165 -0.245 1
1 603 . 5 1 1 A 54 54 GLY HA3 H 54 4.010 4.168 -0.158 1
1 604 . 5 1 1 A 54 54 GLY C C 54 175.110 174.490 0.620 1
1 605 . 5 1 1 A 54 54 GLY CA C 54 46.030 44.593 1.437 1
1 606 . 5 1 1 A 54 54 GLY N N 54 112.510 107.905 4.605 1
1 607 . 5 1 1 A 55 55 GLY H H 55 8.350 8.573 -0.223 1
1 608 . 5 1 1 A 55 55 GLY HA2 H 55 3.980 4.081 -0.101 1
1 609 . 5 1 1 A 55 55 GLY HA3 H 55 3.980 4.081 -0.101 1
1 610 . 5 1 1 A 55 55 GLY C C 55 173.920 172.870 1.050 1
1 611 . 5 1 1 A 55 55 GLY CA C 55 45.200 44.597 0.603 1
1 612 . 5 1 1 A 55 55 GLY N N 55 107.940 108.138 -0.198 1
1 613 . 5 1 1 A 56 56 GLN H H 56 8.100 8.626 -0.526 1
1 614 . 5 1 1 A 56 56 GLN HA H 56 4.420 4.885 -0.465 1
1 619 . 5 1 1 A 56 56 GLN C C 56 175.570 175.849 -0.279 1
1 620 . 5 1 1 A 56 56 GLN CA C 56 55.420 54.003 1.417 1
1 621 . 5 1 1 A 56 56 GLN CB C 56 30.100 31.065 -0.965 1
1 623 . 5 1 1 A 56 56 GLN N N 56 119.350 118.594 0.756 1
1 624 . 5 1 1 A 57 57 ARG H H 57 8.520 9.003 -0.483 1
1 625 . 5 1 1 A 57 57 ARG HA H 57 4.400 3.882 0.518 1
1 632 . 5 1 1 A 57 57 ARG C C 57 176.210 177.883 -1.673 1
1 633 . 5 1 1 A 57 57 ARG CA C 57 56.440 59.558 -3.118 1
1 634 . 5 1 1 A 57 57 ARG CB C 57 30.930 29.908 1.022 1
1 637 . 5 1 1 A 57 57 ARG N N 57 122.610 124.854 -2.244 1
1 638 . 5 1 1 A 58 58 ARG H H 58 8.630 7.845 0.785 1
1 639 . 5 1 1 A 58 58 ARG HA H 58 4.430 4.160 0.270 1
1 646 . 5 1 1 A 58 58 ARG C C 58 175.950 177.021 -1.071 1
1 647 . 5 1 1 A 58 58 ARG CA C 58 55.450 58.953 -3.503 1
1 648 . 5 1 1 A 58 58 ARG CB C 58 31.300 29.984 1.316 1
1 651 . 5 1 1 A 58 58 ARG N N 58 123.320 118.781 4.539 1
1 652 . 5 1 1 A 59 59 LYS H H 59 8.560 7.455 1.105 1
1 653 . 5 1 1 A 59 59 LYS HA H 59 4.410 4.216 0.194 1
1 662 . 5 1 1 A 59 59 LYS C C 59 176.590 176.708 -0.118 1
1 663 . 5 1 1 A 59 59 LYS CA C 59 56.720 56.640 0.080 1
1 664 . 5 1 1 A 59 59 LYS CB C 59 33.150 32.638 0.512 1
1 668 . 5 1 1 A 59 59 LYS N N 59 123.380 121.779 1.601 1
1 669 . 5 1 1 A 60 60 SER H H 60 8.450 8.547 -0.097 1
1 670 . 5 1 1 A 60 60 SER HA H 60 4.480 4.530 -0.050 1
1 673 . 5 1 1 A 60 60 SER C C 60 174.280 174.393 -0.113 1
1 674 . 5 1 1 A 60 60 SER CA C 60 58.140 58.853 -0.713 1
1 675 . 5 1 1 A 60 60 SER CB C 60 64.160 64.123 0.037 1
1 676 . 5 1 1 A 60 60 SER N N 60 117.320 121.631 -4.311 1
1 677 . 5 1 1 A 61 61 GLU H H 61 8.550 8.817 -0.267 1
1 678 . 5 1 1 A 61 61 GLU HA H 61 4.400 5.054 -0.654 1
1 683 . 5 1 1 A 61 61 GLU C C 61 176.150 175.108 1.042 1
1 684 . 5 1 1 A 61 61 GLU CA C 61 56.300 54.777 1.523 1
1 685 . 5 1 1 A 61 61 GLU CB C 61 30.790 33.111 -2.321 1
1 687 . 5 1 1 A 61 61 GLU N N 61 122.810 122.808 0.002 1
1 688 . 5 1 1 A 62 62 ARG H H 62 8.310 8.753 -0.443 1
1 689 . 5 1 1 A 62 62 ARG HA H 62 4.340 4.817 -0.477 1
1 692 . 5 1 1 A 62 62 ARG C C 62 176.140 174.438 1.702 1
1 693 . 5 1 1 A 62 62 ARG CA C 62 56.230 54.159 2.071 1
1 694 . 5 1 1 A 62 62 ARG CB C 62 30.780 33.017 -2.237 1
1 695 . 5 1 1 A 62 62 ARG N N 62 122.080 121.609 0.471 1
1 696 . 5 1 1 A 63 63 LYS H H 63 8.470 8.238 0.232 1
1 697 . 5 1 1 A 63 63 LYS HA H 63 4.300 4.542 -0.242 1
1 700 . 5 1 1 A 63 63 LYS C C 63 175.490 175.330 0.160 1
1 701 . 5 1 1 A 63 63 LYS CA C 63 56.200 56.047 0.153 1
1 702 . 5 1 1 A 63 63 LYS CB C 63 30.730 33.109 -2.379 1
1 703 . 5 1 1 A 63 63 LYS N N 63 123.450 122.538 0.912 1
1 704 . 5 1 1 A 64 64 PHE H H 64 8.200 9.109 -0.909 1
1 705 . 5 1 1 A 64 64 PHE HA H 64 4.450 4.931 -0.481 1
1 710 . 5 1 1 A 64 64 PHE C C 64 174.250 173.945 0.305 1
1 711 . 5 1 1 A 64 64 PHE CA C 64 57.430 56.439 0.991 1
1 712 . 5 1 1 A 64 64 PHE CB C 64 40.330 43.479 -3.149 1
1 715 . 5 1 1 A 64 64 PHE N N 64 121.740 125.612 -3.872 1
1 716 . 5 1 1 A 65 65 PHE H H 65 8.130 8.237 -0.107 1
1 717 . 5 1 1 A 65 65 PHE HA H 65 4.440 5.381 -0.941 1
1 725 . 5 1 1 A 65 65 PHE CA C 65 55.650 54.531 1.119 1
1 726 . 5 1 1 A 65 65 PHE CB C 65 38.900 39.218 -0.318 1
1 731 . 5 1 1 A 65 65 PHE N N 65 120.910 117.705 3.205 1
1 732 . 5 1 1 A 66 66 PRO C C 66 176.780 177.542 -0.762 1
1 733 . 5 1 1 A 67 67 GLY H H 67 9.970 9.144 0.826 1
1 734 . 5 1 1 A 67 67 GLY HA2 H 67 3.820 3.910 -0.090 1
1 735 . 5 1 1 A 67 67 GLY HA3 H 67 4.400 3.920 0.480 1
1 736 . 5 1 1 A 67 67 GLY C C 67 173.670 173.308 0.362 1
1 737 . 5 1 1 A 67 67 GLY CA C 67 45.900 45.272 0.628 1
1 738 . 5 1 1 A 67 67 GLY N N 67 111.550 111.506 0.044 1
1 739 . 5 1 1 A 68 68 TYR H H 68 7.650 8.161 -0.511 1
1 740 . 5 1 1 A 68 68 TYR HA H 68 5.000 4.993 0.007 1
1 747 . 5 1 1 A 68 68 TYR C C 68 175.220 174.975 0.245 1
1 748 . 5 1 1 A 68 68 TYR CA C 68 57.940 57.156 0.784 1
1 753 . 5 1 1 A 68 68 TYR N N 68 118.800 119.395 -0.595 1
1 754 . 5 1 1 A 69 69 VAL H H 69 9.090 8.774 0.316 1
1 755 . 5 1 1 A 69 69 VAL HA H 69 4.330 4.888 -0.558 1
1 763 . 5 1 1 A 69 69 VAL C C 69 174.250 174.970 -0.720 1
1 764 . 5 1 1 A 69 69 VAL CA C 69 62.120 60.483 1.637 1
1 765 . 5 1 1 A 69 69 VAL CB C 69 35.240 35.913 -0.673 1
1 768 . 5 1 1 A 69 69 VAL N N 69 119.300 123.090 -3.790 1
1 769 . 5 1 1 A 70 70 LEU H H 70 9.190 9.044 0.146 1
1 770 . 5 1 1 A 70 70 LEU HA H 70 5.460 5.454 0.006 1
1 780 . 5 1 1 A 70 70 LEU C C 70 176.130 176.372 -0.242 1
1 781 . 5 1 1 A 70 70 LEU CA C 70 54.120 53.476 0.644 1
1 782 . 5 1 1 A 70 70 LEU CB C 70 43.330 43.426 -0.096 1
1 786 . 5 1 1 A 70 70 LEU N N 70 126.710 126.961 -0.251 1
1 787 . 5 1 1 A 71 71 VAL H H 71 9.350 9.150 0.200 1
1 788 . 5 1 1 A 71 71 VAL HA H 71 5.040 4.841 0.199 1
1 796 . 5 1 1 A 71 71 VAL C C 71 173.670 174.989 -1.319 1
1 797 . 5 1 1 A 71 71 VAL CA C 71 61.090 61.419 -0.329 1
1 798 . 5 1 1 A 71 71 VAL CB C 71 35.800 35.594 0.206 1
1 801 . 5 1 1 A 71 71 VAL N N 71 121.920 124.663 -2.743 1
1 802 . 5 1 1 A 72 72 GLN H H 72 8.390 8.869 -0.479 1
1 803 . 5 1 1 A 72 72 GLN HA H 72 4.610 4.304 0.306 1
1 810 . 5 1 1 A 72 72 GLN C C 72 175.920 174.550 1.370 1
1 811 . 5 1 1 A 72 72 GLN CA C 72 53.810 55.690 -1.880 1
1 812 . 5 1 1 A 72 72 GLN CB C 72 28.850 28.777 0.073 1
1 814 . 5 1 1 A 72 72 GLN N N 72 130.760 127.904 2.856 1
1 816 . 5 1 1 A 73 73 MET H H 73 9.750 8.723 1.027 1
1 817 . 5 1 1 A 73 73 MET HA H 73 5.060 5.201 -0.141 1
1 825 . 5 1 1 A 73 73 MET C C 73 175.500 173.868 1.632 1
1 826 . 5 1 1 A 73 73 MET CA C 73 55.520 54.709 0.811 1
1 827 . 5 1 1 A 73 73 MET CB C 73 35.350 35.628 -0.278 1
1 830 . 5 1 1 A 73 73 MET N N 73 121.070 124.195 -3.125 1
1 831 . 5 1 1 A 74 74 VAL H H 74 8.530 8.233 0.297 1
1 832 . 5 1 1 A 74 74 VAL HA H 74 3.970 4.497 -0.527 1
1 840 . 5 1 1 A 74 74 VAL C C 74 174.900 175.089 -0.189 1
1 841 . 5 1 1 A 74 74 VAL CA C 74 62.150 61.019 1.131 1
1 842 . 5 1 1 A 74 74 VAL CB C 74 32.480 33.247 -0.767 1
1 845 . 5 1 1 A 74 74 VAL N N 74 124.120 123.389 0.731 1
1 846 . 5 1 1 A 75 75 MET H H 75 8.600 8.344 0.256 1
1 847 . 5 1 1 A 75 75 MET HA H 75 4.360 4.484 -0.124 1
1 855 . 5 1 1 A 75 75 MET C C 75 173.480 175.557 -2.077 1
1 856 . 5 1 1 A 75 75 MET CA C 75 53.830 53.683 0.147 1
1 857 . 5 1 1 A 75 75 MET CB C 75 29.960 32.240 -2.280 1
1 860 . 5 1 1 A 75 75 MET N N 75 128.250 127.243 1.007 1
1 861 . 5 1 1 A 76 76 ASN H H 76 8.410 8.318 0.092 1
1 862 . 5 1 1 A 76 76 ASN HA H 76 4.540 4.925 -0.385 1
1 867 . 5 1 1 A 76 76 ASN C C 76 173.950 175.147 -1.197 1
1 868 . 5 1 1 A 76 76 ASN CA C 76 51.720 51.503 0.217 1
1 869 . 5 1 1 A 76 76 ASN CB C 76 38.430 41.060 -2.630 1
1 870 . 5 1 1 A 76 76 ASN N N 76 127.500 122.714 4.786 1
1 872 . 5 1 1 A 77 77 ASP H H 77 8.470 8.987 -0.517 1
1 873 . 5 1 1 A 77 77 ASP HA H 77 4.410 4.211 0.199 1
1 876 . 5 1 1 A 77 77 ASP C C 77 178.530 178.470 0.060 1
1 877 . 5 1 1 A 77 77 ASP CA C 77 58.730 57.225 1.505 1
1 878 . 5 1 1 A 77 77 ASP CB C 77 40.940 40.489 0.451 1
1 879 . 5 1 1 A 77 77 ASP N N 77 117.090 121.798 -4.708 1
1 880 . 5 1 1 A 78 78 ALA H H 78 8.160 8.002 0.158 1
1 881 . 5 1 1 A 78 78 ALA HA H 78 4.350 4.139 0.211 1
1 885 . 5 1 1 A 78 78 ALA C C 78 181.250 179.930 1.320 1
1 886 . 5 1 1 A 78 78 ALA CA C 78 55.190 55.344 -0.154 1
1 887 . 5 1 1 A 78 78 ALA CB C 78 18.260 19.129 -0.869 1
1 888 . 5 1 1 A 78 78 ALA N N 78 122.500 123.925 -1.425 1
1 889 . 5 1 1 A 79 79 SER H H 79 9.320 8.617 0.703 1
1 890 . 5 1 1 A 79 79 SER HA H 79 4.290 4.220 0.070 1
1 893 . 5 1 1 A 79 79 SER C C 79 176.570 176.009 0.561 1
1 894 . 5 1 1 A 79 79 SER CA C 79 61.080 62.559 -1.479 1
1 895 . 5 1 1 A 79 79 SER CB C 79 62.200 62.814 -0.614 1
1 896 . 5 1 1 A 79 79 SER N N 79 119.280 113.871 5.409 1
1 897 . 5 1 1 A 80 80 TRP H H 80 8.900 8.313 0.587 1
1 898 . 5 1 1 A 80 80 TRP HA H 80 4.020 4.091 -0.071 1
1 907 . 5 1 1 A 80 80 TRP C C 80 178.210 178.513 -0.303 1
1 908 . 5 1 1 A 80 80 TRP CA C 80 62.490 61.320 1.170 1
1 909 . 5 1 1 A 80 80 TRP CB C 80 29.800 29.318 0.482 1
1 915 . 5 1 1 A 80 80 TRP N N 80 125.870 123.604 2.266 1
1 917 . 5 1 1 A 81 81 HIS H H 81 8.190 7.734 0.456 1
1 918 . 5 1 1 A 81 81 HIS HA H 81 3.930 4.180 -0.250 1
1 923 . 5 1 1 A 81 81 HIS C C 81 177.740 177.552 0.188 1
1 924 . 5 1 1 A 81 81 HIS CA C 81 61.020 59.675 1.345 1
1 925 . 5 1 1 A 81 81 HIS CB C 81 28.910 30.642 -1.732 1
1 927 . 5 1 1 A 81 81 HIS N N 81 114.080 117.146 -3.066 1
1 928 . 5 1 1 A 82 82 LEU H H 82 8.080 8.416 -0.336 1
1 929 . 5 1 1 A 82 82 LEU HA H 82 3.900 3.722 0.178 1
1 939 . 5 1 1 A 82 82 LEU C C 82 180.330 178.873 1.457 1
1 940 . 5 1 1 A 82 82 LEU CA C 82 58.590 58.316 0.274 1
1 941 . 5 1 1 A 82 82 LEU CB C 82 41.350 41.842 -0.492 1
1 945 . 5 1 1 A 82 82 LEU N N 82 121.320 121.012 0.308 1
1 946 . 5 1 1 A 83 83 VAL H H 83 8.000 8.255 -0.255 1
1 947 . 5 1 1 A 83 83 VAL HA H 83 3.210 3.557 -0.347 1
1 955 . 5 1 1 A 83 83 VAL C C 83 177.060 177.678 -0.618 1
1 956 . 5 1 1 A 83 83 VAL CA C 83 67.430 67.068 0.362 1
1 957 . 5 1 1 A 83 83 VAL CB C 83 31.680 31.352 0.328 1
1 960 . 5 1 1 A 83 83 VAL N N 83 118.850 119.580 -0.730 1
1 961 . 5 1 1 A 84 84 ARG H H 84 7.540 7.779 -0.239 1
1 962 . 5 1 1 A 84 84 ARG HA H 84 3.590 3.940 -0.350 1
1 969 . 5 1 1 A 84 84 ARG C C 84 177.240 178.334 -1.094 1
1 970 . 5 1 1 A 84 84 ARG CA C 84 56.050 59.154 -3.104 1
1 971 . 5 1 1 A 84 84 ARG CB C 84 28.190 29.629 -1.439 1
1 974 . 5 1 1 A 84 84 ARG N N 84 111.460 119.830 -8.370 1
1 975 . 5 1 1 A 85 85 SER H H 85 7.530 7.477 0.053 1
1 976 . 5 1 1 A 85 85 SER HA H 85 4.280 4.285 -0.005 1
1 979 . 5 1 1 A 85 85 SER C C 85 173.930 174.558 -0.628 1
1 980 . 5 1 1 A 85 85 SER CA C 85 59.220 59.312 -0.092 1
1 981 . 5 1 1 A 85 85 SER CB C 85 63.830 63.230 0.600 1
1 982 . 5 1 1 A 85 85 SER N N 85 113.660 112.607 1.053 1
1 983 . 5 1 1 A 86 86 VAL H H 86 7.230 7.338 -0.108 1
1 984 . 5 1 1 A 86 86 VAL HA H 86 3.480 3.837 -0.357 1
1 992 . 5 1 1 A 86 86 VAL CA C 86 61.300 61.083 0.217 1
1 993 . 5 1 1 A 86 86 VAL CB C 86 31.780 32.248 -0.468 1
1 996 . 5 1 1 A 86 86 VAL N N 86 128.120 126.422 1.698 1
1 997 . 5 1 1 A 87 87 PRO HA H 87 4.140 4.387 -0.247 1
1 1004 . 5 1 1 A 87 87 PRO C C 87 176.400 176.808 -0.408 1
1 1005 . 5 1 1 A 87 87 PRO CA C 87 64.100 63.535 0.565 1
1 1006 . 5 1 1 A 87 87 PRO CB C 87 31.710 32.306 -0.596 1
1 1009 . 5 1 1 A 88 88 ARG H H 88 8.320 8.755 -0.435 1
1 1010 . 5 1 1 A 88 88 ARG HA H 88 3.030 4.099 -1.069 1
1 1017 . 5 1 1 A 88 88 ARG C C 88 174.630 174.953 -0.323 1
1 1018 . 5 1 1 A 88 88 ARG CA C 88 57.620 57.378 0.242 1
1 1019 . 5 1 1 A 88 88 ARG CB C 88 26.960 27.796 -0.836 1
1 1022 . 5 1 1 A 88 88 ARG N N 88 111.360 116.302 -4.942 1
1 1023 . 5 1 1 A 89 89 VAL H H 89 7.390 7.775 -0.385 1
1 1024 . 5 1 1 A 89 89 VAL HA H 89 3.910 4.339 -0.429 1
1 1032 . 5 1 1 A 89 89 VAL C C 89 177.370 175.525 1.845 1
1 1033 . 5 1 1 A 89 89 VAL CA C 89 64.170 60.946 3.224 1
1 1034 . 5 1 1 A 89 89 VAL CB C 89 32.070 34.077 -2.007 1
1 1037 . 5 1 1 A 89 89 VAL N N 89 117.900 118.466 -0.566 1
1 1038 . 5 1 1 A 90 90 MET H H 90 9.290 8.367 0.923 1
1 1039 . 5 1 1 A 90 90 MET HA H 90 4.340 4.103 0.237 1
1 1047 . 5 1 1 A 90 90 MET C C 90 175.800 175.924 -0.124 1
1 1048 . 5 1 1 A 90 90 MET CA C 90 56.440 56.894 -0.454 1
1 1049 . 5 1 1 A 90 90 MET CB C 90 34.160 33.543 0.617 1
1 1052 . 5 1 1 A 90 90 MET N N 90 128.200 125.684 2.516 1
1 1053 . 5 1 1 A 91 91 GLY H H 91 7.130 7.160 -0.030 1
1 1054 . 5 1 1 A 91 91 GLY HA2 H 91 3.340 3.944 -0.604 1
1 1055 . 5 1 1 A 91 91 GLY HA3 H 91 4.410 4.012 0.398 1
1 1056 . 5 1 1 A 91 91 GLY C C 91 170.920 171.224 -0.304 1
1 1057 . 5 1 1 A 91 91 GLY CA C 91 44.440 45.851 -1.411 1
1 1058 . 5 1 1 A 91 91 GLY N N 91 104.320 103.393 0.927 1
1 1059 . 5 1 1 A 92 92 PHE H H 92 8.790 8.485 0.305 1
1 1060 . 5 1 1 A 92 92 PHE HA H 92 5.270 5.295 -0.025 1
1 1068 . 5 1 1 A 92 92 PHE C C 92 176.230 175.286 0.944 1
1 1069 . 5 1 1 A 92 92 PHE CA C 92 57.480 57.038 0.442 1
1 1070 . 5 1 1 A 92 92 PHE CB C 92 42.190 42.670 -0.480 1
1 1075 . 5 1 1 A 92 92 PHE N N 92 118.770 119.263 -0.493 1
1 1076 . 5 1 1 A 93 93 ILE H H 93 8.800 8.823 -0.023 1
1 1077 . 5 1 1 A 93 93 ILE HA H 93 4.310 5.206 -0.896 1
1 1087 . 5 1 1 A 93 93 ILE C C 93 176.380 175.875 0.505 1
1 1088 . 5 1 1 A 93 93 ILE CA C 93 60.480 59.994 0.486 1
1 1089 . 5 1 1 A 93 93 ILE CB C 93 38.010 41.138 -3.128 1
1 1093 . 5 1 1 A 93 93 ILE N N 93 122.300 121.514 0.786 1
1 1094 . 5 1 1 A 94 94 GLY H H 94 8.640 8.517 0.123 1
1 1095 . 5 1 1 A 94 94 GLY HA2 H 94 3.830 4.296 -0.466 1
1 1096 . 5 1 1 A 94 94 GLY HA3 H 94 4.600 4.315 0.285 1
1 1097 . 5 1 1 A 94 94 GLY C C 94 175.080 174.477 0.603 1
1 1098 . 5 1 1 A 94 94 GLY CA C 94 44.530 46.070 -1.540 1
1 1099 . 5 1 1 A 94 94 GLY N N 94 116.550 113.051 3.499 1
1 1100 . 5 1 1 A 95 95 GLY H H 95 8.900 8.828 0.072 1
1 1101 . 5 1 1 A 95 95 GLY HA2 H 95 3.970 3.887 0.083 1
1 1102 . 5 1 1 A 95 95 GLY HA3 H 95 4.370 3.894 0.476 1
1 1103 . 5 1 1 A 95 95 GLY C C 95 174.560 174.080 0.480 1
1 1104 . 5 1 1 A 95 95 GLY CA C 95 45.640 47.131 -1.491 1
1 1105 . 5 1 1 A 95 95 GLY N N 95 112.960 110.955 2.005 1
1 1106 . 5 1 1 A 96 96 THR H H 96 7.830 7.743 0.087 1
1 1107 . 5 1 1 A 96 96 THR HA H 96 4.720 4.779 -0.059 1
1 1112 . 5 1 1 A 96 96 THR C C 96 176.260 174.178 2.082 1
1 1113 . 5 1 1 A 96 96 THR CA C 96 60.360 59.814 0.546 1
1 1114 . 5 1 1 A 96 96 THR CB C 96 70.960 72.181 -1.221 1
1 1116 . 5 1 1 A 96 96 THR N N 96 113.350 109.793 3.557 1
1 1117 . 5 1 1 A 97 97 SER H H 97 8.850 8.754 0.096 1
1 1118 . 5 1 1 A 97 97 SER HA H 97 4.310 4.704 -0.394 1
1 1121 . 5 1 1 A 97 97 SER C C 97 175.570 174.661 0.909 1
1 1122 . 5 1 1 A 97 97 SER CA C 97 60.850 58.475 2.375 1
1 1123 . 5 1 1 A 97 97 SER CB C 97 63.000 63.524 -0.524 1
1 1124 . 5 1 1 A 97 97 SER N N 97 116.420 115.886 0.534 1
1 1125 . 5 1 1 A 98 98 ASP H H 98 8.360 7.779 0.581 1
1 1126 . 5 1 1 A 98 98 ASP HA H 98 4.310 5.295 -0.985 1
1 1129 . 5 1 1 A 98 98 ASP C C 98 175.380 175.098 0.282 1
1 1130 . 5 1 1 A 98 98 ASP CA C 98 54.190 54.166 0.024 1
1 1131 . 5 1 1 A 98 98 ASP CB C 98 40.740 42.636 -1.896 1
1 1132 . 5 1 1 A 98 98 ASP N N 98 116.320 120.000 -3.680 1
1 1133 . 5 1 1 A 99 99 ARG H H 99 7.450 7.683 -0.233 1
1 1134 . 5 1 1 A 99 99 ARG HA H 99 4.350 4.541 -0.191 1
1 1141 . 5 1 1 A 99 99 ARG CA C 99 52.920 53.522 -0.602 1
1 1142 . 5 1 1 A 99 99 ARG CB C 99 30.340 31.270 -0.930 1
1 1145 . 5 1 1 A 99 99 ARG N N 99 119.960 118.654 1.306 1
1 1146 . 5 1 1 A 100 100 PRO HA H 100 4.750 4.673 0.077 1
1 1153 . 5 1 1 A 100 100 PRO C C 100 175.220 177.145 -1.925 1
1 1154 . 5 1 1 A 100 100 PRO CA C 100 62.680 62.786 -0.106 1
1 1155 . 5 1 1 A 100 100 PRO CB C 100 32.820 31.858 0.962 1
1 1158 . 5 1 1 A 101 101 ALA H H 101 7.210 8.348 -1.138 1
1 1159 . 5 1 1 A 101 101 ALA HA H 101 5.030 4.578 0.452 1
1 1163 . 5 1 1 A 101 101 ALA CA C 101 48.570 50.443 -1.873 1
1 1164 . 5 1 1 A 101 101 ALA CB C 101 19.660 17.478 2.182 1
1 1165 . 5 1 1 A 101 101 ALA N N 101 124.490 125.047 -0.557 1
1 1166 . 5 1 1 A 102 102 PRO HA H 102 4.440 4.095 0.345 1
1 1173 . 5 1 1 A 102 102 PRO C C 102 177.200 176.340 0.860 1
1 1174 . 5 1 1 A 102 102 PRO CA C 102 62.190 62.569 -0.379 1
1 1175 . 5 1 1 A 102 102 PRO CB C 102 32.310 32.628 -0.318 1
1 1178 . 5 1 1 A 103 103 ILE H H 103 8.550 7.603 0.947 1
1 1179 . 5 1 1 A 103 103 ILE HA H 103 4.630 4.901 -0.271 1
1 1189 . 5 1 1 A 103 103 ILE C C 103 175.460 175.107 0.353 1
1 1190 . 5 1 1 A 103 103 ILE CA C 103 59.730 58.554 1.176 1
1 1191 . 5 1 1 A 103 103 ILE CB C 103 40.140 42.116 -1.976 1
1 1195 . 5 1 1 A 103 103 ILE N N 103 115.670 116.449 -0.779 1
1 1196 . 5 1 1 A 104 104 SER H H 104 8.730 8.753 -0.023 1
1 1197 . 5 1 1 A 104 104 SER HA H 104 4.500 4.543 -0.043 1
1 1200 . 5 1 1 A 104 104 SER C C 104 174.840 175.140 -0.300 1
1 1201 . 5 1 1 A 104 104 SER CA C 104 58.010 58.205 -0.195 1
1 1202 . 5 1 1 A 104 104 SER CB C 104 65.470 64.053 1.417 1
1 1203 . 5 1 1 A 104 104 SER N N 104 119.170 119.991 -0.821 1
1 1204 . 5 1 1 A 105 105 ASP H H 105 8.830 9.057 -0.227 1
1 1205 . 5 1 1 A 105 105 ASP HA H 105 4.200 4.244 -0.044 1
1 1208 . 5 1 1 A 105 105 ASP C C 105 178.520 178.351 0.169 1
1 1209 . 5 1 1 A 105 105 ASP CA C 105 57.870 57.738 0.132 1
1 1210 . 5 1 1 A 105 105 ASP CB C 105 40.040 40.349 -0.309 1
1 1211 . 5 1 1 A 105 105 ASP N N 105 121.640 125.360 -3.720 1
1 1212 . 5 1 1 A 106 106 LYS H H 106 8.130 8.086 0.044 1
1 1213 . 5 1 1 A 106 106 LYS HA H 106 4.100 3.906 0.194 1
1 1222 . 5 1 1 A 106 106 LYS C C 106 179.400 178.235 1.165 1
1 1223 . 5 1 1 A 106 106 LYS CA C 106 58.980 59.206 -0.226 1
1 1224 . 5 1 1 A 106 106 LYS CB C 106 32.330 31.996 0.334 1
1 1228 . 5 1 1 A 106 106 LYS N N 106 118.300 121.276 -2.976 1
1 1229 . 5 1 1 A 107 107 GLU H H 107 7.670 7.645 0.025 1
1 1230 . 5 1 1 A 107 107 GLU HA H 107 4.020 4.073 -0.053 1
1 1235 . 5 1 1 A 107 107 GLU C C 107 178.750 179.086 -0.336 1
1 1236 . 5 1 1 A 107 107 GLU CA C 107 59.210 59.045 0.165 1
1 1237 . 5 1 1 A 107 107 GLU CB C 107 29.780 29.442 0.338 1
1 1239 . 5 1 1 A 107 107 GLU N N 107 121.270 118.905 2.365 1
1 1240 . 5 1 1 A 108 108 VAL H H 108 7.790 7.580 0.210 1
1 1241 . 5 1 1 A 108 108 VAL HA H 108 3.050 3.445 -0.395 1
1 1249 . 5 1 1 A 108 108 VAL C C 108 177.550 177.687 -0.137 1
1 1250 . 5 1 1 A 108 108 VAL CA C 108 67.080 66.468 0.612 1
1 1251 . 5 1 1 A 108 108 VAL CB C 108 31.220 31.082 0.138 1
1 1254 . 5 1 1 A 108 108 VAL N N 108 120.940 120.102 0.838 1
1 1255 . 5 1 1 A 109 109 ASP H H 109 7.840 7.975 -0.135 1
1 1256 . 5 1 1 A 109 109 ASP HA H 109 4.110 4.256 -0.146 1
1 1259 . 5 1 1 A 109 109 ASP C C 109 178.190 178.499 -0.309 1
1 1260 . 5 1 1 A 109 109 ASP CA C 109 57.470 57.086 0.384 1
1 1261 . 5 1 1 A 109 109 ASP CB C 109 40.480 40.244 0.236 1
1 1262 . 5 1 1 A 109 109 ASP N N 109 118.780 121.363 -2.583 1
1 1263 . 5 1 1 A 110 110 ALA H H 110 7.520 7.679 -0.159 1
1 1264 . 5 1 1 A 110 110 ALA HA H 110 4.110 4.049 0.061 1
1 1268 . 5 1 1 A 110 110 ALA C C 110 180.550 179.680 0.870 1
1 1269 . 5 1 1 A 110 110 ALA CA C 110 54.880 54.909 -0.029 1
1 1270 . 5 1 1 A 110 110 ALA CB C 110 18.440 18.252 0.188 1
1 1271 . 5 1 1 A 110 110 ALA N N 110 120.640 122.805 -2.165 1
1 1272 . 5 1 1 A 111 111 ILE H H 111 7.840 7.570 0.270 1
1 1273 . 5 1 1 A 111 111 ILE HA H 111 3.580 3.391 0.189 1
1 1281 . 5 1 1 A 111 111 ILE C C 111 177.470 177.983 -0.513 1
1 1282 . 5 1 1 A 111 111 ILE CA C 111 64.620 64.893 -0.273 1
1 1283 . 5 1 1 A 111 111 ILE CB C 111 38.600 37.570 1.030 1
1 1286 . 5 1 1 A 111 111 ILE N N 111 119.840 119.339 0.501 1
1 1287 . 5 1 1 A 112 112 MET H H 112 8.100 7.792 0.308 1
1 1288 . 5 1 1 A 112 112 MET HA H 112 4.400 4.282 0.118 1
1 1296 . 5 1 1 A 112 112 MET C C 112 177.710 178.955 -1.245 1
1 1297 . 5 1 1 A 112 112 MET CA C 112 55.300 58.865 -3.565 1
1 1298 . 5 1 1 A 112 112 MET CB C 112 30.510 32.712 -2.202 1
1 1301 . 5 1 1 A 112 112 MET N N 112 115.180 118.448 -3.268 1
1 1302 . 5 1 1 A 113 113 ASN H H 113 8.070 7.917 0.153 1
1 1303 . 5 1 1 A 113 113 ASN HA H 113 4.570 4.513 0.057 1
1 1308 . 5 1 1 A 113 113 ASN C C 113 175.530 178.389 -2.859 1
1 1309 . 5 1 1 A 113 113 ASN CA C 113 54.420 55.958 -1.538 1
1 1310 . 5 1 1 A 113 113 ASN CB C 113 38.350 37.892 0.458 1
1 1311 . 5 1 1 A 113 113 ASN N N 113 117.190 117.324 -0.134 1
1 1313 . 5 1 1 A 114 114 ARG H H 114 8.070 7.767 0.303 1
1 1314 . 5 1 1 A 114 114 ARG HA H 114 4.280 4.082 0.198 1
1 1321 . 5 1 1 A 114 114 ARG C C 114 176.620 178.439 -1.819 1
1 1322 . 5 1 1 A 114 114 ARG CA C 114 56.910 58.916 -2.006 1
1 1323 . 5 1 1 A 114 114 ARG CB C 114 30.370 29.676 0.694 1
1 1326 . 5 1 1 A 114 114 ARG N N 114 118.360 120.506 -2.146 1
1 1327 . 5 1 1 A 115 115 LEU H H 115 8.100 8.160 -0.060 1
1 1328 . 5 1 1 A 115 115 LEU HA H 115 4.310 3.985 0.325 1
1 1338 . 5 1 1 A 115 115 LEU C C 115 177.440 179.503 -2.063 1
1 1339 . 5 1 1 A 115 115 LEU CA C 115 55.440 58.061 -2.621 1
1 1340 . 5 1 1 A 115 115 LEU CB C 115 42.250 41.687 0.563 1
1 1344 . 5 1 1 A 115 115 LEU N N 115 120.580 120.471 0.109 1
1 1345 . 5 1 1 A 116 116 GLN H H 116 8.180 7.344 0.836 1
1 1346 . 5 1 1 A 116 116 GLN HA H 116 4.360 4.109 0.251 1
1 1353 . 5 1 1 A 116 116 GLN C C 116 175.890 176.590 -0.700 1
1 1354 . 5 1 1 A 116 116 GLN CA C 116 55.810 58.892 -3.082 1
1 1355 . 5 1 1 A 116 116 GLN CB C 116 29.500 28.642 0.858 1
1 1357 . 5 1 1 A 116 116 GLN N N 116 119.770 116.838 2.932 1
1 1358 . 5 1 1 A 117 117 GLN H H 117 8.350 7.525 0.825 1
1 1359 . 5 1 1 A 117 117 GLN HA H 117 4.380 4.261 0.119 1
1 1366 . 5 1 1 A 117 117 GLN C C 117 176.130 175.026 1.104 1
1 1367 . 5 1 1 A 117 117 GLN CA C 117 55.810 56.154 -0.344 1
1 1368 . 5 1 1 A 117 117 GLN CB C 117 29.500 29.578 -0.078 1
1 1370 . 5 1 1 A 117 117 GLN N N 117 121.440 120.150 1.290 1
1 1371 . 5 1 1 A 118 118 VAL H H 118 8.240 8.694 -0.454 1
1 1372 . 5 1 1 A 118 118 VAL HA H 118 4.120 4.483 -0.363 1
1 1380 . 5 1 1 A 118 118 VAL C C 118 176.650 177.099 -0.449 1
1 1381 . 5 1 1 A 118 118 VAL CA C 118 62.720 60.580 2.140 1
1 1382 . 5 1 1 A 118 118 VAL CB C 118 32.730 35.800 -3.070 1
1 1385 . 5 1 1 A 118 118 VAL N N 118 121.250 126.653 -5.403 1
1 1386 . 5 1 1 A 119 119 GLY H H 119 8.460 8.684 -0.224 1
1 1387 . 5 1 1 A 119 119 GLY HA2 H 119 3.990 3.809 0.181 1
1 1388 . 5 1 1 A 119 119 GLY HA3 H 119 3.990 3.810 0.180 1
1 1389 . 5 1 1 A 119 119 GLY C C 119 173.770 173.825 -0.055 1
1 1390 . 5 1 1 A 119 119 GLY CA C 119 45.260 47.097 -1.837 1
1 1391 . 5 1 1 A 119 119 GLY N N 119 112.300 113.330 -1.030 1
1 1392 . 5 1 1 A 120 120 ASP H H 120 8.230 7.636 0.594 1
1 1393 . 5 1 1 A 120 120 ASP HA H 120 4.580 5.234 -0.654 1
1 1396 . 5 1 1 A 120 120 ASP C C 120 175.180 175.475 -0.295 1
1 1397 . 5 1 1 A 120 120 ASP CA C 120 54.340 52.616 1.724 1
1 1398 . 5 1 1 A 120 120 ASP CB C 120 41.390 44.947 -3.557 1
1 1399 . 5 1 1 A 120 120 ASP N N 120 120.420 119.817 0.603 1
1 1400 . 5 1 1 A 121 121 LYS H H 121 7.950 8.589 -0.639 1
1 1401 . 5 1 1 A 121 121 LYS HA H 121 4.240 4.910 -0.670 1
1 1402 . 5 1 1 A 121 121 LYS CA C 121 53.620 53.031 0.589 1
1 1403 . 5 1 1 A 121 121 LYS N N 121 119.110 123.229 -4.119 1
1 1404 . 5 1 1 A 122 122 PRO HA H 122 4.410 4.556 -0.146 1
1 1405 . 5 1 1 A 122 122 PRO C C 122 176.560 176.657 -0.097 1
1 1406 . 5 1 1 A 122 122 PRO CA C 122 63.130 64.212 -1.082 1
1 2 . 6 1 1 A 2 2 SER H H 2 7.890 7.955 -0.065 1
1 3 . 6 1 1 A 2 2 SER HA H 2 4.270 4.111 0.159 1
1 4 . 6 1 1 A 2 2 SER C C 2 173.960 174.210 -0.250 1
1 5 . 6 1 1 A 2 2 SER CA C 2 60.800 61.751 -0.951 1
1 6 . 6 1 1 A 2 2 SER N N 2 111.940 116.895 -4.955 1
1 7 . 6 1 1 A 3 3 GLU H H 3 8.010 8.082 -0.072 1
1 8 . 6 1 1 A 3 3 GLU HA H 3 4.360 4.034 0.326 1
1 9 . 6 1 1 A 3 3 GLU C C 3 175.710 175.702 0.008 1
1 10 . 6 1 1 A 3 3 GLU CA C 3 56.310 57.882 -1.572 1
1 11 . 6 1 1 A 3 3 GLU N N 3 121.280 117.560 3.720 1
1 12 . 6 1 1 A 4 4 ALA H H 4 8.540 8.293 0.247 1
1 13 . 6 1 1 A 4 4 ALA HA H 4 4.560 4.176 0.384 1
1 14 . 6 1 1 A 4 4 ALA CA C 4 50.630 53.340 -2.710 1
1 15 . 6 1 1 A 4 4 ALA N N 4 127.840 115.962 11.878 1
1 16 . 6 1 1 A 5 5 PRO HA H 5 4.420 4.557 -0.137 1
1 17 . 6 1 1 A 5 5 PRO C C 5 174.240 175.978 -1.738 1
1 18 . 6 1 1 A 5 5 PRO CA C 5 62.840 62.586 0.254 1
1 19 . 6 1 1 A 6 6 LYS H H 6 8.320 8.383 -0.063 1
1 20 . 6 1 1 A 6 6 LYS HA H 6 4.290 4.575 -0.285 1
1 21 . 6 1 1 A 6 6 LYS C C 6 176.100 175.861 0.239 1
1 22 . 6 1 1 A 6 6 LYS CA C 6 55.540 55.792 -0.252 1
1 23 . 6 1 1 A 6 6 LYS N N 6 121.910 121.770 0.140 1
1 24 . 6 1 1 A 7 7 LYS H H 7 8.450 8.580 -0.130 1
1 25 . 6 1 1 A 7 7 LYS HA H 7 3.940 4.702 -0.762 1
1 26 . 6 1 1 A 7 7 LYS C C 7 175.700 175.861 -0.161 1
1 27 . 6 1 1 A 7 7 LYS CA C 7 56.440 55.051 1.389 1
1 28 . 6 1 1 A 7 7 LYS N N 7 122.250 125.620 -3.370 1
1 29 . 6 1 1 A 8 8 ARG H H 8 8.210 8.798 -0.588 1
1 30 . 6 1 1 A 8 8 ARG HA H 8 4.670 4.828 -0.158 1
1 31 . 6 1 1 A 8 8 ARG C C 8 173.760 175.004 -1.244 1
1 32 . 6 1 1 A 8 8 ARG CA C 8 53.420 53.918 -0.498 1
1 33 . 6 1 1 A 8 8 ARG N N 8 122.560 122.467 0.093 1
1 34 . 6 1 1 A 9 9 TRP H H 9 8.610 8.747 -0.137 1
1 35 . 6 1 1 A 9 9 TRP HA H 9 4.910 5.251 -0.341 1
1 44 . 6 1 1 A 9 9 TRP C C 9 174.610 175.722 -1.112 1
1 45 . 6 1 1 A 9 9 TRP CA C 9 57.630 56.000 1.630 1
1 46 . 6 1 1 A 9 9 TRP CB C 9 31.020 30.518 0.502 1
1 52 . 6 1 1 A 9 9 TRP N N 9 120.540 121.399 -0.859 1
1 54 . 6 1 1 A 10 10 TYR H H 10 9.260 8.925 0.335 1
1 55 . 6 1 1 A 10 10 TYR HA H 10 4.820 5.239 -0.419 1
1 62 . 6 1 1 A 10 10 TYR C C 10 174.340 175.329 -0.989 1
1 63 . 6 1 1 A 10 10 TYR CA C 10 57.050 56.494 0.556 1
1 64 . 6 1 1 A 10 10 TYR CB C 10 41.920 42.820 -0.900 1
1 69 . 6 1 1 A 10 10 TYR N N 10 118.990 121.906 -2.916 1
1 70 . 6 1 1 A 11 11 VAL H H 11 9.450 8.891 0.559 1
1 71 . 6 1 1 A 11 11 VAL HA H 11 4.470 4.691 -0.221 1
1 79 . 6 1 1 A 11 11 VAL C C 11 175.030 175.531 -0.501 1
1 80 . 6 1 1 A 11 11 VAL CA C 11 62.320 61.952 0.368 1
1 81 . 6 1 1 A 11 11 VAL CB C 11 32.400 32.697 -0.297 1
1 84 . 6 1 1 A 11 11 VAL N N 11 120.930 122.887 -1.957 1
1 85 . 6 1 1 A 12 12 VAL H H 12 9.320 8.674 0.646 1
1 86 . 6 1 1 A 12 12 VAL HA H 12 3.940 4.368 -0.428 1
1 94 . 6 1 1 A 12 12 VAL C C 12 173.870 174.102 -0.232 1
1 95 . 6 1 1 A 12 12 VAL CA C 12 61.330 60.882 0.448 1
1 96 . 6 1 1 A 12 12 VAL CB C 12 33.500 35.072 -1.572 1
1 99 . 6 1 1 A 12 12 VAL N N 12 128.860 127.174 1.686 1
1 100 . 6 1 1 A 13 13 GLN H H 13 8.830 8.808 0.022 1
1 101 . 6 1 1 A 13 13 GLN HA H 13 4.710 4.526 0.184 1
1 108 . 6 1 1 A 13 13 GLN C C 13 174.230 175.155 -0.925 1
1 109 . 6 1 1 A 13 13 GLN CA C 13 54.800 55.253 -0.453 1
1 110 . 6 1 1 A 13 13 GLN CB C 13 29.450 29.578 -0.128 1
1 111 . 6 1 1 A 13 13 GLN N N 13 126.050 128.010 -1.960 1
1 113 . 6 1 1 A 14 14 ALA H H 14 9.420 8.817 0.603 1
1 114 . 6 1 1 A 14 14 ALA HA H 14 5.150 4.943 0.207 1
1 118 . 6 1 1 A 14 14 ALA C C 14 176.400 175.989 0.411 1
1 119 . 6 1 1 A 14 14 ALA CA C 14 49.660 50.712 -1.052 1
1 120 . 6 1 1 A 14 14 ALA CB C 14 22.840 23.351 -0.511 1
1 121 . 6 1 1 A 14 14 ALA N N 14 131.620 127.387 4.233 1
1 122 . 6 1 1 A 15 15 PHE H H 15 8.070 8.807 -0.737 1
1 123 . 6 1 1 A 15 15 PHE HA H 15 4.410 4.686 -0.276 1
1 128 . 6 1 1 A 15 15 PHE C C 15 176.130 176.064 0.066 1
1 129 . 6 1 1 A 15 15 PHE CA C 15 58.550 58.661 -0.111 1
1 130 . 6 1 1 A 15 15 PHE CB C 15 39.780 39.474 0.306 1
1 133 . 6 1 1 A 15 15 PHE N N 15 119.680 119.120 0.560 1
1 134 . 6 1 1 A 16 16 SER H H 16 8.370 8.709 -0.339 1
1 135 . 6 1 1 A 16 16 SER HA H 16 4.140 4.156 -0.016 1
1 138 . 6 1 1 A 16 16 SER C C 16 175.820 174.933 0.887 1
1 139 . 6 1 1 A 16 16 SER CA C 16 60.570 59.772 0.798 1
1 140 . 6 1 1 A 16 16 SER CB C 16 63.030 62.859 0.171 1
1 141 . 6 1 1 A 16 16 SER N N 16 119.700 118.358 1.342 1
1 142 . 6 1 1 A 17 17 GLY H H 17 9.130 8.753 0.377 1
1 143 . 6 1 1 A 17 17 GLY HA2 H 17 3.640 3.677 -0.037 1
1 144 . 6 1 1 A 17 17 GLY HA3 H 17 4.200 3.902 0.298 1
1 145 . 6 1 1 A 17 17 GLY C C 17 175.520 175.216 0.304 1
1 146 . 6 1 1 A 17 17 GLY CA C 17 45.260 45.271 -0.011 1
1 147 . 6 1 1 A 17 17 GLY N N 17 115.850 115.065 0.785 1
1 148 . 6 1 1 A 18 18 PHE H H 18 8.480 7.566 0.914 1
1 149 . 6 1 1 A 18 18 PHE HA H 18 4.740 4.545 0.195 1
1 154 . 6 1 1 A 18 18 PHE C C 18 175.430 176.318 -0.888 1
1 155 . 6 1 1 A 18 18 PHE CA C 18 58.240 58.373 -0.133 1
1 156 . 6 1 1 A 18 18 PHE CB C 18 39.010 38.499 0.511 1
1 159 . 6 1 1 A 18 18 PHE N N 18 118.550 119.861 -1.311 1
1 160 . 6 1 1 A 19 19 GLU H H 19 10.690 8.262 2.428 1
1 161 . 6 1 1 A 19 19 GLU HA H 19 3.490 4.099 -0.609 1
1 166 . 6 1 1 A 19 19 GLU C C 19 177.650 179.180 -1.530 1
1 167 . 6 1 1 A 19 19 GLU CA C 19 62.280 59.888 2.392 1
1 168 . 6 1 1 A 19 19 GLU CB C 19 28.380 29.653 -1.273 1
1 170 . 6 1 1 A 19 19 GLU N N 19 123.470 122.973 0.497 1
1 171 . 6 1 1 A 20 20 GLY H H 20 8.740 8.302 0.438 1
1 172 . 6 1 1 A 20 20 GLY HA2 H 20 3.840 3.883 -0.043 1
1 173 . 6 1 1 A 20 20 GLY HA3 H 20 3.940 3.890 0.050 1
1 174 . 6 1 1 A 20 20 GLY C C 20 176.860 175.712 1.148 1
1 175 . 6 1 1 A 20 20 GLY CA C 20 47.140 46.936 0.204 1
1 176 . 6 1 1 A 20 20 GLY N N 20 105.480 107.502 -2.022 1
1 177 . 6 1 1 A 21 21 ARG H H 21 7.690 8.305 -0.615 1
1 178 . 6 1 1 A 21 21 ARG HA H 21 4.180 4.140 0.040 1
1 185 . 6 1 1 A 21 21 ARG C C 21 179.490 178.289 1.201 1
1 186 . 6 1 1 A 21 21 ARG CA C 21 58.660 58.987 -0.327 1
1 187 . 6 1 1 A 21 21 ARG CB C 21 30.100 29.849 0.251 1
1 190 . 6 1 1 A 21 21 ARG N N 21 123.120 122.119 1.001 1
1 191 . 6 1 1 A 22 22 VAL H H 22 8.980 8.836 0.144 1
1 192 . 6 1 1 A 22 22 VAL HA H 22 3.560 3.696 -0.136 1
1 200 . 6 1 1 A 22 22 VAL C C 22 177.320 178.411 -1.091 1
1 201 . 6 1 1 A 22 22 VAL CA C 22 66.960 66.298 0.662 1
1 202 . 6 1 1 A 22 22 VAL CB C 22 31.050 31.454 -0.404 1
1 205 . 6 1 1 A 22 22 VAL N N 22 122.760 119.433 3.327 1
1 206 . 6 1 1 A 23 23 ALA H H 23 8.280 7.928 0.352 1
1 207 . 6 1 1 A 23 23 ALA HA H 23 3.850 4.067 -0.217 1
1 211 . 6 1 1 A 23 23 ALA C C 23 179.340 179.701 -0.361 1
1 212 . 6 1 1 A 23 23 ALA CA C 23 56.260 55.303 0.957 1
1 213 . 6 1 1 A 23 23 ALA CB C 23 18.260 18.277 -0.017 1
1 214 . 6 1 1 A 23 23 ALA N N 23 122.120 121.744 0.376 1
1 215 . 6 1 1 A 24 24 THR H H 24 8.020 7.352 0.668 1
1 216 . 6 1 1 A 24 24 THR HA H 24 3.920 3.934 -0.014 1
1 221 . 6 1 1 A 24 24 THR C C 24 176.940 176.677 0.263 1
1 222 . 6 1 1 A 24 24 THR CA C 24 66.820 66.432 0.388 1
1 223 . 6 1 1 A 24 24 THR CB C 24 68.930 68.296 0.634 1
1 225 . 6 1 1 A 24 24 THR N N 24 113.410 115.172 -1.762 1
1 226 . 6 1 1 A 25 25 SER H H 25 8.570 7.688 0.882 1
1 227 . 6 1 1 A 25 25 SER HA H 25 4.400 4.042 0.358 1
1 230 . 6 1 1 A 25 25 SER C C 25 177.610 176.299 1.311 1
1 231 . 6 1 1 A 25 25 SER CA C 25 61.920 62.361 -0.441 1
1 232 . 6 1 1 A 25 25 SER CB C 25 63.540 62.853 0.687 1
1 233 . 6 1 1 A 25 25 SER N N 25 118.260 118.260 0.000 1
1 234 . 6 1 1 A 26 26 LEU H H 26 9.430 8.038 1.392 1
1 235 . 6 1 1 A 26 26 LEU HA H 26 3.900 3.947 -0.047 1
1 245 . 6 1 1 A 26 26 LEU C C 26 177.710 178.658 -0.948 1
1 246 . 6 1 1 A 26 26 LEU CA C 26 58.910 58.151 0.759 1
1 247 . 6 1 1 A 26 26 LEU CB C 26 41.300 41.399 -0.099 1
1 251 . 6 1 1 A 26 26 LEU N N 26 124.120 121.562 2.558 1
1 252 . 6 1 1 A 27 27 ARG H H 27 7.790 7.470 0.320 1
1 253 . 6 1 1 A 27 27 ARG HA H 27 3.880 3.697 0.183 1
1 260 . 6 1 1 A 27 27 ARG C C 27 179.380 178.634 0.746 1
1 261 . 6 1 1 A 27 27 ARG CA C 27 60.510 59.557 0.953 1
1 262 . 6 1 1 A 27 27 ARG CB C 27 29.670 29.648 0.022 1
1 265 . 6 1 1 A 27 27 ARG N N 27 116.710 119.253 -2.543 1
1 266 . 6 1 1 A 28 28 GLU H H 28 7.900 7.410 0.490 1
1 267 . 6 1 1 A 28 28 GLU HA H 28 4.070 3.939 0.131 1
1 272 . 6 1 1 A 28 28 GLU C C 28 179.450 179.101 0.349 1
1 273 . 6 1 1 A 28 28 GLU CA C 28 59.450 58.650 0.800 1
1 274 . 6 1 1 A 28 28 GLU CB C 28 29.610 29.359 0.251 1
1 276 . 6 1 1 A 28 28 GLU N N 28 118.340 118.743 -0.403 1
1 277 . 6 1 1 A 29 29 HIS H H 29 8.940 7.817 1.123 1
1 278 . 6 1 1 A 29 29 HIS HA H 29 4.160 4.408 -0.248 1
1 283 . 6 1 1 A 29 29 HIS C C 29 177.750 177.798 -0.048 1
1 284 . 6 1 1 A 29 29 HIS CA C 29 61.260 58.838 2.422 1
1 285 . 6 1 1 A 29 29 HIS CB C 29 29.870 30.127 -0.257 1
1 287 . 6 1 1 A 29 29 HIS N N 29 120.440 118.504 1.936 1
1 288 . 6 1 1 A 30 30 ILE H H 30 8.580 8.842 -0.262 1
1 289 . 6 1 1 A 30 30 ILE HA H 30 3.160 3.670 -0.510 1
1 299 . 6 1 1 A 30 30 ILE C C 30 177.230 178.053 -0.823 1
1 300 . 6 1 1 A 30 30 ILE CA C 30 66.460 65.200 1.260 1
1 301 . 6 1 1 A 30 30 ILE CB C 30 38.630 37.657 0.973 1
1 305 . 6 1 1 A 30 30 ILE N N 30 121.010 119.894 1.116 1
1 306 . 6 1 1 A 31 31 LYS H H 31 7.020 8.482 -1.462 1
1 307 . 6 1 1 A 31 31 LYS HA H 31 4.170 3.988 0.182 1
1 316 . 6 1 1 A 31 31 LYS C C 31 180.570 178.751 1.819 1
1 317 . 6 1 1 A 31 31 LYS CA C 31 58.920 59.795 -0.875 1
1 318 . 6 1 1 A 31 31 LYS CB C 31 32.490 31.942 0.548 1
1 322 . 6 1 1 A 31 31 LYS N N 31 117.400 121.017 -3.617 1
1 323 . 6 1 1 A 32 32 LEU H H 32 8.400 8.422 -0.022 1
1 324 . 6 1 1 A 32 32 LEU HA H 32 3.990 3.960 0.030 1
1 334 . 6 1 1 A 32 32 LEU C C 32 178.230 178.984 -0.754 1
1 335 . 6 1 1 A 32 32 LEU CA C 32 57.700 57.801 -0.101 1
1 336 . 6 1 1 A 32 32 LEU CB C 32 42.540 41.837 0.703 1
1 340 . 6 1 1 A 32 32 LEU N N 32 121.180 119.428 1.752 1
1 341 . 6 1 1 A 33 33 HIS H H 33 7.620 7.945 -0.325 1
1 342 . 6 1 1 A 33 33 HIS HA H 33 4.600 4.638 -0.038 1
1 347 . 6 1 1 A 33 33 HIS C C 33 177.090 174.312 2.778 1
1 348 . 6 1 1 A 33 33 HIS CA C 33 55.840 56.362 -0.522 1
1 349 . 6 1 1 A 33 33 HIS CB C 33 29.330 29.728 -0.398 1
1 351 . 6 1 1 A 33 33 HIS N N 33 112.220 115.878 -3.658 1
1 352 . 6 1 1 A 34 34 ASN H H 34 8.030 8.216 -0.186 1
1 353 . 6 1 1 A 34 34 ASN HA H 34 4.890 4.454 0.436 1
1 358 . 6 1 1 A 34 34 ASN C C 34 175.910 175.387 0.523 1
1 359 . 6 1 1 A 34 34 ASN CA C 34 54.530 54.433 0.097 1
1 360 . 6 1 1 A 34 34 ASN CB C 34 37.380 36.694 0.686 1
1 361 . 6 1 1 A 34 34 ASN N N 34 117.600 114.454 3.146 1
1 363 . 6 1 1 A 35 35 MET H H 35 8.330 8.366 -0.036 1
1 364 . 6 1 1 A 35 35 MET HA H 35 4.940 4.692 0.248 1
1 372 . 6 1 1 A 35 35 MET C C 35 176.880 177.169 -0.289 1
1 373 . 6 1 1 A 35 35 MET CA C 35 55.600 55.151 0.449 1
1 374 . 6 1 1 A 35 35 MET CB C 35 33.790 32.804 0.986 1
1 377 . 6 1 1 A 35 35 MET N N 35 116.190 116.015 0.175 1
1 378 . 6 1 1 A 36 36 GLU H H 36 9.730 8.150 1.580 1
1 379 . 6 1 1 A 36 36 GLU HA H 36 3.850 4.198 -0.348 1
1 384 . 6 1 1 A 36 36 GLU C C 36 178.290 178.840 -0.550 1
1 385 . 6 1 1 A 36 36 GLU CA C 36 61.280 59.511 1.769 1
1 386 . 6 1 1 A 36 36 GLU CB C 36 29.270 29.339 -0.069 1
1 388 . 6 1 1 A 36 36 GLU N N 36 121.630 120.190 1.440 1
1 389 . 6 1 1 A 37 37 ASP H H 37 8.850 8.148 0.702 1
1 390 . 6 1 1 A 37 37 ASP HA H 37 4.470 4.395 0.075 1
1 393 . 6 1 1 A 37 37 ASP C C 37 177.190 178.998 -1.808 1
1 394 . 6 1 1 A 37 37 ASP CA C 37 56.140 57.438 -1.298 1
1 395 . 6 1 1 A 37 37 ASP CB C 37 40.050 40.584 -0.534 1
1 396 . 6 1 1 A 37 37 ASP N N 37 114.390 119.716 -5.326 1
1 397 . 6 1 1 A 38 38 LEU H H 38 7.880 8.050 -0.170 1
1 398 . 6 1 1 A 38 38 LEU HA H 38 4.290 4.146 0.144 1
1 408 . 6 1 1 A 38 38 LEU C C 38 175.090 177.625 -2.535 1
1 409 . 6 1 1 A 38 38 LEU CA C 38 54.670 57.355 -2.685 1
1 410 . 6 1 1 A 38 38 LEU CB C 38 42.940 42.328 0.612 1
1 414 . 6 1 1 A 38 38 LEU N N 38 116.550 119.326 -2.776 1
1 415 . 6 1 1 A 39 39 PHE H H 39 7.500 7.652 -0.152 1
1 416 . 6 1 1 A 39 39 PHE HA H 39 4.970 4.481 0.489 1
1 424 . 6 1 1 A 39 39 PHE C C 39 175.380 175.549 -0.169 1
1 425 . 6 1 1 A 39 39 PHE CA C 39 57.580 58.552 -0.972 1
1 426 . 6 1 1 A 39 39 PHE CB C 39 44.990 39.479 5.511 1
1 432 . 6 1 1 A 39 39 PHE N N 39 115.370 117.079 -1.709 1
1 433 . 6 1 1 A 40 40 GLY H H 40 8.680 8.877 -0.197 1
1 434 . 6 1 1 A 40 40 GLY HA2 H 40 3.370 3.986 -0.616 1
1 435 . 6 1 1 A 40 40 GLY HA3 H 40 4.550 4.065 0.485 1
1 436 . 6 1 1 A 40 40 GLY C C 40 173.090 174.002 -0.912 1
1 437 . 6 1 1 A 40 40 GLY CA C 40 44.180 46.325 -2.145 1
1 438 . 6 1 1 A 40 40 GLY N N 40 110.930 111.510 -0.580 1
1 439 . 6 1 1 A 41 41 GLU H H 41 8.320 7.857 0.463 1
1 440 . 6 1 1 A 41 41 GLU HA H 41 4.280 4.975 -0.695 1
1 445 . 6 1 1 A 41 41 GLU C C 41 173.900 174.412 -0.512 1
1 446 . 6 1 1 A 41 41 GLU CA C 41 56.900 55.003 1.897 1
1 447 . 6 1 1 A 41 41 GLU CB C 41 32.110 33.592 -1.482 1
1 449 . 6 1 1 A 41 41 GLU N N 41 126.730 119.671 7.059 1
1 450 . 6 1 1 A 42 42 VAL H H 42 8.100 8.694 -0.594 1
1 451 . 6 1 1 A 42 42 VAL HA H 42 5.160 5.055 0.105 1
1 459 . 6 1 1 A 42 42 VAL C C 42 176.340 174.924 1.416 1
1 460 . 6 1 1 A 42 42 VAL CA C 42 61.200 60.860 0.340 1
1 461 . 6 1 1 A 42 42 VAL CB C 42 34.770 35.026 -0.256 1
1 464 . 6 1 1 A 42 42 VAL N N 42 119.360 125.197 -5.837 1
1 465 . 6 1 1 A 43 43 MET H H 43 9.870 9.316 0.554 1
1 466 . 6 1 1 A 43 43 MET HA H 43 5.070 5.405 -0.335 1
1 474 . 6 1 1 A 43 43 MET C C 43 173.890 175.650 -1.760 1
1 475 . 6 1 1 A 43 43 MET CA C 43 54.740 54.151 0.589 1
1 476 . 6 1 1 A 43 43 MET CB C 43 37.500 36.549 0.951 1
1 479 . 6 1 1 A 43 43 MET N N 43 125.720 124.495 1.225 1
1 480 . 6 1 1 A 44 44 VAL H H 44 8.800 8.805 -0.005 1
1 481 . 6 1 1 A 44 44 VAL HA H 44 4.720 4.681 0.039 1
1 489 . 6 1 1 A 44 44 VAL CA C 44 59.090 59.073 0.017 1
1 490 . 6 1 1 A 44 44 VAL CB C 44 33.710 33.499 0.211 1
1 493 . 6 1 1 A 44 44 VAL N N 44 122.340 123.532 -1.192 1
1 494 . 6 1 1 A 45 45 PRO HA H 45 4.480 4.513 -0.033 1
1 501 . 6 1 1 A 45 45 PRO C C 45 177.080 175.747 1.333 1
1 502 . 6 1 1 A 45 45 PRO CA C 45 63.240 63.496 -0.256 1
1 503 . 6 1 1 A 45 45 PRO CB C 45 32.170 31.076 1.094 1
1 506 . 6 1 1 A 46 46 THR H H 46 8.200 7.358 0.842 1
1 507 . 6 1 1 A 46 46 THR HA H 46 4.290 4.330 -0.040 1
1 512 . 6 1 1 A 46 46 THR C C 46 174.600 174.270 0.330 1
1 513 . 6 1 1 A 46 46 THR CA C 46 62.100 60.807 1.293 1
1 514 . 6 1 1 A 46 46 THR CB C 46 69.990 70.235 -0.245 1
1 516 . 6 1 1 A 46 46 THR N N 46 113.410 109.663 3.747 1
1 517 . 6 1 1 A 47 47 GLU H H 47 8.380 9.114 -0.734 1
1 518 . 6 1 1 A 47 47 GLU HA H 47 4.400 4.005 0.395 1
1 521 . 6 1 1 A 47 47 GLU C C 47 175.970 176.317 -0.347 1
1 522 . 6 1 1 A 47 47 GLU CA C 47 55.200 57.025 -1.825 1
1 523 . 6 1 1 A 47 47 GLU CB C 47 32.300 28.208 4.092 1
1 524 . 6 1 1 A 47 47 GLU N N 47 122.830 120.994 1.836 1
1 525 . 6 1 1 A 48 48 GLU H H 48 8.400 8.029 0.371 1
1 526 . 6 1 1 A 48 48 GLU HA H 48 4.280 4.086 0.194 1
1 531 . 6 1 1 A 48 48 GLU C C 48 175.750 176.301 -0.551 1
1 532 . 6 1 1 A 48 48 GLU CA C 48 55.190 58.875 -3.685 1
1 533 . 6 1 1 A 48 48 GLU CB C 48 31.980 29.950 2.030 1
1 535 . 6 1 1 A 48 48 GLU N N 48 121.950 121.338 0.612 1
1 536 . 6 1 1 A 49 49 VAL H H 49 8.240 8.157 0.083 1
1 537 . 6 1 1 A 49 49 VAL HA H 49 4.170 4.405 -0.235 1
1 542 . 6 1 1 A 49 49 VAL C C 49 174.610 175.635 -1.025 1
1 543 . 6 1 1 A 49 49 VAL CA C 49 62.280 60.764 1.516 1
1 544 . 6 1 1 A 49 49 VAL CB C 49 32.930 34.309 -1.379 1
1 546 . 6 1 1 A 49 49 VAL N N 49 123.990 119.810 4.180 1
1 547 . 6 1 1 A 50 50 VAL H H 50 8.230 8.624 -0.394 1
1 548 . 6 1 1 A 50 50 VAL HA H 50 4.220 3.861 0.359 1
1 553 . 6 1 1 A 50 50 VAL C C 50 175.770 177.851 -2.081 1
1 554 . 6 1 1 A 50 50 VAL CA C 50 62.170 66.410 -4.240 1
1 555 . 6 1 1 A 50 50 VAL CB C 50 33.110 31.474 1.636 1
1 557 . 6 1 1 A 50 50 VAL N N 50 123.960 125.561 -1.601 1
1 558 . 6 1 1 A 51 51 GLU H H 51 8.570 7.956 0.614 1
1 559 . 6 1 1 A 51 51 GLU HA H 51 4.380 4.084 0.296 1
1 564 . 6 1 1 A 51 51 GLU C C 51 175.920 176.391 -0.471 1
1 565 . 6 1 1 A 51 51 GLU CA C 51 56.050 59.031 -2.981 1
1 566 . 6 1 1 A 51 51 GLU CB C 51 31.080 29.967 1.113 1
1 568 . 6 1 1 A 51 51 GLU N N 51 125.070 120.190 4.880 1
1 569 . 6 1 1 A 52 52 ILE H H 52 8.320 8.210 0.110 1
1 570 . 6 1 1 A 52 52 ILE HA H 52 4.290 4.304 -0.014 1
1 580 . 6 1 1 A 52 52 ILE C C 52 176.330 175.896 0.434 1
1 581 . 6 1 1 A 52 52 ILE CA C 52 60.940 60.607 0.333 1
1 582 . 6 1 1 A 52 52 ILE CB C 52 38.510 38.689 -0.179 1
1 586 . 6 1 1 A 52 52 ILE N N 52 122.760 118.219 4.541 1
1 587 . 6 1 1 A 53 53 ARG H H 53 8.500 8.963 -0.463 1
1 588 . 6 1 1 A 53 53 ARG HA H 53 4.430 4.050 0.380 1
1 595 . 6 1 1 A 53 53 ARG C C 53 176.950 176.861 0.089 1
1 596 . 6 1 1 A 53 53 ARG CA C 53 56.150 57.664 -1.514 1
1 597 . 6 1 1 A 53 53 ARG CB C 53 30.200 30.750 -0.550 1
1 600 . 6 1 1 A 53 53 ARG N N 53 125.250 129.110 -3.860 1
1 601 . 6 1 1 A 54 54 GLY H H 54 8.760 7.959 0.801 1
1 602 . 6 1 1 A 54 54 GLY HA2 H 54 3.920 4.070 -0.150 1
1 603 . 6 1 1 A 54 54 GLY HA3 H 54 4.010 4.073 -0.063 1
1 604 . 6 1 1 A 54 54 GLY C C 54 175.110 174.492 0.618 1
1 605 . 6 1 1 A 54 54 GLY CA C 54 46.030 44.472 1.558 1
1 606 . 6 1 1 A 54 54 GLY N N 54 112.510 106.646 5.864 1
1 607 . 6 1 1 A 55 55 GLY H H 55 8.350 8.567 -0.217 1
1 608 . 6 1 1 A 55 55 GLY HA2 H 55 3.980 3.981 -0.001 1
1 609 . 6 1 1 A 55 55 GLY HA3 H 55 3.980 3.988 -0.008 1
1 610 . 6 1 1 A 55 55 GLY C C 55 173.920 175.318 -1.398 1
1 611 . 6 1 1 A 55 55 GLY CA C 55 45.200 46.546 -1.346 1
1 612 . 6 1 1 A 55 55 GLY N N 55 107.940 107.561 0.379 1
1 613 . 6 1 1 A 56 56 GLN H H 56 8.100 8.044 0.056 1
1 614 . 6 1 1 A 56 56 GLN HA H 56 4.420 3.993 0.427 1
1 619 . 6 1 1 A 56 56 GLN C C 56 175.570 176.509 -0.939 1
1 620 . 6 1 1 A 56 56 GLN CA C 56 55.420 58.524 -3.104 1
1 621 . 6 1 1 A 56 56 GLN CB C 56 30.100 28.817 1.283 1
1 623 . 6 1 1 A 56 56 GLN N N 56 119.350 120.647 -1.297 1
1 624 . 6 1 1 A 57 57 ARG H H 57 8.520 7.527 0.993 1
1 625 . 6 1 1 A 57 57 ARG HA H 57 4.400 4.355 0.045 1
1 632 . 6 1 1 A 57 57 ARG C C 57 176.210 177.368 -1.158 1
1 633 . 6 1 1 A 57 57 ARG CA C 57 56.440 56.207 0.233 1
1 634 . 6 1 1 A 57 57 ARG CB C 57 30.930 30.668 0.262 1
1 637 . 6 1 1 A 57 57 ARG N N 57 122.610 118.992 3.618 1
1 638 . 6 1 1 A 58 58 ARG H H 58 8.630 8.808 -0.178 1
1 639 . 6 1 1 A 58 58 ARG HA H 58 4.430 3.949 0.481 1
1 646 . 6 1 1 A 58 58 ARG C C 58 175.950 178.079 -2.129 1
1 647 . 6 1 1 A 58 58 ARG CA C 58 55.450 59.794 -4.344 1
1 648 . 6 1 1 A 58 58 ARG CB C 58 31.300 29.834 1.466 1
1 651 . 6 1 1 A 58 58 ARG N N 58 123.320 122.609 0.711 1
1 652 . 6 1 1 A 59 59 LYS H H 59 8.560 7.720 0.840 1
1 653 . 6 1 1 A 59 59 LYS HA H 59 4.410 4.052 0.358 1
1 662 . 6 1 1 A 59 59 LYS C C 59 176.590 176.458 0.132 1
1 663 . 6 1 1 A 59 59 LYS CA C 59 56.720 59.027 -2.307 1
1 664 . 6 1 1 A 59 59 LYS CB C 59 33.150 31.980 1.170 1
1 668 . 6 1 1 A 59 59 LYS N N 59 123.380 119.887 3.493 1
1 669 . 6 1 1 A 60 60 SER H H 60 8.450 7.908 0.542 1
1 670 . 6 1 1 A 60 60 SER HA H 60 4.480 4.176 0.304 1
1 673 . 6 1 1 A 60 60 SER C C 60 174.280 173.265 1.015 1
1 674 . 6 1 1 A 60 60 SER CA C 60 58.140 59.221 -1.081 1
1 675 . 6 1 1 A 60 60 SER CB C 60 64.160 60.920 3.240 1
1 676 . 6 1 1 A 60 60 SER N N 60 117.320 112.622 4.698 1
1 677 . 6 1 1 A 61 61 GLU H H 61 8.550 7.847 0.703 1
1 678 . 6 1 1 A 61 61 GLU HA H 61 4.400 4.727 -0.327 1
1 683 . 6 1 1 A 61 61 GLU C C 61 176.150 175.675 0.475 1
1 684 . 6 1 1 A 61 61 GLU CA C 61 56.300 54.844 1.456 1
1 685 . 6 1 1 A 61 61 GLU CB C 61 30.790 31.288 -0.498 1
1 687 . 6 1 1 A 61 61 GLU N N 61 122.810 119.174 3.636 1
1 688 . 6 1 1 A 62 62 ARG H H 62 8.310 8.717 -0.407 1
1 689 . 6 1 1 A 62 62 ARG HA H 62 4.340 4.779 -0.439 1
1 692 . 6 1 1 A 62 62 ARG C C 62 176.140 176.195 -0.055 1
1 693 . 6 1 1 A 62 62 ARG CA C 62 56.230 54.267 1.963 1
1 694 . 6 1 1 A 62 62 ARG CB C 62 30.780 30.666 0.114 1
1 695 . 6 1 1 A 62 62 ARG N N 62 122.080 122.203 -0.123 1
1 696 . 6 1 1 A 63 63 LYS H H 63 8.470 8.541 -0.071 1
1 697 . 6 1 1 A 63 63 LYS HA H 63 4.300 3.974 0.326 1
1 700 . 6 1 1 A 63 63 LYS C C 63 175.490 178.545 -3.055 1
1 701 . 6 1 1 A 63 63 LYS CA C 63 56.200 58.864 -2.664 1
1 702 . 6 1 1 A 63 63 LYS CB C 63 30.730 31.749 -1.019 1
1 703 . 6 1 1 A 63 63 LYS N N 63 123.450 124.172 -0.722 1
1 704 . 6 1 1 A 64 64 PHE H H 64 8.200 7.882 0.318 1
1 705 . 6 1 1 A 64 64 PHE HA H 64 4.450 4.127 0.323 1
1 710 . 6 1 1 A 64 64 PHE C C 64 174.250 175.793 -1.543 1
1 711 . 6 1 1 A 64 64 PHE CA C 64 57.430 59.950 -2.520 1
1 712 . 6 1 1 A 64 64 PHE CB C 64 40.330 39.383 0.947 1
1 715 . 6 1 1 A 64 64 PHE N N 64 121.740 117.932 3.808 1
1 716 . 6 1 1 A 65 65 PHE H H 65 8.130 8.231 -0.101 1
1 717 . 6 1 1 A 65 65 PHE HA H 65 4.440 5.081 -0.641 1
1 725 . 6 1 1 A 65 65 PHE CA C 65 55.650 55.332 0.318 1
1 726 . 6 1 1 A 65 65 PHE CB C 65 38.900 38.981 -0.081 1
1 731 . 6 1 1 A 65 65 PHE N N 65 120.910 116.940 3.970 1
1 732 . 6 1 1 A 66 66 PRO C C 66 176.780 177.918 -1.138 1
1 733 . 6 1 1 A 67 67 GLY H H 67 9.970 8.900 1.070 1
1 734 . 6 1 1 A 67 67 GLY HA2 H 67 3.820 4.040 -0.220 1
1 735 . 6 1 1 A 67 67 GLY HA3 H 67 4.400 4.051 0.349 1
1 736 . 6 1 1 A 67 67 GLY C C 67 173.670 174.175 -0.505 1
1 737 . 6 1 1 A 67 67 GLY CA C 67 45.900 46.062 -0.162 1
1 738 . 6 1 1 A 67 67 GLY N N 67 111.550 112.958 -1.408 1
1 739 . 6 1 1 A 68 68 TYR H H 68 7.650 8.104 -0.454 1
1 740 . 6 1 1 A 68 68 TYR HA H 68 5.000 4.817 0.183 1
1 747 . 6 1 1 A 68 68 TYR C C 68 175.220 174.903 0.317 1
1 748 . 6 1 1 A 68 68 TYR CA C 68 57.940 57.252 0.688 1
1 753 . 6 1 1 A 68 68 TYR N N 68 118.800 118.870 -0.070 1
1 754 . 6 1 1 A 69 69 VAL H H 69 9.090 8.680 0.410 1
1 755 . 6 1 1 A 69 69 VAL HA H 69 4.330 4.860 -0.530 1
1 763 . 6 1 1 A 69 69 VAL C C 69 174.250 174.882 -0.632 1
1 764 . 6 1 1 A 69 69 VAL CA C 69 62.120 60.324 1.796 1
1 765 . 6 1 1 A 69 69 VAL CB C 69 35.240 35.905 -0.665 1
1 768 . 6 1 1 A 69 69 VAL N N 69 119.300 122.616 -3.316 1
1 769 . 6 1 1 A 70 70 LEU H H 70 9.190 8.842 0.348 1
1 770 . 6 1 1 A 70 70 LEU HA H 70 5.460 5.358 0.102 1
1 780 . 6 1 1 A 70 70 LEU C C 70 176.130 176.135 -0.005 1
1 781 . 6 1 1 A 70 70 LEU CA C 70 54.120 53.396 0.724 1
1 782 . 6 1 1 A 70 70 LEU CB C 70 43.330 43.260 0.070 1
1 786 . 6 1 1 A 70 70 LEU N N 70 126.710 126.782 -0.072 1
1 787 . 6 1 1 A 71 71 VAL H H 71 9.350 9.044 0.306 1
1 788 . 6 1 1 A 71 71 VAL HA H 71 5.040 4.833 0.207 1
1 796 . 6 1 1 A 71 71 VAL C C 71 173.670 174.615 -0.945 1
1 797 . 6 1 1 A 71 71 VAL CA C 71 61.090 61.427 -0.337 1
1 798 . 6 1 1 A 71 71 VAL CB C 71 35.800 35.492 0.308 1
1 801 . 6 1 1 A 71 71 VAL N N 71 121.920 124.947 -3.027 1
1 802 . 6 1 1 A 72 72 GLN H H 72 8.390 8.962 -0.572 1
1 803 . 6 1 1 A 72 72 GLN HA H 72 4.610 4.526 0.084 1
1 810 . 6 1 1 A 72 72 GLN C C 72 175.920 174.726 1.194 1
1 811 . 6 1 1 A 72 72 GLN CA C 72 53.810 55.038 -1.228 1
1 812 . 6 1 1 A 72 72 GLN CB C 72 28.850 28.552 0.298 1
1 814 . 6 1 1 A 72 72 GLN N N 72 130.760 127.897 2.863 1
1 816 . 6 1 1 A 73 73 MET H H 73 9.750 8.701 1.049 1
1 817 . 6 1 1 A 73 73 MET HA H 73 5.060 5.200 -0.140 1
1 825 . 6 1 1 A 73 73 MET C C 73 175.500 175.032 0.468 1
1 826 . 6 1 1 A 73 73 MET CA C 73 55.520 54.478 1.042 1
1 827 . 6 1 1 A 73 73 MET CB C 73 35.350 35.571 -0.221 1
1 830 . 6 1 1 A 73 73 MET N N 73 121.070 124.960 -3.890 1
1 831 . 6 1 1 A 74 74 VAL H H 74 8.530 8.743 -0.213 1
1 832 . 6 1 1 A 74 74 VAL HA H 74 3.970 4.143 -0.173 1
1 840 . 6 1 1 A 74 74 VAL C C 74 174.900 175.412 -0.512 1
1 841 . 6 1 1 A 74 74 VAL CA C 74 62.150 62.757 -0.607 1
1 842 . 6 1 1 A 74 74 VAL CB C 74 32.480 31.943 0.537 1
1 845 . 6 1 1 A 74 74 VAL N N 74 124.120 123.323 0.797 1
1 846 . 6 1 1 A 75 75 MET H H 75 8.600 8.737 -0.137 1
1 847 . 6 1 1 A 75 75 MET HA H 75 4.360 4.615 -0.255 1
1 855 . 6 1 1 A 75 75 MET C C 75 173.480 175.268 -1.788 1
1 856 . 6 1 1 A 75 75 MET CA C 75 53.830 54.040 -0.210 1
1 857 . 6 1 1 A 75 75 MET CB C 75 29.960 33.614 -3.654 1
1 860 . 6 1 1 A 75 75 MET N N 75 128.250 126.220 2.030 1
1 861 . 6 1 1 A 76 76 ASN H H 76 8.410 8.444 -0.034 1
1 862 . 6 1 1 A 76 76 ASN HA H 76 4.540 4.980 -0.440 1
1 867 . 6 1 1 A 76 76 ASN C C 76 173.950 174.980 -1.030 1
1 868 . 6 1 1 A 76 76 ASN CA C 76 51.720 51.709 0.011 1
1 869 . 6 1 1 A 76 76 ASN CB C 76 38.430 41.326 -2.896 1
1 870 . 6 1 1 A 76 76 ASN N N 76 127.500 124.018 3.482 1
1 872 . 6 1 1 A 77 77 ASP H H 77 8.470 9.042 -0.572 1
1 873 . 6 1 1 A 77 77 ASP HA H 77 4.410 4.166 0.244 1
1 876 . 6 1 1 A 77 77 ASP C C 77 178.530 178.324 0.206 1
1 877 . 6 1 1 A 77 77 ASP CA C 77 58.730 57.266 1.464 1
1 878 . 6 1 1 A 77 77 ASP CB C 77 40.940 40.600 0.340 1
1 879 . 6 1 1 A 77 77 ASP N N 77 117.090 121.146 -4.056 1
1 880 . 6 1 1 A 78 78 ALA H H 78 8.160 8.087 0.073 1
1 881 . 6 1 1 A 78 78 ALA HA H 78 4.350 4.230 0.120 1
1 885 . 6 1 1 A 78 78 ALA C C 78 181.250 180.056 1.194 1
1 886 . 6 1 1 A 78 78 ALA CA C 78 55.190 55.448 -0.258 1
1 887 . 6 1 1 A 78 78 ALA CB C 78 18.260 18.629 -0.369 1
1 888 . 6 1 1 A 78 78 ALA N N 78 122.500 123.754 -1.254 1
1 889 . 6 1 1 A 79 79 SER H H 79 9.320 8.403 0.917 1
1 890 . 6 1 1 A 79 79 SER HA H 79 4.290 4.255 0.035 1
1 893 . 6 1 1 A 79 79 SER C C 79 176.570 176.507 0.063 1
1 894 . 6 1 1 A 79 79 SER CA C 79 61.080 61.492 -0.412 1
1 895 . 6 1 1 A 79 79 SER CB C 79 62.200 62.138 0.062 1
1 896 . 6 1 1 A 79 79 SER N N 79 119.280 112.409 6.871 1
1 897 . 6 1 1 A 80 80 TRP H H 80 8.900 7.842 1.058 1
1 898 . 6 1 1 A 80 80 TRP HA H 80 4.020 4.181 -0.161 1
1 907 . 6 1 1 A 80 80 TRP C C 80 178.210 178.466 -0.256 1
1 908 . 6 1 1 A 80 80 TRP CA C 80 62.490 61.214 1.276 1
1 909 . 6 1 1 A 80 80 TRP CB C 80 29.800 29.267 0.533 1
1 915 . 6 1 1 A 80 80 TRP N N 80 125.870 123.570 2.300 1
1 917 . 6 1 1 A 81 81 HIS H H 81 8.190 7.708 0.482 1
1 918 . 6 1 1 A 81 81 HIS HA H 81 3.930 4.222 -0.292 1
1 923 . 6 1 1 A 81 81 HIS C C 81 177.740 177.686 0.054 1
1 924 . 6 1 1 A 81 81 HIS CA C 81 61.020 59.606 1.414 1
1 925 . 6 1 1 A 81 81 HIS CB C 81 28.910 30.342 -1.432 1
1 927 . 6 1 1 A 81 81 HIS N N 81 114.080 117.359 -3.279 1
1 928 . 6 1 1 A 82 82 LEU H H 82 8.080 8.111 -0.031 1
1 929 . 6 1 1 A 82 82 LEU HA H 82 3.900 3.935 -0.035 1
1 939 . 6 1 1 A 82 82 LEU C C 82 180.330 178.557 1.773 1
1 940 . 6 1 1 A 82 82 LEU CA C 82 58.590 58.359 0.231 1
1 941 . 6 1 1 A 82 82 LEU CB C 82 41.350 41.577 -0.227 1
1 945 . 6 1 1 A 82 82 LEU N N 82 121.320 121.500 -0.180 1
1 946 . 6 1 1 A 83 83 VAL H H 83 8.000 8.442 -0.442 1
1 947 . 6 1 1 A 83 83 VAL HA H 83 3.210 3.466 -0.256 1
1 955 . 6 1 1 A 83 83 VAL C C 83 177.060 177.414 -0.354 1
1 956 . 6 1 1 A 83 83 VAL CA C 83 67.430 66.650 0.780 1
1 957 . 6 1 1 A 83 83 VAL CB C 83 31.680 31.282 0.398 1
1 960 . 6 1 1 A 83 83 VAL N N 83 118.850 119.195 -0.345 1
1 961 . 6 1 1 A 84 84 ARG H H 84 7.540 7.863 -0.323 1
1 962 . 6 1 1 A 84 84 ARG HA H 84 3.590 3.745 -0.155 1
1 969 . 6 1 1 A 84 84 ARG C C 84 177.240 178.900 -1.660 1
1 970 . 6 1 1 A 84 84 ARG CA C 84 56.050 59.535 -3.485 1
1 971 . 6 1 1 A 84 84 ARG CB C 84 28.190 29.664 -1.474 1
1 974 . 6 1 1 A 84 84 ARG N N 84 111.460 119.713 -8.253 1
1 975 . 6 1 1 A 85 85 SER H H 85 7.530 8.163 -0.633 1
1 976 . 6 1 1 A 85 85 SER HA H 85 4.280 4.265 0.015 1
1 979 . 6 1 1 A 85 85 SER C C 85 173.930 174.755 -0.825 1
1 980 . 6 1 1 A 85 85 SER CA C 85 59.220 60.412 -1.192 1
1 981 . 6 1 1 A 85 85 SER CB C 85 63.830 62.988 0.842 1
1 982 . 6 1 1 A 85 85 SER N N 85 113.660 113.522 0.138 1
1 983 . 6 1 1 A 86 86 VAL H H 86 7.230 7.262 -0.032 1
1 984 . 6 1 1 A 86 86 VAL HA H 86 3.480 3.601 -0.121 1
1 992 . 6 1 1 A 86 86 VAL CA C 86 61.300 61.028 0.272 1
1 993 . 6 1 1 A 86 86 VAL CB C 86 31.780 32.187 -0.407 1
1 996 . 6 1 1 A 86 86 VAL N N 86 128.120 125.311 2.809 1
1 997 . 6 1 1 A 87 87 PRO HA H 87 4.140 4.417 -0.277 1
1 1004 . 6 1 1 A 87 87 PRO C C 87 176.400 176.806 -0.406 1
1 1005 . 6 1 1 A 87 87 PRO CA C 87 64.100 63.176 0.924 1
1 1006 . 6 1 1 A 87 87 PRO CB C 87 31.710 32.395 -0.685 1
1 1009 . 6 1 1 A 88 88 ARG H H 88 8.320 8.848 -0.528 1
1 1010 . 6 1 1 A 88 88 ARG HA H 88 3.030 4.232 -1.202 1
1 1017 . 6 1 1 A 88 88 ARG C C 88 174.630 175.041 -0.411 1
1 1018 . 6 1 1 A 88 88 ARG CA C 88 57.620 57.615 0.005 1
1 1019 . 6 1 1 A 88 88 ARG CB C 88 26.960 27.915 -0.955 1
1 1022 . 6 1 1 A 88 88 ARG N N 88 111.360 116.241 -4.881 1
1 1023 . 6 1 1 A 89 89 VAL H H 89 7.390 7.885 -0.495 1
1 1024 . 6 1 1 A 89 89 VAL HA H 89 3.910 4.296 -0.386 1
1 1032 . 6 1 1 A 89 89 VAL C C 89 177.370 175.619 1.751 1
1 1033 . 6 1 1 A 89 89 VAL CA C 89 64.170 61.567 2.603 1
1 1034 . 6 1 1 A 89 89 VAL CB C 89 32.070 33.728 -1.658 1
1 1037 . 6 1 1 A 89 89 VAL N N 89 117.900 118.259 -0.359 1
1 1038 . 6 1 1 A 90 90 MET H H 90 9.290 8.376 0.914 1
1 1039 . 6 1 1 A 90 90 MET HA H 90 4.340 4.148 0.192 1
1 1047 . 6 1 1 A 90 90 MET C C 90 175.800 176.095 -0.295 1
1 1048 . 6 1 1 A 90 90 MET CA C 90 56.440 56.887 -0.447 1
1 1049 . 6 1 1 A 90 90 MET CB C 90 34.160 33.166 0.994 1
1 1052 . 6 1 1 A 90 90 MET N N 90 128.200 126.257 1.943 1
1 1053 . 6 1 1 A 91 91 GLY H H 91 7.130 7.165 -0.035 1
1 1054 . 6 1 1 A 91 91 GLY HA2 H 91 3.340 3.890 -0.550 1
1 1055 . 6 1 1 A 91 91 GLY HA3 H 91 4.410 4.047 0.363 1
1 1056 . 6 1 1 A 91 91 GLY C C 91 170.920 171.720 -0.800 1
1 1057 . 6 1 1 A 91 91 GLY CA C 91 44.440 45.526 -1.086 1
1 1058 . 6 1 1 A 91 91 GLY N N 91 104.320 104.040 0.280 1
1 1059 . 6 1 1 A 92 92 PHE H H 92 8.790 8.550 0.240 1
1 1060 . 6 1 1 A 92 92 PHE HA H 92 5.270 5.173 0.097 1
1 1068 . 6 1 1 A 92 92 PHE C C 92 176.230 175.337 0.893 1
1 1069 . 6 1 1 A 92 92 PHE CA C 92 57.480 57.125 0.355 1
1 1070 . 6 1 1 A 92 92 PHE CB C 92 42.190 42.431 -0.241 1
1 1075 . 6 1 1 A 92 92 PHE N N 92 118.770 120.129 -1.359 1
1 1076 . 6 1 1 A 93 93 ILE H H 93 8.800 8.695 0.105 1
1 1077 . 6 1 1 A 93 93 ILE HA H 93 4.310 5.133 -0.823 1
1 1087 . 6 1 1 A 93 93 ILE C C 93 176.380 175.633 0.747 1
1 1088 . 6 1 1 A 93 93 ILE CA C 93 60.480 59.855 0.625 1
1 1089 . 6 1 1 A 93 93 ILE CB C 93 38.010 40.840 -2.830 1
1 1093 . 6 1 1 A 93 93 ILE N N 93 122.300 121.421 0.879 1
1 1094 . 6 1 1 A 94 94 GLY H H 94 8.640 8.504 0.136 1
1 1095 . 6 1 1 A 94 94 GLY HA2 H 94 3.830 4.292 -0.462 1
1 1096 . 6 1 1 A 94 94 GLY HA3 H 94 4.600 4.306 0.294 1
1 1097 . 6 1 1 A 94 94 GLY C C 94 175.080 174.529 0.551 1
1 1098 . 6 1 1 A 94 94 GLY CA C 94 44.530 45.203 -0.673 1
1 1099 . 6 1 1 A 94 94 GLY N N 94 116.550 112.937 3.613 1
1 1100 . 6 1 1 A 95 95 GLY H H 95 8.900 8.703 0.197 1
1 1101 . 6 1 1 A 95 95 GLY HA2 H 95 3.970 3.781 0.189 1
1 1102 . 6 1 1 A 95 95 GLY HA3 H 95 4.370 3.784 0.586 1
1 1103 . 6 1 1 A 95 95 GLY C C 95 174.560 174.499 0.061 1
1 1104 . 6 1 1 A 95 95 GLY CA C 95 45.640 47.441 -1.801 1
1 1105 . 6 1 1 A 95 95 GLY N N 95 112.960 111.288 1.672 1
1 1106 . 6 1 1 A 96 96 THR H H 96 7.830 7.904 -0.074 1
1 1107 . 6 1 1 A 96 96 THR HA H 96 4.720 4.837 -0.117 1
1 1112 . 6 1 1 A 96 96 THR C C 96 176.260 174.000 2.260 1
1 1113 . 6 1 1 A 96 96 THR CA C 96 60.360 59.974 0.386 1
1 1114 . 6 1 1 A 96 96 THR CB C 96 70.960 72.148 -1.188 1
1 1116 . 6 1 1 A 96 96 THR N N 96 113.350 111.163 2.187 1
1 1117 . 6 1 1 A 97 97 SER H H 97 8.850 8.773 0.077 1
1 1118 . 6 1 1 A 97 97 SER HA H 97 4.310 4.902 -0.592 1
1 1121 . 6 1 1 A 97 97 SER C C 97 175.570 174.688 0.882 1
1 1122 . 6 1 1 A 97 97 SER CA C 97 60.850 58.317 2.533 1
1 1123 . 6 1 1 A 97 97 SER CB C 97 63.000 63.664 -0.664 1
1 1124 . 6 1 1 A 97 97 SER N N 97 116.420 116.268 0.152 1
1 1125 . 6 1 1 A 98 98 ASP H H 98 8.360 7.857 0.503 1
1 1126 . 6 1 1 A 98 98 ASP HA H 98 4.310 5.076 -0.766 1
1 1129 . 6 1 1 A 98 98 ASP C C 98 175.380 176.063 -0.683 1
1 1130 . 6 1 1 A 98 98 ASP CA C 98 54.190 54.991 -0.801 1
1 1131 . 6 1 1 A 98 98 ASP CB C 98 40.740 43.431 -2.691 1
1 1132 . 6 1 1 A 98 98 ASP N N 98 116.320 119.576 -3.256 1
1 1133 . 6 1 1 A 99 99 ARG H H 99 7.450 7.692 -0.242 1
1 1134 . 6 1 1 A 99 99 ARG HA H 99 4.350 4.535 -0.185 1
1 1141 . 6 1 1 A 99 99 ARG CA C 99 52.920 53.005 -0.085 1
1 1142 . 6 1 1 A 99 99 ARG CB C 99 30.340 31.408 -1.068 1
1 1145 . 6 1 1 A 99 99 ARG N N 99 119.960 118.409 1.551 1
1 1146 . 6 1 1 A 100 100 PRO HA H 100 4.750 4.557 0.193 1
1 1153 . 6 1 1 A 100 100 PRO C C 100 175.220 177.093 -1.873 1
1 1154 . 6 1 1 A 100 100 PRO CA C 100 62.680 62.728 -0.048 1
1 1155 . 6 1 1 A 100 100 PRO CB C 100 32.820 31.706 1.114 1
1 1158 . 6 1 1 A 101 101 ALA H H 101 7.210 8.352 -1.142 1
1 1159 . 6 1 1 A 101 101 ALA HA H 101 5.030 4.589 0.441 1
1 1163 . 6 1 1 A 101 101 ALA CA C 101 48.570 50.086 -1.516 1
1 1164 . 6 1 1 A 101 101 ALA CB C 101 19.660 16.855 2.805 1
1 1165 . 6 1 1 A 101 101 ALA N N 101 124.490 125.090 -0.600 1
1 1166 . 6 1 1 A 102 102 PRO HA H 102 4.440 4.386 0.054 1
1 1173 . 6 1 1 A 102 102 PRO C C 102 177.200 176.455 0.745 1
1 1174 . 6 1 1 A 102 102 PRO CA C 102 62.190 62.593 -0.403 1
1 1175 . 6 1 1 A 102 102 PRO CB C 102 32.310 32.708 -0.398 1
1 1178 . 6 1 1 A 103 103 ILE H H 103 8.550 8.178 0.372 1
1 1179 . 6 1 1 A 103 103 ILE HA H 103 4.630 4.893 -0.263 1
1 1189 . 6 1 1 A 103 103 ILE C C 103 175.460 175.275 0.185 1
1 1190 . 6 1 1 A 103 103 ILE CA C 103 59.730 58.493 1.237 1
1 1191 . 6 1 1 A 103 103 ILE CB C 103 40.140 42.098 -1.958 1
1 1195 . 6 1 1 A 103 103 ILE N N 103 115.670 116.405 -0.735 1
1 1196 . 6 1 1 A 104 104 SER H H 104 8.730 8.639 0.091 1
1 1197 . 6 1 1 A 104 104 SER HA H 104 4.500 4.523 -0.023 1
1 1200 . 6 1 1 A 104 104 SER C C 104 174.840 175.275 -0.435 1
1 1201 . 6 1 1 A 104 104 SER CA C 104 58.010 58.774 -0.764 1
1 1202 . 6 1 1 A 104 104 SER CB C 104 65.470 63.713 1.757 1
1 1203 . 6 1 1 A 104 104 SER N N 104 119.170 119.878 -0.708 1
1 1204 . 6 1 1 A 105 105 ASP H H 105 8.830 9.030 -0.200 1
1 1205 . 6 1 1 A 105 105 ASP HA H 105 4.200 4.212 -0.012 1
1 1208 . 6 1 1 A 105 105 ASP C C 105 178.520 178.285 0.235 1
1 1209 . 6 1 1 A 105 105 ASP CA C 105 57.870 57.866 0.004 1
1 1210 . 6 1 1 A 105 105 ASP CB C 105 40.040 40.408 -0.368 1
1 1211 . 6 1 1 A 105 105 ASP N N 105 121.640 125.319 -3.679 1
1 1212 . 6 1 1 A 106 106 LYS H H 106 8.130 7.991 0.139 1
1 1213 . 6 1 1 A 106 106 LYS HA H 106 4.100 3.910 0.190 1
1 1222 . 6 1 1 A 106 106 LYS C C 106 179.400 178.767 0.633 1
1 1223 . 6 1 1 A 106 106 LYS CA C 106 58.980 59.482 -0.502 1
1 1224 . 6 1 1 A 106 106 LYS CB C 106 32.330 32.096 0.234 1
1 1228 . 6 1 1 A 106 106 LYS N N 106 118.300 120.730 -2.430 1
1 1229 . 6 1 1 A 107 107 GLU H H 107 7.670 8.073 -0.403 1
1 1230 . 6 1 1 A 107 107 GLU HA H 107 4.020 4.064 -0.044 1
1 1235 . 6 1 1 A 107 107 GLU C C 107 178.750 179.734 -0.984 1
1 1236 . 6 1 1 A 107 107 GLU CA C 107 59.210 59.066 0.144 1
1 1237 . 6 1 1 A 107 107 GLU CB C 107 29.780 29.733 0.047 1
1 1239 . 6 1 1 A 107 107 GLU N N 107 121.270 119.395 1.875 1
1 1240 . 6 1 1 A 108 108 VAL H H 108 7.790 7.758 0.032 1
1 1241 . 6 1 1 A 108 108 VAL HA H 108 3.050 3.469 -0.419 1
1 1249 . 6 1 1 A 108 108 VAL C C 108 177.550 177.611 -0.061 1
1 1250 . 6 1 1 A 108 108 VAL CA C 108 67.080 66.377 0.703 1
1 1251 . 6 1 1 A 108 108 VAL CB C 108 31.220 31.044 0.176 1
1 1254 . 6 1 1 A 108 108 VAL N N 108 120.940 121.172 -0.232 1
1 1255 . 6 1 1 A 109 109 ASP H H 109 7.840 7.855 -0.015 1
1 1256 . 6 1 1 A 109 109 ASP HA H 109 4.110 4.286 -0.176 1
1 1259 . 6 1 1 A 109 109 ASP C C 109 178.190 178.509 -0.319 1
1 1260 . 6 1 1 A 109 109 ASP CA C 109 57.470 57.029 0.441 1
1 1261 . 6 1 1 A 109 109 ASP CB C 109 40.480 40.160 0.320 1
1 1262 . 6 1 1 A 109 109 ASP N N 109 118.780 121.359 -2.579 1
1 1263 . 6 1 1 A 110 110 ALA H H 110 7.520 7.772 -0.252 1
1 1264 . 6 1 1 A 110 110 ALA HA H 110 4.110 4.520 -0.410 1
1 1268 . 6 1 1 A 110 110 ALA C C 110 180.550 179.921 0.629 1
1 1269 . 6 1 1 A 110 110 ALA CA C 110 54.880 54.994 -0.114 1
1 1270 . 6 1 1 A 110 110 ALA CB C 110 18.440 18.236 0.204 1
1 1271 . 6 1 1 A 110 110 ALA N N 110 120.640 122.895 -2.255 1
1 1272 . 6 1 1 A 111 111 ILE H H 111 7.840 7.717 0.123 1
1 1273 . 6 1 1 A 111 111 ILE HA H 111 3.580 3.615 -0.035 1
1 1281 . 6 1 1 A 111 111 ILE C C 111 177.470 177.931 -0.461 1
1 1282 . 6 1 1 A 111 111 ILE CA C 111 64.620 65.201 -0.581 1
1 1283 . 6 1 1 A 111 111 ILE CB C 111 38.600 37.915 0.685 1
1 1286 . 6 1 1 A 111 111 ILE N N 111 119.840 119.353 0.487 1
1 1287 . 6 1 1 A 112 112 MET H H 112 8.100 8.046 0.054 1
1 1288 . 6 1 1 A 112 112 MET HA H 112 4.400 4.325 0.075 1
1 1296 . 6 1 1 A 112 112 MET C C 112 177.710 178.002 -0.292 1
1 1297 . 6 1 1 A 112 112 MET CA C 112 55.300 58.627 -3.327 1
1 1298 . 6 1 1 A 112 112 MET CB C 112 30.510 31.899 -1.389 1
1 1301 . 6 1 1 A 112 112 MET N N 112 115.180 120.927 -5.747 1
1 1302 . 6 1 1 A 113 113 ASN H H 113 8.070 8.052 0.018 1
1 1303 . 6 1 1 A 113 113 ASN HA H 113 4.570 4.382 0.188 1
1 1308 . 6 1 1 A 113 113 ASN C C 113 175.530 178.393 -2.863 1
1 1309 . 6 1 1 A 113 113 ASN CA C 113 54.420 56.368 -1.948 1
1 1310 . 6 1 1 A 113 113 ASN CB C 113 38.350 37.986 0.364 1
1 1311 . 6 1 1 A 113 113 ASN N N 113 117.190 117.382 -0.192 1
1 1313 . 6 1 1 A 114 114 ARG H H 114 8.070 7.697 0.373 1
1 1314 . 6 1 1 A 114 114 ARG HA H 114 4.280 3.919 0.361 1
1 1321 . 6 1 1 A 114 114 ARG C C 114 176.620 178.456 -1.836 1
1 1322 . 6 1 1 A 114 114 ARG CA C 114 56.910 59.190 -2.280 1
1 1323 . 6 1 1 A 114 114 ARG CB C 114 30.370 29.867 0.503 1
1 1326 . 6 1 1 A 114 114 ARG N N 114 118.360 119.878 -1.518 1
1 1327 . 6 1 1 A 115 115 LEU H H 115 8.100 7.916 0.184 1
1 1328 . 6 1 1 A 115 115 LEU HA H 115 4.310 3.523 0.787 1
1 1338 . 6 1 1 A 115 115 LEU C C 115 177.440 178.466 -1.026 1
1 1339 . 6 1 1 A 115 115 LEU CA C 115 55.440 57.547 -2.107 1
1 1340 . 6 1 1 A 115 115 LEU CB C 115 42.250 41.543 0.707 1
1 1344 . 6 1 1 A 115 115 LEU N N 115 120.580 121.390 -0.810 1
1 1345 . 6 1 1 A 116 116 GLN H H 116 8.180 7.775 0.405 1
1 1346 . 6 1 1 A 116 116 GLN HA H 116 4.360 3.965 0.395 1
1 1353 . 6 1 1 A 116 116 GLN C C 116 175.890 176.587 -0.697 1
1 1354 . 6 1 1 A 116 116 GLN CA C 116 55.810 58.477 -2.667 1
1 1355 . 6 1 1 A 116 116 GLN CB C 116 29.500 28.074 1.426 1
1 1357 . 6 1 1 A 116 116 GLN N N 116 119.770 118.030 1.740 1
1 1358 . 6 1 1 A 117 117 GLN H H 117 8.350 7.888 0.462 1
1 1359 . 6 1 1 A 117 117 GLN HA H 117 4.380 4.407 -0.027 1
1 1366 . 6 1 1 A 117 117 GLN C C 117 176.130 174.752 1.378 1
1 1367 . 6 1 1 A 117 117 GLN CA C 117 55.810 55.734 0.076 1
1 1368 . 6 1 1 A 117 117 GLN CB C 117 29.500 29.673 -0.173 1
1 1370 . 6 1 1 A 117 117 GLN N N 117 121.440 119.601 1.839 1
1 1371 . 6 1 1 A 118 118 VAL H H 118 8.240 8.823 -0.583 1
1 1372 . 6 1 1 A 118 118 VAL HA H 118 4.120 4.555 -0.435 1
1 1380 . 6 1 1 A 118 118 VAL C C 118 176.650 176.112 0.538 1
1 1381 . 6 1 1 A 118 118 VAL CA C 118 62.720 60.811 1.909 1
1 1382 . 6 1 1 A 118 118 VAL CB C 118 32.730 34.924 -2.194 1
1 1385 . 6 1 1 A 118 118 VAL N N 118 121.250 126.892 -5.642 1
1 1386 . 6 1 1 A 119 119 GLY H H 119 8.460 8.806 -0.346 1
1 1387 . 6 1 1 A 119 119 GLY HA2 H 119 3.990 4.010 -0.020 1
1 1388 . 6 1 1 A 119 119 GLY HA3 H 119 3.990 4.012 -0.022 1
1 1389 . 6 1 1 A 119 119 GLY C C 119 173.770 175.105 -1.335 1
1 1390 . 6 1 1 A 119 119 GLY CA C 119 45.260 46.616 -1.356 1
1 1391 . 6 1 1 A 119 119 GLY N N 119 112.300 113.645 -1.345 1
1 1392 . 6 1 1 A 120 120 ASP H H 120 8.230 8.748 -0.518 1
1 1393 . 6 1 1 A 120 120 ASP HA H 120 4.580 4.590 -0.010 1
1 1396 . 6 1 1 A 120 120 ASP C C 120 175.180 176.473 -1.293 1
1 1397 . 6 1 1 A 120 120 ASP CA C 120 54.340 53.560 0.780 1
1 1398 . 6 1 1 A 120 120 ASP CB C 120 41.390 40.068 1.322 1
1 1399 . 6 1 1 A 120 120 ASP N N 120 120.420 123.322 -2.902 1
1 1400 . 6 1 1 A 121 121 LYS H H 121 7.950 7.336 0.614 1
1 1401 . 6 1 1 A 121 121 LYS HA H 121 4.240 4.466 -0.226 1
1 1402 . 6 1 1 A 121 121 LYS CA C 121 53.620 54.671 -1.051 1
1 1403 . 6 1 1 A 121 121 LYS N N 121 119.110 121.978 -2.868 1
1 1404 . 6 1 1 A 122 122 PRO HA H 122 4.410 4.462 -0.052 1
1 1405 . 6 1 1 A 122 122 PRO C C 122 176.560 176.547 0.013 1
1 1406 . 6 1 1 A 122 122 PRO CA C 122 63.130 64.204 -1.074 1
1 2 . 7 1 1 A 2 2 SER H H 2 7.890 8.426 -0.536 1
1 3 . 7 1 1 A 2 2 SER HA H 2 4.270 5.005 -0.735 1
1 4 . 7 1 1 A 2 2 SER C C 2 173.960 175.054 -1.094 1
1 5 . 7 1 1 A 2 2 SER CA C 2 60.800 55.975 4.825 1
1 6 . 7 1 1 A 2 2 SER N N 2 111.940 115.405 -3.465 1
1 7 . 7 1 1 A 3 3 GLU H H 3 8.010 8.976 -0.966 1
1 8 . 7 1 1 A 3 3 GLU HA H 3 4.360 4.048 0.312 1
1 9 . 7 1 1 A 3 3 GLU C C 3 175.710 176.544 -0.834 1
1 10 . 7 1 1 A 3 3 GLU CA C 3 56.310 59.298 -2.988 1
1 11 . 7 1 1 A 3 3 GLU N N 3 121.280 125.637 -4.357 1
1 12 . 7 1 1 A 4 4 ALA H H 4 8.540 7.814 0.726 1
1 13 . 7 1 1 A 4 4 ALA HA H 4 4.560 4.695 -0.135 1
1 14 . 7 1 1 A 4 4 ALA CA C 4 50.630 49.325 1.305 1
1 15 . 7 1 1 A 4 4 ALA N N 4 127.840 120.029 7.811 1
1 16 . 7 1 1 A 5 5 PRO HA H 5 4.420 4.574 -0.154 1
1 17 . 7 1 1 A 5 5 PRO C C 5 174.240 176.658 -2.418 1
1 18 . 7 1 1 A 5 5 PRO CA C 5 62.840 62.452 0.388 1
1 19 . 7 1 1 A 6 6 LYS H H 6 8.320 8.357 -0.037 1
1 20 . 7 1 1 A 6 6 LYS HA H 6 4.290 4.568 -0.278 1
1 21 . 7 1 1 A 6 6 LYS C C 6 176.100 176.300 -0.200 1
1 22 . 7 1 1 A 6 6 LYS CA C 6 55.540 56.281 -0.741 1
1 23 . 7 1 1 A 6 6 LYS N N 6 121.910 121.892 0.018 1
1 24 . 7 1 1 A 7 7 LYS H H 7 8.450 8.333 0.117 1
1 25 . 7 1 1 A 7 7 LYS HA H 7 3.940 4.847 -0.907 1
1 26 . 7 1 1 A 7 7 LYS C C 7 175.700 175.277 0.423 1
1 27 . 7 1 1 A 7 7 LYS CA C 7 56.440 54.349 2.091 1
1 28 . 7 1 1 A 7 7 LYS N N 7 122.250 122.592 -0.342 1
1 29 . 7 1 1 A 8 8 ARG H H 8 8.210 8.584 -0.374 1
1 30 . 7 1 1 A 8 8 ARG HA H 8 4.670 4.782 -0.112 1
1 31 . 7 1 1 A 8 8 ARG C C 8 173.760 174.590 -0.830 1
1 32 . 7 1 1 A 8 8 ARG CA C 8 53.420 53.983 -0.563 1
1 33 . 7 1 1 A 8 8 ARG N N 8 122.560 121.130 1.430 1
1 34 . 7 1 1 A 9 9 TRP H H 9 8.610 8.824 -0.214 1
1 35 . 7 1 1 A 9 9 TRP HA H 9 4.910 5.409 -0.499 1
1 44 . 7 1 1 A 9 9 TRP C C 9 174.610 175.077 -0.467 1
1 45 . 7 1 1 A 9 9 TRP CA C 9 57.630 55.377 2.253 1
1 46 . 7 1 1 A 9 9 TRP CB C 9 31.020 30.790 0.230 1
1 52 . 7 1 1 A 9 9 TRP N N 9 120.540 121.645 -1.105 1
1 54 . 7 1 1 A 10 10 TYR H H 10 9.260 9.221 0.039 1
1 55 . 7 1 1 A 10 10 TYR HA H 10 4.820 5.199 -0.379 1
1 62 . 7 1 1 A 10 10 TYR C C 10 174.340 175.600 -1.260 1
1 63 . 7 1 1 A 10 10 TYR CA C 10 57.050 56.353 0.697 1
1 64 . 7 1 1 A 10 10 TYR CB C 10 41.920 42.161 -0.241 1
1 69 . 7 1 1 A 10 10 TYR N N 10 118.990 122.021 -3.031 1
1 70 . 7 1 1 A 11 11 VAL H H 11 9.450 8.850 0.600 1
1 71 . 7 1 1 A 11 11 VAL HA H 11 4.470 4.742 -0.272 1
1 79 . 7 1 1 A 11 11 VAL C C 11 175.030 175.620 -0.590 1
1 80 . 7 1 1 A 11 11 VAL CA C 11 62.320 62.214 0.106 1
1 81 . 7 1 1 A 11 11 VAL CB C 11 32.400 32.421 -0.021 1
1 84 . 7 1 1 A 11 11 VAL N N 11 120.930 123.967 -3.037 1
1 85 . 7 1 1 A 12 12 VAL H H 12 9.320 9.123 0.197 1
1 86 . 7 1 1 A 12 12 VAL HA H 12 3.940 4.346 -0.406 1
1 94 . 7 1 1 A 12 12 VAL C C 12 173.870 173.942 -0.072 1
1 95 . 7 1 1 A 12 12 VAL CA C 12 61.330 60.714 0.616 1
1 96 . 7 1 1 A 12 12 VAL CB C 12 33.500 34.972 -1.472 1
1 99 . 7 1 1 A 12 12 VAL N N 12 128.860 127.597 1.263 1
1 100 . 7 1 1 A 13 13 GLN H H 13 8.830 8.562 0.268 1
1 101 . 7 1 1 A 13 13 GLN HA H 13 4.710 4.680 0.030 1
1 108 . 7 1 1 A 13 13 GLN C C 13 174.230 175.147 -0.917 1
1 109 . 7 1 1 A 13 13 GLN CA C 13 54.800 54.977 -0.177 1
1 110 . 7 1 1 A 13 13 GLN CB C 13 29.450 29.467 -0.017 1
1 111 . 7 1 1 A 13 13 GLN N N 13 126.050 127.903 -1.853 1
1 113 . 7 1 1 A 14 14 ALA H H 14 9.420 9.040 0.380 1
1 114 . 7 1 1 A 14 14 ALA HA H 14 5.150 4.859 0.291 1
1 118 . 7 1 1 A 14 14 ALA C C 14 176.400 175.998 0.402 1
1 119 . 7 1 1 A 14 14 ALA CA C 14 49.660 50.467 -0.807 1
1 120 . 7 1 1 A 14 14 ALA CB C 14 22.840 23.288 -0.448 1
1 121 . 7 1 1 A 14 14 ALA N N 14 131.620 127.631 3.989 1
1 122 . 7 1 1 A 15 15 PHE H H 15 8.070 8.678 -0.608 1
1 123 . 7 1 1 A 15 15 PHE HA H 15 4.410 4.687 -0.277 1
1 128 . 7 1 1 A 15 15 PHE C C 15 176.130 175.785 0.345 1
1 129 . 7 1 1 A 15 15 PHE CA C 15 58.550 59.010 -0.460 1
1 130 . 7 1 1 A 15 15 PHE CB C 15 39.780 39.793 -0.013 1
1 133 . 7 1 1 A 15 15 PHE N N 15 119.680 119.004 0.676 1
1 134 . 7 1 1 A 16 16 SER H H 16 8.370 8.930 -0.560 1
1 135 . 7 1 1 A 16 16 SER HA H 16 4.140 4.157 -0.017 1
1 138 . 7 1 1 A 16 16 SER C C 16 175.820 175.604 0.216 1
1 139 . 7 1 1 A 16 16 SER CA C 16 60.570 60.251 0.319 1
1 140 . 7 1 1 A 16 16 SER CB C 16 63.030 63.288 -0.258 1
1 141 . 7 1 1 A 16 16 SER N N 16 119.700 120.129 -0.429 1
1 142 . 7 1 1 A 17 17 GLY H H 17 9.130 8.745 0.385 1
1 143 . 7 1 1 A 17 17 GLY HA2 H 17 3.640 3.685 -0.045 1
1 144 . 7 1 1 A 17 17 GLY HA3 H 17 4.200 3.788 0.412 1
1 145 . 7 1 1 A 17 17 GLY C C 17 175.520 174.723 0.797 1
1 146 . 7 1 1 A 17 17 GLY CA C 17 45.260 45.358 -0.098 1
1 147 . 7 1 1 A 17 17 GLY N N 17 115.850 113.027 2.823 1
1 148 . 7 1 1 A 18 18 PHE H H 18 8.480 7.645 0.835 1
1 149 . 7 1 1 A 18 18 PHE HA H 18 4.740 4.599 0.141 1
1 154 . 7 1 1 A 18 18 PHE C C 18 175.430 176.433 -1.003 1
1 155 . 7 1 1 A 18 18 PHE CA C 18 58.240 57.902 0.338 1
1 156 . 7 1 1 A 18 18 PHE CB C 18 39.010 38.562 0.448 1
1 159 . 7 1 1 A 18 18 PHE N N 18 118.550 119.741 -1.191 1
1 160 . 7 1 1 A 19 19 GLU H H 19 10.690 8.278 2.412 1
1 161 . 7 1 1 A 19 19 GLU HA H 19 3.490 4.040 -0.550 1
1 166 . 7 1 1 A 19 19 GLU C C 19 177.650 179.293 -1.643 1
1 167 . 7 1 1 A 19 19 GLU CA C 19 62.280 59.704 2.576 1
1 168 . 7 1 1 A 19 19 GLU CB C 19 28.380 29.266 -0.886 1
1 170 . 7 1 1 A 19 19 GLU N N 19 123.470 123.261 0.209 1
1 171 . 7 1 1 A 20 20 GLY H H 20 8.740 8.399 0.341 1
1 172 . 7 1 1 A 20 20 GLY HA2 H 20 3.840 3.775 0.065 1
1 173 . 7 1 1 A 20 20 GLY HA3 H 20 3.940 3.785 0.155 1
1 174 . 7 1 1 A 20 20 GLY C C 20 176.860 175.651 1.209 1
1 175 . 7 1 1 A 20 20 GLY CA C 20 47.140 47.338 -0.198 1
1 176 . 7 1 1 A 20 20 GLY N N 20 105.480 108.086 -2.606 1
1 177 . 7 1 1 A 21 21 ARG H H 21 7.690 8.225 -0.535 1
1 178 . 7 1 1 A 21 21 ARG HA H 21 4.180 4.117 0.063 1
1 185 . 7 1 1 A 21 21 ARG C C 21 179.490 178.282 1.208 1
1 186 . 7 1 1 A 21 21 ARG CA C 21 58.660 58.954 -0.294 1
1 187 . 7 1 1 A 21 21 ARG CB C 21 30.100 29.768 0.332 1
1 190 . 7 1 1 A 21 21 ARG N N 21 123.120 121.985 1.135 1
1 191 . 7 1 1 A 22 22 VAL H H 22 8.980 8.747 0.233 1
1 192 . 7 1 1 A 22 22 VAL HA H 22 3.560 3.697 -0.137 1
1 200 . 7 1 1 A 22 22 VAL C C 22 177.320 178.222 -0.902 1
1 201 . 7 1 1 A 22 22 VAL CA C 22 66.960 66.323 0.637 1
1 202 . 7 1 1 A 22 22 VAL CB C 22 31.050 31.396 -0.346 1
1 205 . 7 1 1 A 22 22 VAL N N 22 122.760 120.411 2.349 1
1 206 . 7 1 1 A 23 23 ALA H H 23 8.280 7.917 0.363 1
1 207 . 7 1 1 A 23 23 ALA HA H 23 3.850 4.042 -0.192 1
1 211 . 7 1 1 A 23 23 ALA C C 23 179.340 179.556 -0.216 1
1 212 . 7 1 1 A 23 23 ALA CA C 23 56.260 55.197 1.063 1
1 213 . 7 1 1 A 23 23 ALA CB C 23 18.260 18.261 -0.001 1
1 214 . 7 1 1 A 23 23 ALA N N 23 122.120 121.874 0.246 1
1 215 . 7 1 1 A 24 24 THR H H 24 8.020 7.453 0.567 1
1 216 . 7 1 1 A 24 24 THR HA H 24 3.920 4.000 -0.080 1
1 221 . 7 1 1 A 24 24 THR C C 24 176.940 176.513 0.427 1
1 222 . 7 1 1 A 24 24 THR CA C 24 66.820 66.700 0.120 1
1 223 . 7 1 1 A 24 24 THR CB C 24 68.930 68.299 0.631 1
1 225 . 7 1 1 A 24 24 THR N N 24 113.410 115.263 -1.853 1
1 226 . 7 1 1 A 25 25 SER H H 25 8.570 8.247 0.323 1
1 227 . 7 1 1 A 25 25 SER HA H 25 4.400 4.053 0.347 1
1 230 . 7 1 1 A 25 25 SER C C 25 177.610 177.636 -0.026 1
1 231 . 7 1 1 A 25 25 SER CA C 25 61.920 61.719 0.201 1
1 232 . 7 1 1 A 25 25 SER CB C 25 63.540 62.347 1.193 1
1 233 . 7 1 1 A 25 25 SER N N 25 118.260 115.460 2.800 1
1 234 . 7 1 1 A 26 26 LEU H H 26 9.430 7.989 1.441 1
1 235 . 7 1 1 A 26 26 LEU HA H 26 3.900 3.960 -0.060 1
1 245 . 7 1 1 A 26 26 LEU C C 26 177.710 178.926 -1.216 1
1 246 . 7 1 1 A 26 26 LEU CA C 26 58.910 58.101 0.809 1
1 247 . 7 1 1 A 26 26 LEU CB C 26 41.300 41.618 -0.318 1
1 251 . 7 1 1 A 26 26 LEU N N 26 124.120 123.251 0.869 1
1 252 . 7 1 1 A 27 27 ARG H H 27 7.790 7.623 0.167 1
1 253 . 7 1 1 A 27 27 ARG HA H 27 3.880 3.786 0.094 1
1 260 . 7 1 1 A 27 27 ARG C C 27 179.380 178.160 1.220 1
1 261 . 7 1 1 A 27 27 ARG CA C 27 60.510 59.442 1.068 1
1 262 . 7 1 1 A 27 27 ARG CB C 27 29.670 29.615 0.055 1
1 265 . 7 1 1 A 27 27 ARG N N 27 116.710 119.070 -2.360 1
1 266 . 7 1 1 A 28 28 GLU H H 28 7.900 7.925 -0.025 1
1 267 . 7 1 1 A 28 28 GLU HA H 28 4.070 3.997 0.073 1
1 272 . 7 1 1 A 28 28 GLU C C 28 179.450 179.151 0.299 1
1 273 . 7 1 1 A 28 28 GLU CA C 28 59.450 59.365 0.085 1
1 274 . 7 1 1 A 28 28 GLU CB C 28 29.610 29.151 0.459 1
1 276 . 7 1 1 A 28 28 GLU N N 28 118.340 119.610 -1.270 1
1 277 . 7 1 1 A 29 29 HIS H H 29 8.940 8.024 0.916 1
1 278 . 7 1 1 A 29 29 HIS HA H 29 4.160 4.459 -0.299 1
1 283 . 7 1 1 A 29 29 HIS C C 29 177.750 177.895 -0.145 1
1 284 . 7 1 1 A 29 29 HIS CA C 29 61.260 59.552 1.708 1
1 285 . 7 1 1 A 29 29 HIS CB C 29 29.870 29.886 -0.016 1
1 287 . 7 1 1 A 29 29 HIS N N 29 120.440 118.331 2.109 1
1 288 . 7 1 1 A 30 30 ILE H H 30 8.580 8.792 -0.212 1
1 289 . 7 1 1 A 30 30 ILE HA H 30 3.160 3.686 -0.526 1
1 299 . 7 1 1 A 30 30 ILE C C 30 177.230 177.932 -0.702 1
1 300 . 7 1 1 A 30 30 ILE CA C 30 66.460 65.358 1.102 1
1 301 . 7 1 1 A 30 30 ILE CB C 30 38.630 37.619 1.011 1
1 305 . 7 1 1 A 30 30 ILE N N 30 121.010 119.779 1.231 1
1 306 . 7 1 1 A 31 31 LYS H H 31 7.020 8.362 -1.342 1
1 307 . 7 1 1 A 31 31 LYS HA H 31 4.170 4.069 0.101 1
1 316 . 7 1 1 A 31 31 LYS C C 31 180.570 178.510 2.060 1
1 317 . 7 1 1 A 31 31 LYS CA C 31 58.920 60.119 -1.199 1
1 318 . 7 1 1 A 31 31 LYS CB C 31 32.490 31.923 0.567 1
1 322 . 7 1 1 A 31 31 LYS N N 31 117.400 120.840 -3.440 1
1 323 . 7 1 1 A 32 32 LEU H H 32 8.400 7.912 0.488 1
1 324 . 7 1 1 A 32 32 LEU HA H 32 3.990 3.920 0.070 1
1 334 . 7 1 1 A 32 32 LEU C C 32 178.230 178.868 -0.638 1
1 335 . 7 1 1 A 32 32 LEU CA C 32 57.700 57.937 -0.237 1
1 336 . 7 1 1 A 32 32 LEU CB C 32 42.540 41.721 0.819 1
1 340 . 7 1 1 A 32 32 LEU N N 32 121.180 119.457 1.723 1
1 341 . 7 1 1 A 33 33 HIS H H 33 7.620 8.195 -0.575 1
1 342 . 7 1 1 A 33 33 HIS HA H 33 4.600 4.621 -0.021 1
1 347 . 7 1 1 A 33 33 HIS C C 33 177.090 174.676 2.414 1
1 348 . 7 1 1 A 33 33 HIS CA C 33 55.840 56.081 -0.241 1
1 349 . 7 1 1 A 33 33 HIS CB C 33 29.330 29.784 -0.454 1
1 351 . 7 1 1 A 33 33 HIS N N 33 112.220 115.961 -3.741 1
1 352 . 7 1 1 A 34 34 ASN H H 34 8.030 8.141 -0.111 1
1 353 . 7 1 1 A 34 34 ASN HA H 34 4.890 4.403 0.487 1
1 358 . 7 1 1 A 34 34 ASN C C 34 175.910 175.879 0.031 1
1 359 . 7 1 1 A 34 34 ASN CA C 34 54.530 54.116 0.414 1
1 360 . 7 1 1 A 34 34 ASN CB C 34 37.380 37.218 0.162 1
1 361 . 7 1 1 A 34 34 ASN N N 34 117.600 116.409 1.191 1
1 363 . 7 1 1 A 35 35 MET H H 35 8.330 8.410 -0.080 1
1 364 . 7 1 1 A 35 35 MET HA H 35 4.940 4.798 0.142 1
1 372 . 7 1 1 A 35 35 MET C C 35 176.880 176.930 -0.050 1
1 373 . 7 1 1 A 35 35 MET CA C 35 55.600 54.443 1.157 1
1 374 . 7 1 1 A 35 35 MET CB C 35 33.790 32.641 1.149 1
1 377 . 7 1 1 A 35 35 MET N N 35 116.190 117.244 -1.054 1
1 378 . 7 1 1 A 36 36 GLU H H 36 9.730 8.177 1.553 1
1 379 . 7 1 1 A 36 36 GLU HA H 36 3.850 4.375 -0.525 1
1 384 . 7 1 1 A 36 36 GLU C C 36 178.290 179.083 -0.793 1
1 385 . 7 1 1 A 36 36 GLU CA C 36 61.280 59.040 2.240 1
1 386 . 7 1 1 A 36 36 GLU CB C 36 29.270 29.463 -0.193 1
1 388 . 7 1 1 A 36 36 GLU N N 36 121.630 120.142 1.488 1
1 389 . 7 1 1 A 37 37 ASP H H 37 8.850 8.232 0.618 1
1 390 . 7 1 1 A 37 37 ASP HA H 37 4.470 4.519 -0.049 1
1 393 . 7 1 1 A 37 37 ASP C C 37 177.190 178.670 -1.480 1
1 394 . 7 1 1 A 37 37 ASP CA C 37 56.140 57.299 -1.159 1
1 395 . 7 1 1 A 37 37 ASP CB C 37 40.050 40.842 -0.792 1
1 396 . 7 1 1 A 37 37 ASP N N 37 114.390 119.782 -5.392 1
1 397 . 7 1 1 A 38 38 LEU H H 38 7.880 7.663 0.217 1
1 398 . 7 1 1 A 38 38 LEU HA H 38 4.290 4.299 -0.009 1
1 408 . 7 1 1 A 38 38 LEU C C 38 175.090 177.150 -2.060 1
1 409 . 7 1 1 A 38 38 LEU CA C 38 54.670 56.910 -2.240 1
1 410 . 7 1 1 A 38 38 LEU CB C 38 42.940 41.734 1.206 1
1 414 . 7 1 1 A 38 38 LEU N N 38 116.550 113.769 2.781 1
1 415 . 7 1 1 A 39 39 PHE H H 39 7.500 7.458 0.042 1
1 416 . 7 1 1 A 39 39 PHE HA H 39 4.970 4.665 0.305 1
1 424 . 7 1 1 A 39 39 PHE C C 39 175.380 175.856 -0.476 1
1 425 . 7 1 1 A 39 39 PHE CA C 39 57.580 57.731 -0.151 1
1 426 . 7 1 1 A 39 39 PHE CB C 39 44.990 39.457 5.533 1
1 432 . 7 1 1 A 39 39 PHE N N 39 115.370 119.932 -4.562 1
1 433 . 7 1 1 A 40 40 GLY H H 40 8.680 8.463 0.217 1
1 434 . 7 1 1 A 40 40 GLY HA2 H 40 3.370 3.896 -0.526 1
1 435 . 7 1 1 A 40 40 GLY HA3 H 40 4.550 3.992 0.558 1
1 436 . 7 1 1 A 40 40 GLY C C 40 173.090 173.886 -0.796 1
1 437 . 7 1 1 A 40 40 GLY CA C 40 44.180 46.635 -2.455 1
1 438 . 7 1 1 A 40 40 GLY N N 40 110.930 111.574 -0.644 1
1 439 . 7 1 1 A 41 41 GLU H H 41 8.320 7.882 0.438 1
1 440 . 7 1 1 A 41 41 GLU HA H 41 4.280 4.969 -0.689 1
1 445 . 7 1 1 A 41 41 GLU C C 41 173.900 174.264 -0.364 1
1 446 . 7 1 1 A 41 41 GLU CA C 41 56.900 55.300 1.600 1
1 447 . 7 1 1 A 41 41 GLU CB C 41 32.110 33.332 -1.222 1
1 449 . 7 1 1 A 41 41 GLU N N 41 126.730 119.330 7.400 1
1 450 . 7 1 1 A 42 42 VAL H H 42 8.100 8.972 -0.872 1
1 451 . 7 1 1 A 42 42 VAL HA H 42 5.160 4.923 0.237 1
1 459 . 7 1 1 A 42 42 VAL C C 42 176.340 174.252 2.088 1
1 460 . 7 1 1 A 42 42 VAL CA C 42 61.200 60.157 1.043 1
1 461 . 7 1 1 A 42 42 VAL CB C 42 34.770 33.958 0.812 1
1 464 . 7 1 1 A 42 42 VAL N N 42 119.360 126.369 -7.009 1
1 465 . 7 1 1 A 43 43 MET H H 43 9.870 9.563 0.307 1
1 466 . 7 1 1 A 43 43 MET HA H 43 5.070 5.316 -0.246 1
1 474 . 7 1 1 A 43 43 MET C C 43 173.890 175.530 -1.640 1
1 475 . 7 1 1 A 43 43 MET CA C 43 54.740 53.811 0.929 1
1 476 . 7 1 1 A 43 43 MET CB C 43 37.500 34.679 2.821 1
1 479 . 7 1 1 A 43 43 MET N N 43 125.720 126.716 -0.996 1
1 480 . 7 1 1 A 44 44 VAL H H 44 8.800 8.949 -0.149 1
1 481 . 7 1 1 A 44 44 VAL HA H 44 4.720 4.743 -0.023 1
1 489 . 7 1 1 A 44 44 VAL CA C 44 59.090 59.121 -0.031 1
1 490 . 7 1 1 A 44 44 VAL CB C 44 33.710 32.877 0.833 1
1 493 . 7 1 1 A 44 44 VAL N N 44 122.340 124.247 -1.907 1
1 494 . 7 1 1 A 45 45 PRO HA H 45 4.480 4.599 -0.119 1
1 501 . 7 1 1 A 45 45 PRO C C 45 177.080 174.614 2.466 1
1 502 . 7 1 1 A 45 45 PRO CA C 45 63.240 62.476 0.764 1
1 503 . 7 1 1 A 45 45 PRO CB C 45 32.170 29.065 3.105 1
1 506 . 7 1 1 A 46 46 THR H H 46 8.200 8.319 -0.119 1
1 507 . 7 1 1 A 46 46 THR HA H 46 4.290 4.963 -0.673 1
1 512 . 7 1 1 A 46 46 THR C C 46 174.600 172.894 1.706 1
1 513 . 7 1 1 A 46 46 THR CA C 46 62.100 59.411 2.689 1
1 514 . 7 1 1 A 46 46 THR CB C 46 69.990 72.308 -2.318 1
1 516 . 7 1 1 A 46 46 THR N N 46 113.410 112.110 1.300 1
1 517 . 7 1 1 A 47 47 GLU H H 47 8.380 8.756 -0.376 1
1 518 . 7 1 1 A 47 47 GLU HA H 47 4.400 4.352 0.048 1
1 521 . 7 1 1 A 47 47 GLU C C 47 175.970 177.867 -1.897 1
1 522 . 7 1 1 A 47 47 GLU CA C 47 55.200 55.596 -0.396 1
1 523 . 7 1 1 A 47 47 GLU CB C 47 32.300 30.727 1.573 1
1 524 . 7 1 1 A 47 47 GLU N N 47 122.830 121.260 1.570 1
1 525 . 7 1 1 A 48 48 GLU H H 48 8.400 8.619 -0.219 1
1 526 . 7 1 1 A 48 48 GLU HA H 48 4.280 4.115 0.165 1
1 531 . 7 1 1 A 48 48 GLU C C 48 175.750 176.251 -0.501 1
1 532 . 7 1 1 A 48 48 GLU CA C 48 55.190 59.186 -3.996 1
1 533 . 7 1 1 A 48 48 GLU CB C 48 31.980 30.556 1.424 1
1 535 . 7 1 1 A 48 48 GLU N N 48 121.950 124.061 -2.111 1
1 536 . 7 1 1 A 49 49 VAL H H 49 8.240 7.695 0.545 1
1 537 . 7 1 1 A 49 49 VAL HA H 49 4.170 4.752 -0.582 1
1 542 . 7 1 1 A 49 49 VAL C C 49 174.610 173.623 0.987 1
1 543 . 7 1 1 A 49 49 VAL CA C 49 62.280 59.886 2.394 1
1 544 . 7 1 1 A 49 49 VAL CB C 49 32.930 35.764 -2.834 1
1 546 . 7 1 1 A 49 49 VAL N N 49 123.990 116.277 7.713 1
1 547 . 7 1 1 A 50 50 VAL H H 50 8.230 8.850 -0.620 1
1 548 . 7 1 1 A 50 50 VAL HA H 50 4.220 4.880 -0.660 1
1 553 . 7 1 1 A 50 50 VAL C C 50 175.770 173.439 2.331 1
1 554 . 7 1 1 A 50 50 VAL CA C 50 62.170 58.536 3.634 1
1 555 . 7 1 1 A 50 50 VAL CB C 50 33.110 35.310 -2.200 1
1 557 . 7 1 1 A 50 50 VAL N N 50 123.960 121.279 2.681 1
1 558 . 7 1 1 A 51 51 GLU H H 51 8.570 8.769 -0.199 1
1 559 . 7 1 1 A 51 51 GLU HA H 51 4.380 4.803 -0.423 1
1 564 . 7 1 1 A 51 51 GLU C C 51 175.920 176.520 -0.600 1
1 565 . 7 1 1 A 51 51 GLU CA C 51 56.050 55.008 1.042 1
1 566 . 7 1 1 A 51 51 GLU CB C 51 31.080 31.691 -0.611 1
1 568 . 7 1 1 A 51 51 GLU N N 51 125.070 123.333 1.737 1
1 569 . 7 1 1 A 52 52 ILE H H 52 8.320 8.406 -0.086 1
1 570 . 7 1 1 A 52 52 ILE HA H 52 4.290 3.738 0.552 1
1 580 . 7 1 1 A 52 52 ILE C C 52 176.330 176.880 -0.550 1
1 581 . 7 1 1 A 52 52 ILE CA C 52 60.940 64.791 -3.851 1
1 582 . 7 1 1 A 52 52 ILE CB C 52 38.510 37.638 0.872 1
1 586 . 7 1 1 A 52 52 ILE N N 52 122.760 127.560 -4.800 1
1 587 . 7 1 1 A 53 53 ARG H H 53 8.500 7.615 0.885 1
1 588 . 7 1 1 A 53 53 ARG HA H 53 4.430 4.142 0.288 1
1 595 . 7 1 1 A 53 53 ARG C C 53 176.950 177.208 -0.258 1
1 596 . 7 1 1 A 53 53 ARG CA C 53 56.150 58.148 -1.998 1
1 597 . 7 1 1 A 53 53 ARG CB C 53 30.200 30.368 -0.168 1
1 600 . 7 1 1 A 53 53 ARG N N 53 125.250 122.033 3.217 1
1 601 . 7 1 1 A 54 54 GLY H H 54 8.760 8.627 0.133 1
1 602 . 7 1 1 A 54 54 GLY HA2 H 54 3.920 4.013 -0.093 1
1 603 . 7 1 1 A 54 54 GLY HA3 H 54 4.010 4.014 -0.004 1
1 604 . 7 1 1 A 54 54 GLY C C 54 175.110 173.730 1.380 1
1 605 . 7 1 1 A 54 54 GLY CA C 54 46.030 45.087 0.943 1
1 606 . 7 1 1 A 54 54 GLY N N 54 112.510 111.670 0.840 1
1 607 . 7 1 1 A 55 55 GLY H H 55 8.350 7.610 0.740 1
1 608 . 7 1 1 A 55 55 GLY HA2 H 55 3.980 4.060 -0.080 1
1 609 . 7 1 1 A 55 55 GLY HA3 H 55 3.980 4.062 -0.082 1
1 610 . 7 1 1 A 55 55 GLY C C 55 173.920 171.511 2.409 1
1 611 . 7 1 1 A 55 55 GLY CA C 55 45.200 45.770 -0.570 1
1 612 . 7 1 1 A 55 55 GLY N N 55 107.940 107.603 0.337 1
1 613 . 7 1 1 A 56 56 GLN H H 56 8.100 8.377 -0.277 1
1 614 . 7 1 1 A 56 56 GLN HA H 56 4.420 4.956 -0.536 1
1 619 . 7 1 1 A 56 56 GLN C C 56 175.570 176.477 -0.907 1
1 620 . 7 1 1 A 56 56 GLN CA C 56 55.420 54.210 1.210 1
1 621 . 7 1 1 A 56 56 GLN CB C 56 30.100 31.305 -1.205 1
1 623 . 7 1 1 A 56 56 GLN N N 56 119.350 119.188 0.162 1
1 624 . 7 1 1 A 57 57 ARG H H 57 8.520 9.042 -0.522 1
1 625 . 7 1 1 A 57 57 ARG HA H 57 4.400 3.927 0.473 1
1 632 . 7 1 1 A 57 57 ARG C C 57 176.210 178.748 -2.538 1
1 633 . 7 1 1 A 57 57 ARG CA C 57 56.440 59.691 -3.251 1
1 634 . 7 1 1 A 57 57 ARG CB C 57 30.930 29.793 1.137 1
1 637 . 7 1 1 A 57 57 ARG N N 57 122.610 123.855 -1.245 1
1 638 . 7 1 1 A 58 58 ARG H H 58 8.630 7.842 0.788 1
1 639 . 7 1 1 A 58 58 ARG HA H 58 4.430 4.096 0.334 1
1 646 . 7 1 1 A 58 58 ARG C C 58 175.950 175.966 -0.016 1
1 647 . 7 1 1 A 58 58 ARG CA C 58 55.450 58.522 -3.072 1
1 648 . 7 1 1 A 58 58 ARG CB C 58 31.300 30.616 0.684 1
1 651 . 7 1 1 A 58 58 ARG N N 58 123.320 119.358 3.962 1
1 652 . 7 1 1 A 59 59 LYS H H 59 8.560 7.429 1.131 1
1 653 . 7 1 1 A 59 59 LYS HA H 59 4.410 4.882 -0.472 1
1 662 . 7 1 1 A 59 59 LYS C C 59 176.590 174.131 2.459 1
1 663 . 7 1 1 A 59 59 LYS CA C 59 56.720 55.200 1.520 1
1 664 . 7 1 1 A 59 59 LYS CB C 59 33.150 35.853 -2.703 1
1 668 . 7 1 1 A 59 59 LYS N N 59 123.380 119.277 4.103 1
1 669 . 7 1 1 A 60 60 SER H H 60 8.450 8.730 -0.280 1
1 670 . 7 1 1 A 60 60 SER HA H 60 4.480 5.147 -0.667 1
1 673 . 7 1 1 A 60 60 SER C C 60 174.280 173.794 0.486 1
1 674 . 7 1 1 A 60 60 SER CA C 60 58.140 56.662 1.478 1
1 675 . 7 1 1 A 60 60 SER CB C 60 64.160 64.572 -0.412 1
1 676 . 7 1 1 A 60 60 SER N N 60 117.320 121.711 -4.391 1
1 677 . 7 1 1 A 61 61 GLU H H 61 8.550 8.853 -0.303 1
1 678 . 7 1 1 A 61 61 GLU HA H 61 4.400 4.764 -0.364 1
1 683 . 7 1 1 A 61 61 GLU C C 61 176.150 174.814 1.336 1
1 684 . 7 1 1 A 61 61 GLU CA C 61 56.300 55.998 0.302 1
1 685 . 7 1 1 A 61 61 GLU CB C 61 30.790 30.167 0.623 1
1 687 . 7 1 1 A 61 61 GLU N N 61 122.810 125.807 -2.997 1
1 688 . 7 1 1 A 62 62 ARG H H 62 8.310 7.613 0.697 1
1 689 . 7 1 1 A 62 62 ARG HA H 62 4.340 4.987 -0.647 1
1 692 . 7 1 1 A 62 62 ARG C C 62 176.140 175.925 0.215 1
1 693 . 7 1 1 A 62 62 ARG CA C 62 56.230 54.281 1.949 1
1 694 . 7 1 1 A 62 62 ARG CB C 62 30.780 33.582 -2.802 1
1 695 . 7 1 1 A 62 62 ARG N N 62 122.080 118.786 3.294 1
1 696 . 7 1 1 A 63 63 LYS H H 63 8.470 8.568 -0.098 1
1 697 . 7 1 1 A 63 63 LYS HA H 63 4.300 4.498 -0.198 1
1 700 . 7 1 1 A 63 63 LYS C C 63 175.490 176.563 -1.073 1
1 701 . 7 1 1 A 63 63 LYS CA C 63 56.200 55.808 0.392 1
1 702 . 7 1 1 A 63 63 LYS CB C 63 30.730 32.804 -2.074 1
1 703 . 7 1 1 A 63 63 LYS N N 63 123.450 121.170 2.280 1
1 704 . 7 1 1 A 64 64 PHE H H 64 8.200 7.718 0.482 1
1 705 . 7 1 1 A 64 64 PHE HA H 64 4.450 4.511 -0.061 1
1 710 . 7 1 1 A 64 64 PHE C C 64 174.250 175.454 -1.204 1
1 711 . 7 1 1 A 64 64 PHE CA C 64 57.430 58.926 -1.496 1
1 712 . 7 1 1 A 64 64 PHE CB C 64 40.330 39.491 0.839 1
1 715 . 7 1 1 A 64 64 PHE N N 64 121.740 120.572 1.168 1
1 716 . 7 1 1 A 65 65 PHE H H 65 8.130 8.335 -0.205 1
1 717 . 7 1 1 A 65 65 PHE HA H 65 4.440 5.371 -0.931 1
1 725 . 7 1 1 A 65 65 PHE CA C 65 55.650 54.565 1.085 1
1 726 . 7 1 1 A 65 65 PHE CB C 65 38.900 39.183 -0.283 1
1 731 . 7 1 1 A 65 65 PHE N N 65 120.910 117.680 3.230 1
1 732 . 7 1 1 A 66 66 PRO C C 66 176.780 177.387 -0.607 1
1 733 . 7 1 1 A 67 67 GLY H H 67 9.970 8.765 1.205 1
1 734 . 7 1 1 A 67 67 GLY HA2 H 67 3.820 3.882 -0.062 1
1 735 . 7 1 1 A 67 67 GLY HA3 H 67 4.400 3.919 0.481 1
1 736 . 7 1 1 A 67 67 GLY C C 67 173.670 173.256 0.414 1
1 737 . 7 1 1 A 67 67 GLY CA C 67 45.900 45.195 0.705 1
1 738 . 7 1 1 A 67 67 GLY N N 67 111.550 111.465 0.085 1
1 739 . 7 1 1 A 68 68 TYR H H 68 7.650 8.153 -0.503 1
1 740 . 7 1 1 A 68 68 TYR HA H 68 5.000 5.075 -0.075 1
1 747 . 7 1 1 A 68 68 TYR C C 68 175.220 174.935 0.285 1
1 748 . 7 1 1 A 68 68 TYR CA C 68 57.940 56.602 1.338 1
1 753 . 7 1 1 A 68 68 TYR N N 68 118.800 119.018 -0.218 1
1 754 . 7 1 1 A 69 69 VAL H H 69 9.090 8.968 0.122 1
1 755 . 7 1 1 A 69 69 VAL HA H 69 4.330 4.825 -0.495 1
1 763 . 7 1 1 A 69 69 VAL C C 69 174.250 174.830 -0.580 1
1 764 . 7 1 1 A 69 69 VAL CA C 69 62.120 60.293 1.827 1
1 765 . 7 1 1 A 69 69 VAL CB C 69 35.240 35.758 -0.518 1
1 768 . 7 1 1 A 69 69 VAL N N 69 119.300 123.143 -3.843 1
1 769 . 7 1 1 A 70 70 LEU H H 70 9.190 8.881 0.309 1
1 770 . 7 1 1 A 70 70 LEU HA H 70 5.460 5.423 0.037 1
1 780 . 7 1 1 A 70 70 LEU C C 70 176.130 176.122 0.008 1
1 781 . 7 1 1 A 70 70 LEU CA C 70 54.120 53.417 0.703 1
1 782 . 7 1 1 A 70 70 LEU CB C 70 43.330 43.115 0.215 1
1 786 . 7 1 1 A 70 70 LEU N N 70 126.710 126.838 -0.128 1
1 787 . 7 1 1 A 71 71 VAL H H 71 9.350 9.318 0.032 1
1 788 . 7 1 1 A 71 71 VAL HA H 71 5.040 4.862 0.178 1
1 796 . 7 1 1 A 71 71 VAL C C 71 173.670 174.410 -0.740 1
1 797 . 7 1 1 A 71 71 VAL CA C 71 61.090 61.220 -0.130 1
1 798 . 7 1 1 A 71 71 VAL CB C 71 35.800 35.626 0.174 1
1 801 . 7 1 1 A 71 71 VAL N N 71 121.920 125.430 -3.510 1
1 802 . 7 1 1 A 72 72 GLN H H 72 8.390 8.662 -0.272 1
1 803 . 7 1 1 A 72 72 GLN HA H 72 4.610 4.516 0.094 1
1 810 . 7 1 1 A 72 72 GLN C C 72 175.920 174.510 1.410 1
1 811 . 7 1 1 A 72 72 GLN CA C 72 53.810 54.928 -1.118 1
1 812 . 7 1 1 A 72 72 GLN CB C 72 28.850 28.539 0.311 1
1 814 . 7 1 1 A 72 72 GLN N N 72 130.760 127.894 2.866 1
1 816 . 7 1 1 A 73 73 MET H H 73 9.750 8.598 1.152 1
1 817 . 7 1 1 A 73 73 MET HA H 73 5.060 5.262 -0.202 1
1 825 . 7 1 1 A 73 73 MET C C 73 175.500 174.055 1.445 1
1 826 . 7 1 1 A 73 73 MET CA C 73 55.520 54.530 0.990 1
1 827 . 7 1 1 A 73 73 MET CB C 73 35.350 35.525 -0.175 1
1 830 . 7 1 1 A 73 73 MET N N 73 121.070 123.797 -2.727 1
1 831 . 7 1 1 A 74 74 VAL H H 74 8.530 8.143 0.387 1
1 832 . 7 1 1 A 74 74 VAL HA H 74 3.970 4.284 -0.314 1
1 840 . 7 1 1 A 74 74 VAL C C 74 174.900 175.509 -0.609 1
1 841 . 7 1 1 A 74 74 VAL CA C 74 62.150 62.595 -0.445 1
1 842 . 7 1 1 A 74 74 VAL CB C 74 32.480 32.260 0.220 1
1 845 . 7 1 1 A 74 74 VAL N N 74 124.120 124.540 -0.420 1
1 846 . 7 1 1 A 75 75 MET H H 75 8.600 8.818 -0.218 1
1 847 . 7 1 1 A 75 75 MET HA H 75 4.360 4.100 0.260 1
1 855 . 7 1 1 A 75 75 MET C C 75 173.480 175.545 -2.065 1
1 856 . 7 1 1 A 75 75 MET CA C 75 53.830 56.142 -2.312 1
1 857 . 7 1 1 A 75 75 MET CB C 75 29.960 32.408 -2.448 1
1 860 . 7 1 1 A 75 75 MET N N 75 128.250 128.577 -0.327 1
1 861 . 7 1 1 A 76 76 ASN H H 76 8.410 8.427 -0.017 1
1 862 . 7 1 1 A 76 76 ASN HA H 76 4.540 4.979 -0.439 1
1 867 . 7 1 1 A 76 76 ASN C C 76 173.950 175.014 -1.064 1
1 868 . 7 1 1 A 76 76 ASN CA C 76 51.720 51.550 0.170 1
1 869 . 7 1 1 A 76 76 ASN CB C 76 38.430 42.147 -3.717 1
1 870 . 7 1 1 A 76 76 ASN N N 76 127.500 123.740 3.760 1
1 872 . 7 1 1 A 77 77 ASP H H 77 8.470 9.046 -0.576 1
1 873 . 7 1 1 A 77 77 ASP HA H 77 4.410 4.165 0.245 1
1 876 . 7 1 1 A 77 77 ASP C C 77 178.530 178.293 0.237 1
1 877 . 7 1 1 A 77 77 ASP CA C 77 58.730 56.941 1.789 1
1 878 . 7 1 1 A 77 77 ASP CB C 77 40.940 40.599 0.341 1
1 879 . 7 1 1 A 77 77 ASP N N 77 117.090 120.900 -3.810 1
1 880 . 7 1 1 A 78 78 ALA H H 78 8.160 8.166 -0.006 1
1 881 . 7 1 1 A 78 78 ALA HA H 78 4.350 4.209 0.141 1
1 885 . 7 1 1 A 78 78 ALA C C 78 181.250 180.096 1.154 1
1 886 . 7 1 1 A 78 78 ALA CA C 78 55.190 55.457 -0.267 1
1 887 . 7 1 1 A 78 78 ALA CB C 78 18.260 18.564 -0.304 1
1 888 . 7 1 1 A 78 78 ALA N N 78 122.500 123.592 -1.092 1
1 889 . 7 1 1 A 79 79 SER H H 79 9.320 8.468 0.852 1
1 890 . 7 1 1 A 79 79 SER HA H 79 4.290 4.346 -0.056 1
1 893 . 7 1 1 A 79 79 SER C C 79 176.570 176.654 -0.084 1
1 894 . 7 1 1 A 79 79 SER CA C 79 61.080 61.553 -0.473 1
1 895 . 7 1 1 A 79 79 SER CB C 79 62.200 62.355 -0.155 1
1 896 . 7 1 1 A 79 79 SER N N 79 119.280 112.307 6.973 1
1 897 . 7 1 1 A 80 80 TRP H H 80 8.900 7.820 1.080 1
1 898 . 7 1 1 A 80 80 TRP HA H 80 4.020 4.201 -0.181 1
1 907 . 7 1 1 A 80 80 TRP C C 80 178.210 178.363 -0.153 1
1 908 . 7 1 1 A 80 80 TRP CA C 80 62.490 61.269 1.221 1
1 909 . 7 1 1 A 80 80 TRP CB C 80 29.800 29.436 0.364 1
1 915 . 7 1 1 A 80 80 TRP N N 80 125.870 123.536 2.334 1
1 917 . 7 1 1 A 81 81 HIS H H 81 8.190 8.030 0.160 1
1 918 . 7 1 1 A 81 81 HIS HA H 81 3.930 4.375 -0.445 1
1 923 . 7 1 1 A 81 81 HIS C C 81 177.740 177.904 -0.164 1
1 924 . 7 1 1 A 81 81 HIS CA C 81 61.020 59.722 1.298 1
1 925 . 7 1 1 A 81 81 HIS CB C 81 28.910 30.102 -1.192 1
1 927 . 7 1 1 A 81 81 HIS N N 81 114.080 117.245 -3.165 1
1 928 . 7 1 1 A 82 82 LEU H H 82 8.080 8.187 -0.107 1
1 929 . 7 1 1 A 82 82 LEU HA H 82 3.900 3.792 0.108 1
1 939 . 7 1 1 A 82 82 LEU C C 82 180.330 178.549 1.781 1
1 940 . 7 1 1 A 82 82 LEU CA C 82 58.590 58.245 0.345 1
1 941 . 7 1 1 A 82 82 LEU CB C 82 41.350 41.366 -0.016 1
1 945 . 7 1 1 A 82 82 LEU N N 82 121.320 121.215 0.105 1
1 946 . 7 1 1 A 83 83 VAL H H 83 8.000 8.464 -0.464 1
1 947 . 7 1 1 A 83 83 VAL HA H 83 3.210 3.449 -0.239 1
1 955 . 7 1 1 A 83 83 VAL C C 83 177.060 177.993 -0.933 1
1 956 . 7 1 1 A 83 83 VAL CA C 83 67.430 66.390 1.040 1
1 957 . 7 1 1 A 83 83 VAL CB C 83 31.680 31.221 0.459 1
1 960 . 7 1 1 A 83 83 VAL N N 83 118.850 118.810 0.040 1
1 961 . 7 1 1 A 84 84 ARG H H 84 7.540 7.693 -0.153 1
1 962 . 7 1 1 A 84 84 ARG HA H 84 3.590 3.748 -0.158 1
1 969 . 7 1 1 A 84 84 ARG C C 84 177.240 178.805 -1.565 1
1 970 . 7 1 1 A 84 84 ARG CA C 84 56.050 59.680 -3.630 1
1 971 . 7 1 1 A 84 84 ARG CB C 84 28.190 29.845 -1.655 1
1 974 . 7 1 1 A 84 84 ARG N N 84 111.460 120.276 -8.816 1
1 975 . 7 1 1 A 85 85 SER H H 85 7.530 7.572 -0.042 1
1 976 . 7 1 1 A 85 85 SER HA H 85 4.280 4.262 0.018 1
1 979 . 7 1 1 A 85 85 SER C C 85 173.930 174.769 -0.839 1
1 980 . 7 1 1 A 85 85 SER CA C 85 59.220 60.856 -1.636 1
1 981 . 7 1 1 A 85 85 SER CB C 85 63.830 62.945 0.885 1
1 982 . 7 1 1 A 85 85 SER N N 85 113.660 114.346 -0.686 1
1 983 . 7 1 1 A 86 86 VAL H H 86 7.230 7.396 -0.166 1
1 984 . 7 1 1 A 86 86 VAL HA H 86 3.480 3.754 -0.274 1
1 992 . 7 1 1 A 86 86 VAL CA C 86 61.300 61.188 0.112 1
1 993 . 7 1 1 A 86 86 VAL CB C 86 31.780 32.242 -0.462 1
1 996 . 7 1 1 A 86 86 VAL N N 86 128.120 125.172 2.948 1
1 997 . 7 1 1 A 87 87 PRO HA H 87 4.140 4.375 -0.235 1
1 1004 . 7 1 1 A 87 87 PRO C C 87 176.400 176.797 -0.397 1
1 1005 . 7 1 1 A 87 87 PRO CA C 87 64.100 63.556 0.544 1
1 1006 . 7 1 1 A 87 87 PRO CB C 87 31.710 32.273 -0.563 1
1 1009 . 7 1 1 A 88 88 ARG H H 88 8.320 8.731 -0.411 1
1 1010 . 7 1 1 A 88 88 ARG HA H 88 3.030 3.999 -0.969 1
1 1017 . 7 1 1 A 88 88 ARG C C 88 174.630 174.834 -0.204 1
1 1018 . 7 1 1 A 88 88 ARG CA C 88 57.620 57.219 0.401 1
1 1019 . 7 1 1 A 88 88 ARG CB C 88 26.960 27.792 -0.832 1
1 1022 . 7 1 1 A 88 88 ARG N N 88 111.360 116.392 -5.032 1
1 1023 . 7 1 1 A 89 89 VAL H H 89 7.390 7.841 -0.451 1
1 1024 . 7 1 1 A 89 89 VAL HA H 89 3.910 4.251 -0.341 1
1 1032 . 7 1 1 A 89 89 VAL C C 89 177.370 175.702 1.668 1
1 1033 . 7 1 1 A 89 89 VAL CA C 89 64.170 61.156 3.014 1
1 1034 . 7 1 1 A 89 89 VAL CB C 89 32.070 33.568 -1.498 1
1 1037 . 7 1 1 A 89 89 VAL N N 89 117.900 118.476 -0.576 1
1 1038 . 7 1 1 A 90 90 MET H H 90 9.290 8.728 0.562 1
1 1039 . 7 1 1 A 90 90 MET HA H 90 4.340 3.958 0.382 1
1 1047 . 7 1 1 A 90 90 MET C C 90 175.800 176.054 -0.254 1
1 1048 . 7 1 1 A 90 90 MET CA C 90 56.440 57.046 -0.606 1
1 1049 . 7 1 1 A 90 90 MET CB C 90 34.160 32.887 1.273 1
1 1052 . 7 1 1 A 90 90 MET N N 90 128.200 126.425 1.775 1
1 1053 . 7 1 1 A 91 91 GLY H H 91 7.130 6.826 0.304 1
1 1054 . 7 1 1 A 91 91 GLY HA2 H 91 3.340 3.934 -0.594 1
1 1055 . 7 1 1 A 91 91 GLY HA3 H 91 4.410 4.037 0.373 1
1 1056 . 7 1 1 A 91 91 GLY C C 91 170.920 171.638 -0.718 1
1 1057 . 7 1 1 A 91 91 GLY CA C 91 44.440 45.301 -0.861 1
1 1058 . 7 1 1 A 91 91 GLY N N 91 104.320 104.023 0.297 1
1 1059 . 7 1 1 A 92 92 PHE H H 92 8.790 8.470 0.320 1
1 1060 . 7 1 1 A 92 92 PHE HA H 92 5.270 5.297 -0.027 1
1 1068 . 7 1 1 A 92 92 PHE C C 92 176.230 175.153 1.077 1
1 1069 . 7 1 1 A 92 92 PHE CA C 92 57.480 56.691 0.789 1
1 1070 . 7 1 1 A 92 92 PHE CB C 92 42.190 43.395 -1.205 1
1 1075 . 7 1 1 A 92 92 PHE N N 92 118.770 119.743 -0.973 1
1 1076 . 7 1 1 A 93 93 ILE H H 93 8.800 8.288 0.512 1
1 1077 . 7 1 1 A 93 93 ILE HA H 93 4.310 5.039 -0.729 1
1 1087 . 7 1 1 A 93 93 ILE C C 93 176.380 175.987 0.393 1
1 1088 . 7 1 1 A 93 93 ILE CA C 93 60.480 59.742 0.738 1
1 1089 . 7 1 1 A 93 93 ILE CB C 93 38.010 40.751 -2.741 1
1 1093 . 7 1 1 A 93 93 ILE N N 93 122.300 121.366 0.934 1
1 1094 . 7 1 1 A 94 94 GLY H H 94 8.640 8.437 0.203 1
1 1095 . 7 1 1 A 94 94 GLY HA2 H 94 3.830 4.326 -0.496 1
1 1096 . 7 1 1 A 94 94 GLY HA3 H 94 4.600 4.330 0.270 1
1 1097 . 7 1 1 A 94 94 GLY C C 94 175.080 174.354 0.726 1
1 1098 . 7 1 1 A 94 94 GLY CA C 94 44.530 46.268 -1.738 1
1 1099 . 7 1 1 A 94 94 GLY N N 94 116.550 113.752 2.798 1
1 1100 . 7 1 1 A 95 95 GLY H H 95 8.900 8.844 0.056 1
1 1101 . 7 1 1 A 95 95 GLY HA2 H 95 3.970 3.905 0.065 1
1 1102 . 7 1 1 A 95 95 GLY HA3 H 95 4.370 3.913 0.457 1
1 1103 . 7 1 1 A 95 95 GLY C C 95 174.560 174.102 0.458 1
1 1104 . 7 1 1 A 95 95 GLY CA C 95 45.640 46.964 -1.324 1
1 1105 . 7 1 1 A 95 95 GLY N N 95 112.960 110.652 2.308 1
1 1106 . 7 1 1 A 96 96 THR H H 96 7.830 7.728 0.102 1
1 1107 . 7 1 1 A 96 96 THR HA H 96 4.720 4.829 -0.109 1
1 1112 . 7 1 1 A 96 96 THR C C 96 176.260 174.095 2.165 1
1 1113 . 7 1 1 A 96 96 THR CA C 96 60.360 59.501 0.859 1
1 1114 . 7 1 1 A 96 96 THR CB C 96 70.960 71.989 -1.029 1
1 1116 . 7 1 1 A 96 96 THR N N 96 113.350 110.639 2.711 1
1 1117 . 7 1 1 A 97 97 SER H H 97 8.850 8.748 0.102 1
1 1118 . 7 1 1 A 97 97 SER HA H 97 4.310 4.781 -0.471 1
1 1121 . 7 1 1 A 97 97 SER C C 97 175.570 174.815 0.755 1
1 1122 . 7 1 1 A 97 97 SER CA C 97 60.850 58.334 2.516 1
1 1123 . 7 1 1 A 97 97 SER CB C 97 63.000 63.911 -0.911 1
1 1124 . 7 1 1 A 97 97 SER N N 97 116.420 116.977 -0.557 1
1 1125 . 7 1 1 A 98 98 ASP H H 98 8.360 8.024 0.336 1
1 1126 . 7 1 1 A 98 98 ASP HA H 98 4.310 5.115 -0.805 1
1 1129 . 7 1 1 A 98 98 ASP C C 98 175.380 175.761 -0.381 1
1 1130 . 7 1 1 A 98 98 ASP CA C 98 54.190 55.152 -0.962 1
1 1131 . 7 1 1 A 98 98 ASP CB C 98 40.740 43.514 -2.774 1
1 1132 . 7 1 1 A 98 98 ASP N N 98 116.320 119.869 -3.549 1
1 1133 . 7 1 1 A 99 99 ARG H H 99 7.450 7.912 -0.462 1
1 1134 . 7 1 1 A 99 99 ARG HA H 99 4.350 4.617 -0.267 1
1 1141 . 7 1 1 A 99 99 ARG CA C 99 52.920 53.492 -0.572 1
1 1142 . 7 1 1 A 99 99 ARG CB C 99 30.340 30.708 -0.368 1
1 1145 . 7 1 1 A 99 99 ARG N N 99 119.960 118.116 1.844 1
1 1146 . 7 1 1 A 100 100 PRO HA H 100 4.750 4.604 0.146 1
1 1153 . 7 1 1 A 100 100 PRO C C 100 175.220 177.041 -1.821 1
1 1154 . 7 1 1 A 100 100 PRO CA C 100 62.680 62.695 -0.015 1
1 1155 . 7 1 1 A 100 100 PRO CB C 100 32.820 31.709 1.111 1
1 1158 . 7 1 1 A 101 101 ALA H H 101 7.210 8.377 -1.167 1
1 1159 . 7 1 1 A 101 101 ALA HA H 101 5.030 4.545 0.485 1
1 1163 . 7 1 1 A 101 101 ALA CA C 101 48.570 50.630 -2.060 1
1 1164 . 7 1 1 A 101 101 ALA CB C 101 19.660 17.802 1.858 1
1 1165 . 7 1 1 A 101 101 ALA N N 101 124.490 124.990 -0.500 1
1 1166 . 7 1 1 A 102 102 PRO HA H 102 4.440 4.447 -0.007 1
1 1173 . 7 1 1 A 102 102 PRO C C 102 177.200 176.414 0.786 1
1 1174 . 7 1 1 A 102 102 PRO CA C 102 62.190 62.698 -0.508 1
1 1175 . 7 1 1 A 102 102 PRO CB C 102 32.310 32.620 -0.310 1
1 1178 . 7 1 1 A 103 103 ILE H H 103 8.550 7.741 0.809 1
1 1179 . 7 1 1 A 103 103 ILE HA H 103 4.630 4.841 -0.211 1
1 1189 . 7 1 1 A 103 103 ILE C C 103 175.460 175.348 0.112 1
1 1190 . 7 1 1 A 103 103 ILE CA C 103 59.730 58.499 1.231 1
1 1191 . 7 1 1 A 103 103 ILE CB C 103 40.140 41.885 -1.745 1
1 1195 . 7 1 1 A 103 103 ILE N N 103 115.670 116.097 -0.427 1
1 1196 . 7 1 1 A 104 104 SER H H 104 8.730 8.593 0.137 1
1 1197 . 7 1 1 A 104 104 SER HA H 104 4.500 4.523 -0.023 1
1 1200 . 7 1 1 A 104 104 SER C C 104 174.840 175.459 -0.619 1
1 1201 . 7 1 1 A 104 104 SER CA C 104 58.010 58.375 -0.365 1
1 1202 . 7 1 1 A 104 104 SER CB C 104 65.470 63.973 1.497 1
1 1203 . 7 1 1 A 104 104 SER N N 104 119.170 119.936 -0.766 1
1 1204 . 7 1 1 A 105 105 ASP H H 105 8.830 9.022 -0.192 1
1 1205 . 7 1 1 A 105 105 ASP HA H 105 4.200 4.252 -0.052 1
1 1208 . 7 1 1 A 105 105 ASP C C 105 178.520 178.308 0.212 1
1 1209 . 7 1 1 A 105 105 ASP CA C 105 57.870 57.869 0.001 1
1 1210 . 7 1 1 A 105 105 ASP CB C 105 40.040 40.315 -0.275 1
1 1211 . 7 1 1 A 105 105 ASP N N 105 121.640 125.224 -3.584 1
1 1212 . 7 1 1 A 106 106 LYS H H 106 8.130 7.971 0.159 1
1 1213 . 7 1 1 A 106 106 LYS HA H 106 4.100 3.888 0.212 1
1 1222 . 7 1 1 A 106 106 LYS C C 106 179.400 178.609 0.791 1
1 1223 . 7 1 1 A 106 106 LYS CA C 106 58.980 59.450 -0.470 1
1 1224 . 7 1 1 A 106 106 LYS CB C 106 32.330 32.088 0.242 1
1 1228 . 7 1 1 A 106 106 LYS N N 106 118.300 120.579 -2.279 1
1 1229 . 7 1 1 A 107 107 GLU H H 107 7.670 7.934 -0.264 1
1 1230 . 7 1 1 A 107 107 GLU HA H 107 4.020 4.020 0.000 1
1 1235 . 7 1 1 A 107 107 GLU C C 107 178.750 179.521 -0.771 1
1 1236 . 7 1 1 A 107 107 GLU CA C 107 59.210 59.157 0.053 1
1 1237 . 7 1 1 A 107 107 GLU CB C 107 29.780 29.505 0.275 1
1 1239 . 7 1 1 A 107 107 GLU N N 107 121.270 119.136 2.134 1
1 1240 . 7 1 1 A 108 108 VAL H H 108 7.790 7.791 -0.001 1
1 1241 . 7 1 1 A 108 108 VAL HA H 108 3.050 3.447 -0.397 1
1 1249 . 7 1 1 A 108 108 VAL C C 108 177.550 177.344 0.206 1
1 1250 . 7 1 1 A 108 108 VAL CA C 108 67.080 66.325 0.755 1
1 1251 . 7 1 1 A 108 108 VAL CB C 108 31.220 30.825 0.395 1
1 1254 . 7 1 1 A 108 108 VAL N N 108 120.940 121.203 -0.263 1
1 1255 . 7 1 1 A 109 109 ASP H H 109 7.840 7.889 -0.049 1
1 1256 . 7 1 1 A 109 109 ASP HA H 109 4.110 4.257 -0.147 1
1 1259 . 7 1 1 A 109 109 ASP C C 109 178.190 178.795 -0.605 1
1 1260 . 7 1 1 A 109 109 ASP CA C 109 57.470 57.145 0.325 1
1 1261 . 7 1 1 A 109 109 ASP CB C 109 40.480 39.887 0.593 1
1 1262 . 7 1 1 A 109 109 ASP N N 109 118.780 119.890 -1.110 1
1 1263 . 7 1 1 A 110 110 ALA H H 110 7.520 8.082 -0.562 1
1 1264 . 7 1 1 A 110 110 ALA HA H 110 4.110 4.375 -0.265 1
1 1268 . 7 1 1 A 110 110 ALA C C 110 180.550 179.808 0.742 1
1 1269 . 7 1 1 A 110 110 ALA CA C 110 54.880 55.157 -0.277 1
1 1270 . 7 1 1 A 110 110 ALA CB C 110 18.440 18.441 -0.001 1
1 1271 . 7 1 1 A 110 110 ALA N N 110 120.640 122.386 -1.746 1
1 1272 . 7 1 1 A 111 111 ILE H H 111 7.840 7.887 -0.047 1
1 1273 . 7 1 1 A 111 111 ILE HA H 111 3.580 3.794 -0.214 1
1 1281 . 7 1 1 A 111 111 ILE C C 111 177.470 178.110 -0.640 1
1 1282 . 7 1 1 A 111 111 ILE CA C 111 64.620 65.060 -0.440 1
1 1283 . 7 1 1 A 111 111 ILE CB C 111 38.600 38.018 0.582 1
1 1286 . 7 1 1 A 111 111 ILE N N 111 119.840 118.082 1.758 1
1 1287 . 7 1 1 A 112 112 MET H H 112 8.100 7.856 0.244 1
1 1288 . 7 1 1 A 112 112 MET HA H 112 4.400 4.171 0.229 1
1 1296 . 7 1 1 A 112 112 MET C C 112 177.710 178.835 -1.125 1
1 1297 . 7 1 1 A 112 112 MET CA C 112 55.300 58.758 -3.458 1
1 1298 . 7 1 1 A 112 112 MET CB C 112 30.510 33.130 -2.620 1
1 1301 . 7 1 1 A 112 112 MET N N 112 115.180 118.244 -3.064 1
1 1302 . 7 1 1 A 113 113 ASN H H 113 8.070 8.461 -0.391 1
1 1303 . 7 1 1 A 113 113 ASN HA H 113 4.570 4.427 0.143 1
1 1308 . 7 1 1 A 113 113 ASN C C 113 175.530 178.248 -2.718 1
1 1309 . 7 1 1 A 113 113 ASN CA C 113 54.420 56.605 -2.185 1
1 1310 . 7 1 1 A 113 113 ASN CB C 113 38.350 37.662 0.688 1
1 1311 . 7 1 1 A 113 113 ASN N N 113 117.190 117.372 -0.182 1
1 1313 . 7 1 1 A 114 114 ARG H H 114 8.070 8.010 0.060 1
1 1314 . 7 1 1 A 114 114 ARG HA H 114 4.280 3.980 0.300 1
1 1321 . 7 1 1 A 114 114 ARG C C 114 176.620 178.668 -2.048 1
1 1322 . 7 1 1 A 114 114 ARG CA C 114 56.910 59.433 -2.523 1
1 1323 . 7 1 1 A 114 114 ARG CB C 114 30.370 30.178 0.192 1
1 1326 . 7 1 1 A 114 114 ARG N N 114 118.360 119.598 -1.238 1
1 1327 . 7 1 1 A 115 115 LEU H H 115 8.100 7.855 0.245 1
1 1328 . 7 1 1 A 115 115 LEU HA H 115 4.310 4.301 0.009 1
1 1338 . 7 1 1 A 115 115 LEU C C 115 177.440 178.745 -1.305 1
1 1339 . 7 1 1 A 115 115 LEU CA C 115 55.440 58.049 -2.609 1
1 1340 . 7 1 1 A 115 115 LEU CB C 115 42.250 41.770 0.480 1
1 1344 . 7 1 1 A 115 115 LEU N N 115 120.580 121.663 -1.083 1
1 1345 . 7 1 1 A 116 116 GLN H H 116 8.180 7.980 0.200 1
1 1346 . 7 1 1 A 116 116 GLN HA H 116 4.360 3.987 0.373 1
1 1353 . 7 1 1 A 116 116 GLN C C 116 175.890 178.327 -2.437 1
1 1354 . 7 1 1 A 116 116 GLN CA C 116 55.810 59.166 -3.356 1
1 1355 . 7 1 1 A 116 116 GLN CB C 116 29.500 28.216 1.284 1
1 1357 . 7 1 1 A 116 116 GLN N N 116 119.770 118.077 1.693 1
1 1358 . 7 1 1 A 117 117 GLN H H 117 8.350 7.978 0.372 1
1 1359 . 7 1 1 A 117 117 GLN HA H 117 4.380 4.141 0.239 1
1 1366 . 7 1 1 A 117 117 GLN C C 117 176.130 175.592 0.538 1
1 1367 . 7 1 1 A 117 117 GLN CA C 117 55.810 58.438 -2.628 1
1 1368 . 7 1 1 A 117 117 GLN CB C 117 29.500 28.491 1.009 1
1 1370 . 7 1 1 A 117 117 GLN N N 117 121.440 119.290 2.150 1
1 1371 . 7 1 1 A 118 118 VAL H H 118 8.240 7.748 0.492 1
1 1372 . 7 1 1 A 118 118 VAL HA H 118 4.120 3.340 0.780 1
1 1380 . 7 1 1 A 118 118 VAL C C 118 176.650 175.920 0.730 1
1 1381 . 7 1 1 A 118 118 VAL CA C 118 62.720 63.522 -0.802 1
1 1382 . 7 1 1 A 118 118 VAL CB C 118 32.730 29.758 2.972 1
1 1385 . 7 1 1 A 118 118 VAL N N 118 121.250 117.834 3.416 1
1 1386 . 7 1 1 A 119 119 GLY H H 119 8.460 8.625 -0.165 1
1 1387 . 7 1 1 A 119 119 GLY HA2 H 119 3.990 3.714 0.276 1
1 1388 . 7 1 1 A 119 119 GLY HA3 H 119 3.990 3.768 0.222 1
1 1389 . 7 1 1 A 119 119 GLY C C 119 173.770 173.041 0.729 1
1 1390 . 7 1 1 A 119 119 GLY CA C 119 45.260 47.388 -2.128 1
1 1391 . 7 1 1 A 119 119 GLY N N 119 112.300 107.231 5.069 1
1 1392 . 7 1 1 A 120 120 ASP H H 120 8.230 8.293 -0.063 1
1 1393 . 7 1 1 A 120 120 ASP HA H 120 4.580 5.231 -0.651 1
1 1396 . 7 1 1 A 120 120 ASP C C 120 175.180 173.586 1.594 1
1 1397 . 7 1 1 A 120 120 ASP CA C 120 54.340 52.932 1.408 1
1 1398 . 7 1 1 A 120 120 ASP CB C 120 41.390 44.872 -3.482 1
1 1399 . 7 1 1 A 120 120 ASP N N 120 120.420 125.016 -4.596 1
1 1400 . 7 1 1 A 121 121 LYS H H 121 7.950 8.921 -0.971 1
1 1401 . 7 1 1 A 121 121 LYS HA H 121 4.240 4.968 -0.728 1
1 1402 . 7 1 1 A 121 121 LYS CA C 121 53.620 53.057 0.563 1
1 1403 . 7 1 1 A 121 121 LYS N N 121 119.110 124.868 -5.758 1
1 1404 . 7 1 1 A 122 122 PRO HA H 122 4.410 4.563 -0.153 1
1 1405 . 7 1 1 A 122 122 PRO C C 122 176.560 176.327 0.233 1
1 1406 . 7 1 1 A 122 122 PRO CA C 122 63.130 62.762 0.368 1
1 2 . 8 1 1 A 2 2 SER H H 2 7.890 8.138 -0.248 1
1 3 . 8 1 1 A 2 2 SER HA H 2 4.270 4.151 0.119 1
1 4 . 8 1 1 A 2 2 SER C C 2 173.960 175.248 -1.288 1
1 5 . 8 1 1 A 2 2 SER CA C 2 60.800 61.731 -0.931 1
1 6 . 8 1 1 A 2 2 SER N N 2 111.940 115.064 -3.124 1
1 7 . 8 1 1 A 3 3 GLU H H 3 8.010 7.827 0.183 1
1 8 . 8 1 1 A 3 3 GLU HA H 3 4.360 4.401 -0.041 1
1 9 . 8 1 1 A 3 3 GLU C C 3 175.710 176.160 -0.450 1
1 10 . 8 1 1 A 3 3 GLU CA C 3 56.310 57.205 -0.895 1
1 11 . 8 1 1 A 3 3 GLU N N 3 121.280 119.804 1.476 1
1 12 . 8 1 1 A 4 4 ALA H H 4 8.540 8.439 0.101 1
1 13 . 8 1 1 A 4 4 ALA HA H 4 4.560 4.492 0.068 1
1 14 . 8 1 1 A 4 4 ALA CA C 4 50.630 50.912 -0.282 1
1 15 . 8 1 1 A 4 4 ALA N N 4 127.840 125.638 2.202 1
1 16 . 8 1 1 A 5 5 PRO HA H 5 4.420 4.593 -0.173 1
1 17 . 8 1 1 A 5 5 PRO C C 5 174.240 175.320 -1.080 1
1 18 . 8 1 1 A 5 5 PRO CA C 5 62.840 62.755 0.085 1
1 19 . 8 1 1 A 6 6 LYS H H 6 8.320 8.599 -0.279 1
1 20 . 8 1 1 A 6 6 LYS HA H 6 4.290 4.756 -0.466 1
1 21 . 8 1 1 A 6 6 LYS C C 6 176.100 175.171 0.929 1
1 22 . 8 1 1 A 6 6 LYS CA C 6 55.540 55.105 0.435 1
1 23 . 8 1 1 A 6 6 LYS N N 6 121.910 122.088 -0.178 1
1 24 . 8 1 1 A 7 7 LYS H H 7 8.450 8.696 -0.246 1
1 25 . 8 1 1 A 7 7 LYS HA H 7 3.940 4.721 -0.781 1
1 26 . 8 1 1 A 7 7 LYS C C 7 175.700 176.100 -0.400 1
1 27 . 8 1 1 A 7 7 LYS CA C 7 56.440 55.714 0.726 1
1 28 . 8 1 1 A 7 7 LYS N N 7 122.250 126.262 -4.012 1
1 29 . 8 1 1 A 8 8 ARG H H 8 8.210 8.805 -0.595 1
1 30 . 8 1 1 A 8 8 ARG HA H 8 4.670 4.850 -0.180 1
1 31 . 8 1 1 A 8 8 ARG C C 8 173.760 174.576 -0.816 1
1 32 . 8 1 1 A 8 8 ARG CA C 8 53.420 53.947 -0.527 1
1 33 . 8 1 1 A 8 8 ARG N N 8 122.560 123.630 -1.070 1
1 34 . 8 1 1 A 9 9 TRP H H 9 8.610 8.607 0.003 1
1 35 . 8 1 1 A 9 9 TRP HA H 9 4.910 5.348 -0.438 1
1 44 . 8 1 1 A 9 9 TRP C C 9 174.610 175.506 -0.896 1
1 45 . 8 1 1 A 9 9 TRP CA C 9 57.630 55.522 2.108 1
1 46 . 8 1 1 A 9 9 TRP CB C 9 31.020 30.598 0.422 1
1 52 . 8 1 1 A 9 9 TRP N N 9 120.540 121.678 -1.138 1
1 54 . 8 1 1 A 10 10 TYR H H 10 9.260 9.033 0.227 1
1 55 . 8 1 1 A 10 10 TYR HA H 10 4.820 5.329 -0.509 1
1 62 . 8 1 1 A 10 10 TYR C C 10 174.340 175.007 -0.667 1
1 63 . 8 1 1 A 10 10 TYR CA C 10 57.050 56.469 0.581 1
1 64 . 8 1 1 A 10 10 TYR CB C 10 41.920 43.629 -1.709 1
1 69 . 8 1 1 A 10 10 TYR N N 10 118.990 121.702 -2.712 1
1 70 . 8 1 1 A 11 11 VAL H H 11 9.450 8.984 0.466 1
1 71 . 8 1 1 A 11 11 VAL HA H 11 4.470 4.827 -0.357 1
1 79 . 8 1 1 A 11 11 VAL C C 11 175.030 175.320 -0.290 1
1 80 . 8 1 1 A 11 11 VAL CA C 11 62.320 61.663 0.657 1
1 81 . 8 1 1 A 11 11 VAL CB C 11 32.400 33.469 -1.069 1
1 84 . 8 1 1 A 11 11 VAL N N 11 120.930 122.219 -1.289 1
1 85 . 8 1 1 A 12 12 VAL H H 12 9.320 9.440 -0.120 1
1 86 . 8 1 1 A 12 12 VAL HA H 12 3.940 4.264 -0.324 1
1 94 . 8 1 1 A 12 12 VAL C C 12 173.870 173.747 0.123 1
1 95 . 8 1 1 A 12 12 VAL CA C 12 61.330 60.813 0.517 1
1 96 . 8 1 1 A 12 12 VAL CB C 12 33.500 34.225 -0.725 1
1 99 . 8 1 1 A 12 12 VAL N N 12 128.860 127.364 1.496 1
1 100 . 8 1 1 A 13 13 GLN H H 13 8.830 8.560 0.270 1
1 101 . 8 1 1 A 13 13 GLN HA H 13 4.710 4.881 -0.171 1
1 108 . 8 1 1 A 13 13 GLN C C 13 174.230 175.093 -0.863 1
1 109 . 8 1 1 A 13 13 GLN CA C 13 54.800 55.035 -0.235 1
1 110 . 8 1 1 A 13 13 GLN CB C 13 29.450 29.632 -0.182 1
1 111 . 8 1 1 A 13 13 GLN N N 13 126.050 127.899 -1.849 1
1 113 . 8 1 1 A 14 14 ALA H H 14 9.420 9.397 0.023 1
1 114 . 8 1 1 A 14 14 ALA HA H 14 5.150 4.590 0.560 1
1 118 . 8 1 1 A 14 14 ALA C C 14 176.400 175.738 0.662 1
1 119 . 8 1 1 A 14 14 ALA CA C 14 49.660 50.728 -1.068 1
1 120 . 8 1 1 A 14 14 ALA CB C 14 22.840 22.546 0.294 1
1 121 . 8 1 1 A 14 14 ALA N N 14 131.620 127.323 4.297 1
1 122 . 8 1 1 A 15 15 PHE H H 15 8.070 8.726 -0.656 1
1 123 . 8 1 1 A 15 15 PHE HA H 15 4.410 5.093 -0.683 1
1 128 . 8 1 1 A 15 15 PHE C C 15 176.130 175.872 0.258 1
1 129 . 8 1 1 A 15 15 PHE CA C 15 58.550 56.482 2.068 1
1 130 . 8 1 1 A 15 15 PHE CB C 15 39.780 41.150 -1.370 1
1 133 . 8 1 1 A 15 15 PHE N N 15 119.680 116.099 3.581 1
1 134 . 8 1 1 A 16 16 SER H H 16 8.370 8.905 -0.535 1
1 135 . 8 1 1 A 16 16 SER HA H 16 4.140 4.118 0.022 1
1 138 . 8 1 1 A 16 16 SER C C 16 175.820 175.617 0.203 1
1 139 . 8 1 1 A 16 16 SER CA C 16 60.570 60.432 0.138 1
1 140 . 8 1 1 A 16 16 SER CB C 16 63.030 63.135 -0.105 1
1 141 . 8 1 1 A 16 16 SER N N 16 119.700 120.086 -0.386 1
1 142 . 8 1 1 A 17 17 GLY H H 17 9.130 8.765 0.365 1
1 143 . 8 1 1 A 17 17 GLY HA2 H 17 3.640 3.645 -0.005 1
1 144 . 8 1 1 A 17 17 GLY HA3 H 17 4.200 3.769 0.431 1
1 145 . 8 1 1 A 17 17 GLY C C 17 175.520 174.422 1.098 1
1 146 . 8 1 1 A 17 17 GLY CA C 17 45.260 45.335 -0.075 1
1 147 . 8 1 1 A 17 17 GLY N N 17 115.850 112.940 2.910 1
1 148 . 8 1 1 A 18 18 PHE H H 18 8.480 7.859 0.621 1
1 149 . 8 1 1 A 18 18 PHE HA H 18 4.740 4.760 -0.020 1
1 154 . 8 1 1 A 18 18 PHE C C 18 175.430 176.497 -1.067 1
1 155 . 8 1 1 A 18 18 PHE CA C 18 58.240 57.758 0.482 1
1 156 . 8 1 1 A 18 18 PHE CB C 18 39.010 39.052 -0.042 1
1 159 . 8 1 1 A 18 18 PHE N N 18 118.550 119.705 -1.155 1
1 160 . 8 1 1 A 19 19 GLU H H 19 10.690 8.261 2.429 1
1 161 . 8 1 1 A 19 19 GLU HA H 19 3.490 4.084 -0.594 1
1 166 . 8 1 1 A 19 19 GLU C C 19 177.650 179.108 -1.458 1
1 167 . 8 1 1 A 19 19 GLU CA C 19 62.280 59.818 2.462 1
1 168 . 8 1 1 A 19 19 GLU CB C 19 28.380 29.443 -1.063 1
1 170 . 8 1 1 A 19 19 GLU N N 19 123.470 123.004 0.466 1
1 171 . 8 1 1 A 20 20 GLY H H 20 8.740 8.209 0.531 1
1 172 . 8 1 1 A 20 20 GLY HA2 H 20 3.840 3.770 0.070 1
1 173 . 8 1 1 A 20 20 GLY HA3 H 20 3.940 3.779 0.161 1
1 174 . 8 1 1 A 20 20 GLY C C 20 176.860 175.793 1.067 1
1 175 . 8 1 1 A 20 20 GLY CA C 20 47.140 46.966 0.174 1
1 176 . 8 1 1 A 20 20 GLY N N 20 105.480 107.575 -2.095 1
1 177 . 8 1 1 A 21 21 ARG H H 21 7.690 8.272 -0.582 1
1 178 . 8 1 1 A 21 21 ARG HA H 21 4.180 4.118 0.062 1
1 185 . 8 1 1 A 21 21 ARG C C 21 179.490 178.480 1.010 1
1 186 . 8 1 1 A 21 21 ARG CA C 21 58.660 59.051 -0.391 1
1 187 . 8 1 1 A 21 21 ARG CB C 21 30.100 29.827 0.273 1
1 190 . 8 1 1 A 21 21 ARG N N 21 123.120 122.062 1.058 1
1 191 . 8 1 1 A 22 22 VAL H H 22 8.980 8.618 0.362 1
1 192 . 8 1 1 A 22 22 VAL HA H 22 3.560 3.655 -0.095 1
1 200 . 8 1 1 A 22 22 VAL C C 22 177.320 178.125 -0.805 1
1 201 . 8 1 1 A 22 22 VAL CA C 22 66.960 66.426 0.534 1
1 202 . 8 1 1 A 22 22 VAL CB C 22 31.050 31.634 -0.584 1
1 205 . 8 1 1 A 22 22 VAL N N 22 122.760 119.613 3.147 1
1 206 . 8 1 1 A 23 23 ALA H H 23 8.280 8.197 0.083 1
1 207 . 8 1 1 A 23 23 ALA HA H 23 3.850 4.106 -0.256 1
1 211 . 8 1 1 A 23 23 ALA C C 23 179.340 179.507 -0.167 1
1 212 . 8 1 1 A 23 23 ALA CA C 23 56.260 55.234 1.026 1
1 213 . 8 1 1 A 23 23 ALA CB C 23 18.260 18.199 0.061 1
1 214 . 8 1 1 A 23 23 ALA N N 23 122.120 121.940 0.180 1
1 215 . 8 1 1 A 24 24 THR H H 24 8.020 7.609 0.411 1
1 216 . 8 1 1 A 24 24 THR HA H 24 3.920 4.020 -0.100 1
1 221 . 8 1 1 A 24 24 THR C C 24 176.940 176.355 0.585 1
1 222 . 8 1 1 A 24 24 THR CA C 24 66.820 66.618 0.202 1
1 223 . 8 1 1 A 24 24 THR CB C 24 68.930 68.414 0.516 1
1 225 . 8 1 1 A 24 24 THR N N 24 113.410 115.681 -2.271 1
1 226 . 8 1 1 A 25 25 SER H H 25 8.570 8.450 0.120 1
1 227 . 8 1 1 A 25 25 SER HA H 25 4.400 4.013 0.387 1
1 230 . 8 1 1 A 25 25 SER C C 25 177.610 176.060 1.550 1
1 231 . 8 1 1 A 25 25 SER CA C 25 61.920 62.324 -0.404 1
1 232 . 8 1 1 A 25 25 SER CB C 25 63.540 62.959 0.581 1
1 233 . 8 1 1 A 25 25 SER N N 25 118.260 117.940 0.320 1
1 234 . 8 1 1 A 26 26 LEU H H 26 9.430 8.035 1.395 1
1 235 . 8 1 1 A 26 26 LEU HA H 26 3.900 4.058 -0.158 1
1 245 . 8 1 1 A 26 26 LEU C C 26 177.710 178.729 -1.019 1
1 246 . 8 1 1 A 26 26 LEU CA C 26 58.910 58.110 0.800 1
1 247 . 8 1 1 A 26 26 LEU CB C 26 41.300 41.650 -0.350 1
1 251 . 8 1 1 A 26 26 LEU N N 26 124.120 121.352 2.768 1
1 252 . 8 1 1 A 27 27 ARG H H 27 7.790 7.691 0.099 1
1 253 . 8 1 1 A 27 27 ARG HA H 27 3.880 3.832 0.048 1
1 260 . 8 1 1 A 27 27 ARG C C 27 179.380 178.736 0.644 1
1 261 . 8 1 1 A 27 27 ARG CA C 27 60.510 59.738 0.772 1
1 262 . 8 1 1 A 27 27 ARG CB C 27 29.670 29.956 -0.286 1
1 265 . 8 1 1 A 27 27 ARG N N 27 116.710 119.153 -2.443 1
1 266 . 8 1 1 A 28 28 GLU H H 28 7.900 8.011 -0.111 1
1 267 . 8 1 1 A 28 28 GLU HA H 28 4.070 3.917 0.153 1
1 272 . 8 1 1 A 28 28 GLU C C 28 179.450 179.552 -0.102 1
1 273 . 8 1 1 A 28 28 GLU CA C 28 59.450 59.245 0.205 1
1 274 . 8 1 1 A 28 28 GLU CB C 28 29.610 29.403 0.207 1
1 276 . 8 1 1 A 28 28 GLU N N 28 118.340 117.604 0.736 1
1 277 . 8 1 1 A 29 29 HIS H H 29 8.940 7.465 1.475 1
1 278 . 8 1 1 A 29 29 HIS HA H 29 4.160 4.534 -0.374 1
1 283 . 8 1 1 A 29 29 HIS C C 29 177.750 177.991 -0.241 1
1 284 . 8 1 1 A 29 29 HIS CA C 29 61.260 60.289 0.971 1
1 285 . 8 1 1 A 29 29 HIS CB C 29 29.870 30.277 -0.407 1
1 287 . 8 1 1 A 29 29 HIS N N 29 120.440 118.733 1.707 1
1 288 . 8 1 1 A 30 30 ILE H H 30 8.580 7.990 0.590 1
1 289 . 8 1 1 A 30 30 ILE HA H 30 3.160 3.607 -0.447 1
1 299 . 8 1 1 A 30 30 ILE C C 30 177.230 177.840 -0.610 1
1 300 . 8 1 1 A 30 30 ILE CA C 30 66.460 65.079 1.381 1
1 301 . 8 1 1 A 30 30 ILE CB C 30 38.630 37.660 0.970 1
1 305 . 8 1 1 A 30 30 ILE N N 30 121.010 120.403 0.607 1
1 306 . 8 1 1 A 31 31 LYS H H 31 7.020 7.795 -0.775 1
1 307 . 8 1 1 A 31 31 LYS HA H 31 4.170 3.990 0.180 1
1 316 . 8 1 1 A 31 31 LYS C C 31 180.570 179.471 1.099 1
1 317 . 8 1 1 A 31 31 LYS CA C 31 58.920 59.855 -0.935 1
1 318 . 8 1 1 A 31 31 LYS CB C 31 32.490 32.165 0.325 1
1 322 . 8 1 1 A 31 31 LYS N N 31 117.400 119.516 -2.116 1
1 323 . 8 1 1 A 32 32 LEU H H 32 8.400 8.243 0.157 1
1 324 . 8 1 1 A 32 32 LEU HA H 32 3.990 3.882 0.108 1
1 334 . 8 1 1 A 32 32 LEU C C 32 178.230 178.105 0.125 1
1 335 . 8 1 1 A 32 32 LEU CA C 32 57.700 57.803 -0.103 1
1 336 . 8 1 1 A 32 32 LEU CB C 32 42.540 41.680 0.860 1
1 340 . 8 1 1 A 32 32 LEU N N 32 121.180 119.844 1.336 1
1 341 . 8 1 1 A 33 33 HIS H H 33 7.620 7.930 -0.310 1
1 342 . 8 1 1 A 33 33 HIS HA H 33 4.600 4.664 -0.064 1
1 347 . 8 1 1 A 33 33 HIS C C 33 177.090 174.077 3.013 1
1 348 . 8 1 1 A 33 33 HIS CA C 33 55.840 55.500 0.340 1
1 349 . 8 1 1 A 33 33 HIS CB C 33 29.330 30.000 -0.670 1
1 351 . 8 1 1 A 33 33 HIS N N 33 112.220 115.250 -3.030 1
1 352 . 8 1 1 A 34 34 ASN H H 34 8.030 7.836 0.194 1
1 353 . 8 1 1 A 34 34 ASN HA H 34 4.890 4.312 0.578 1
1 358 . 8 1 1 A 34 34 ASN C C 34 175.910 175.443 0.467 1
1 359 . 8 1 1 A 34 34 ASN CA C 34 54.530 54.455 0.075 1
1 360 . 8 1 1 A 34 34 ASN CB C 34 37.380 36.795 0.585 1
1 361 . 8 1 1 A 34 34 ASN N N 34 117.600 114.732 2.868 1
1 363 . 8 1 1 A 35 35 MET H H 35 8.330 9.121 -0.791 1
1 364 . 8 1 1 A 35 35 MET HA H 35 4.940 4.911 0.029 1
1 372 . 8 1 1 A 35 35 MET C C 35 176.880 176.669 0.211 1
1 373 . 8 1 1 A 35 35 MET CA C 35 55.600 54.779 0.821 1
1 374 . 8 1 1 A 35 35 MET CB C 35 33.790 33.206 0.584 1
1 377 . 8 1 1 A 35 35 MET N N 35 116.190 116.332 -0.142 1
1 378 . 8 1 1 A 36 36 GLU H H 36 9.730 8.209 1.521 1
1 379 . 8 1 1 A 36 36 GLU HA H 36 3.850 4.406 -0.556 1
1 384 . 8 1 1 A 36 36 GLU C C 36 178.290 179.027 -0.737 1
1 385 . 8 1 1 A 36 36 GLU CA C 36 61.280 58.721 2.559 1
1 386 . 8 1 1 A 36 36 GLU CB C 36 29.270 29.372 -0.102 1
1 388 . 8 1 1 A 36 36 GLU N N 36 121.630 120.485 1.145 1
1 389 . 8 1 1 A 37 37 ASP H H 37 8.850 8.198 0.652 1
1 390 . 8 1 1 A 37 37 ASP HA H 37 4.470 4.474 -0.004 1
1 393 . 8 1 1 A 37 37 ASP C C 37 177.190 179.017 -1.827 1
1 394 . 8 1 1 A 37 37 ASP CA C 37 56.140 56.969 -0.829 1
1 395 . 8 1 1 A 37 37 ASP CB C 37 40.050 40.733 -0.683 1
1 396 . 8 1 1 A 37 37 ASP N N 37 114.390 120.196 -5.806 1
1 397 . 8 1 1 A 38 38 LEU H H 38 7.880 7.792 0.088 1
1 398 . 8 1 1 A 38 38 LEU HA H 38 4.290 4.075 0.215 1
1 408 . 8 1 1 A 38 38 LEU C C 38 175.090 177.306 -2.216 1
1 409 . 8 1 1 A 38 38 LEU CA C 38 54.670 57.681 -3.011 1
1 410 . 8 1 1 A 38 38 LEU CB C 38 42.940 41.121 1.819 1
1 414 . 8 1 1 A 38 38 LEU N N 38 116.550 115.374 1.176 1
1 415 . 8 1 1 A 39 39 PHE H H 39 7.500 7.619 -0.119 1
1 416 . 8 1 1 A 39 39 PHE HA H 39 4.970 4.614 0.356 1
1 424 . 8 1 1 A 39 39 PHE C C 39 175.380 175.516 -0.136 1
1 425 . 8 1 1 A 39 39 PHE CA C 39 57.580 58.045 -0.465 1
1 426 . 8 1 1 A 39 39 PHE CB C 39 44.990 39.754 5.236 1
1 432 . 8 1 1 A 39 39 PHE N N 39 115.370 119.790 -4.420 1
1 433 . 8 1 1 A 40 40 GLY H H 40 8.680 8.655 0.025 1
1 434 . 8 1 1 A 40 40 GLY HA2 H 40 3.370 3.996 -0.626 1
1 435 . 8 1 1 A 40 40 GLY HA3 H 40 4.550 4.081 0.469 1
1 436 . 8 1 1 A 40 40 GLY C C 40 173.090 173.746 -0.656 1
1 437 . 8 1 1 A 40 40 GLY CA C 40 44.180 46.011 -1.831 1
1 438 . 8 1 1 A 40 40 GLY N N 40 110.930 111.008 -0.078 1
1 439 . 8 1 1 A 41 41 GLU H H 41 8.320 7.996 0.324 1
1 440 . 8 1 1 A 41 41 GLU HA H 41 4.280 4.992 -0.712 1
1 445 . 8 1 1 A 41 41 GLU C C 41 173.900 174.557 -0.657 1
1 446 . 8 1 1 A 41 41 GLU CA C 41 56.900 54.919 1.981 1
1 447 . 8 1 1 A 41 41 GLU CB C 41 32.110 33.458 -1.348 1
1 449 . 8 1 1 A 41 41 GLU N N 41 126.730 120.125 6.605 1
1 450 . 8 1 1 A 42 42 VAL H H 42 8.100 8.575 -0.475 1
1 451 . 8 1 1 A 42 42 VAL HA H 42 5.160 5.239 -0.079 1
1 459 . 8 1 1 A 42 42 VAL C C 42 176.340 175.025 1.315 1
1 460 . 8 1 1 A 42 42 VAL CA C 42 61.200 60.726 0.474 1
1 461 . 8 1 1 A 42 42 VAL CB C 42 34.770 35.040 -0.270 1
1 464 . 8 1 1 A 42 42 VAL N N 42 119.360 125.040 -5.680 1
1 465 . 8 1 1 A 43 43 MET H H 43 9.870 9.913 -0.043 1
1 466 . 8 1 1 A 43 43 MET HA H 43 5.070 5.169 -0.099 1
1 474 . 8 1 1 A 43 43 MET C C 43 173.890 174.320 -0.430 1
1 475 . 8 1 1 A 43 43 MET CA C 43 54.740 54.528 0.212 1
1 476 . 8 1 1 A 43 43 MET CB C 43 37.500 37.276 0.224 1
1 479 . 8 1 1 A 43 43 MET N N 43 125.720 124.163 1.557 1
1 480 . 8 1 1 A 44 44 VAL H H 44 8.800 8.873 -0.073 1
1 481 . 8 1 1 A 44 44 VAL HA H 44 4.720 4.572 0.148 1
1 489 . 8 1 1 A 44 44 VAL CA C 44 59.090 58.991 0.099 1
1 490 . 8 1 1 A 44 44 VAL CB C 44 33.710 34.972 -1.262 1
1 493 . 8 1 1 A 44 44 VAL N N 44 122.340 123.091 -0.751 1
1 494 . 8 1 1 A 45 45 PRO HA H 45 4.480 4.332 0.148 1
1 501 . 8 1 1 A 45 45 PRO C C 45 177.080 175.749 1.331 1
1 502 . 8 1 1 A 45 45 PRO CA C 45 63.240 64.136 -0.896 1
1 503 . 8 1 1 A 45 45 PRO CB C 45 32.170 31.473 0.697 1
1 506 . 8 1 1 A 46 46 THR H H 46 8.200 7.434 0.766 1
1 507 . 8 1 1 A 46 46 THR HA H 46 4.290 4.558 -0.268 1
1 512 . 8 1 1 A 46 46 THR C C 46 174.600 173.860 0.740 1
1 513 . 8 1 1 A 46 46 THR CA C 46 62.100 60.391 1.709 1
1 514 . 8 1 1 A 46 46 THR CB C 46 69.990 70.798 -0.808 1
1 516 . 8 1 1 A 46 46 THR N N 46 113.410 109.130 4.280 1
1 517 . 8 1 1 A 47 47 GLU H H 47 8.380 8.543 -0.163 1
1 518 . 8 1 1 A 47 47 GLU HA H 47 4.400 4.959 -0.559 1
1 521 . 8 1 1 A 47 47 GLU C C 47 175.970 175.025 0.945 1
1 522 . 8 1 1 A 47 47 GLU CA C 47 55.200 54.653 0.547 1
1 523 . 8 1 1 A 47 47 GLU CB C 47 32.300 33.059 -0.759 1
1 524 . 8 1 1 A 47 47 GLU N N 47 122.830 120.070 2.760 1
1 525 . 8 1 1 A 48 48 GLU H H 48 8.400 8.793 -0.393 1
1 526 . 8 1 1 A 48 48 GLU HA H 48 4.280 5.022 -0.742 1
1 531 . 8 1 1 A 48 48 GLU C C 48 175.750 175.223 0.527 1
1 532 . 8 1 1 A 48 48 GLU CA C 48 55.190 54.576 0.614 1
1 533 . 8 1 1 A 48 48 GLU CB C 48 31.980 33.028 -1.048 1
1 535 . 8 1 1 A 48 48 GLU N N 48 121.950 121.576 0.374 1
1 536 . 8 1 1 A 49 49 VAL H H 49 8.240 8.696 -0.456 1
1 537 . 8 1 1 A 49 49 VAL HA H 49 4.170 4.510 -0.340 1
1 542 . 8 1 1 A 49 49 VAL C C 49 174.610 175.837 -1.227 1
1 543 . 8 1 1 A 49 49 VAL CA C 49 62.280 61.080 1.200 1
1 544 . 8 1 1 A 49 49 VAL CB C 49 32.930 34.237 -1.307 1
1 546 . 8 1 1 A 49 49 VAL N N 49 123.990 122.913 1.077 1
1 547 . 8 1 1 A 50 50 VAL H H 50 8.230 9.338 -1.108 1
1 548 . 8 1 1 A 50 50 VAL HA H 50 4.220 3.769 0.451 1
1 553 . 8 1 1 A 50 50 VAL C C 50 175.770 175.775 -0.005 1
1 554 . 8 1 1 A 50 50 VAL CA C 50 62.170 63.423 -1.253 1
1 555 . 8 1 1 A 50 50 VAL CB C 50 33.110 29.674 3.436 1
1 557 . 8 1 1 A 50 50 VAL N N 50 123.960 127.417 -3.457 1
1 558 . 8 1 1 A 51 51 GLU H H 51 8.570 8.494 0.076 1
1 559 . 8 1 1 A 51 51 GLU HA H 51 4.380 4.033 0.347 1
1 564 . 8 1 1 A 51 51 GLU C C 51 175.920 175.714 0.206 1
1 565 . 8 1 1 A 51 51 GLU CA C 51 56.050 57.208 -1.158 1
1 566 . 8 1 1 A 51 51 GLU CB C 51 31.080 28.333 2.747 1
1 568 . 8 1 1 A 51 51 GLU N N 51 125.070 120.237 4.833 1
1 569 . 8 1 1 A 52 52 ILE H H 52 8.320 8.042 0.278 1
1 570 . 8 1 1 A 52 52 ILE HA H 52 4.290 4.735 -0.445 1
1 580 . 8 1 1 A 52 52 ILE C C 52 176.330 175.130 1.200 1
1 581 . 8 1 1 A 52 52 ILE CA C 52 60.940 60.436 0.504 1
1 582 . 8 1 1 A 52 52 ILE CB C 52 38.510 40.518 -2.008 1
1 586 . 8 1 1 A 52 52 ILE N N 52 122.760 126.418 -3.658 1
1 587 . 8 1 1 A 53 53 ARG H H 53 8.500 8.565 -0.065 1
1 588 . 8 1 1 A 53 53 ARG HA H 53 4.430 4.163 0.267 1
1 595 . 8 1 1 A 53 53 ARG C C 53 176.950 176.217 0.733 1
1 596 . 8 1 1 A 53 53 ARG CA C 53 56.150 57.549 -1.399 1
1 597 . 8 1 1 A 53 53 ARG CB C 53 30.200 30.820 -0.620 1
1 600 . 8 1 1 A 53 53 ARG N N 53 125.250 129.540 -4.290 1
1 601 . 8 1 1 A 54 54 GLY H H 54 8.760 8.495 0.265 1
1 602 . 8 1 1 A 54 54 GLY HA2 H 54 3.920 4.221 -0.301 1
1 603 . 8 1 1 A 54 54 GLY HA3 H 54 4.010 4.248 -0.238 1
1 604 . 8 1 1 A 54 54 GLY C C 54 175.110 173.888 1.222 1
1 605 . 8 1 1 A 54 54 GLY CA C 54 46.030 45.004 1.026 1
1 606 . 8 1 1 A 54 54 GLY N N 54 112.510 109.053 3.457 1
1 607 . 8 1 1 A 55 55 GLY H H 55 8.350 8.631 -0.281 1
1 608 . 8 1 1 A 55 55 GLY HA2 H 55 3.980 3.753 0.227 1
1 609 . 8 1 1 A 55 55 GLY HA3 H 55 3.980 3.998 -0.018 1
1 610 . 8 1 1 A 55 55 GLY C C 55 173.920 175.781 -1.861 1
1 611 . 8 1 1 A 55 55 GLY CA C 55 45.200 45.376 -0.176 1
1 612 . 8 1 1 A 55 55 GLY N N 55 107.940 109.677 -1.737 1
1 613 . 8 1 1 A 56 56 GLN H H 56 8.100 8.195 -0.095 1
1 614 . 8 1 1 A 56 56 GLN HA H 56 4.420 4.133 0.287 1
1 619 . 8 1 1 A 56 56 GLN C C 56 175.570 175.826 -0.256 1
1 620 . 8 1 1 A 56 56 GLN CA C 56 55.420 58.127 -2.707 1
1 621 . 8 1 1 A 56 56 GLN CB C 56 30.100 28.946 1.154 1
1 623 . 8 1 1 A 56 56 GLN N N 56 119.350 118.041 1.309 1
1 624 . 8 1 1 A 57 57 ARG H H 57 8.520 7.899 0.621 1
1 625 . 8 1 1 A 57 57 ARG HA H 57 4.400 4.749 -0.349 1
1 632 . 8 1 1 A 57 57 ARG C C 57 176.210 176.803 -0.593 1
1 633 . 8 1 1 A 57 57 ARG CA C 57 56.440 54.430 2.010 1
1 634 . 8 1 1 A 57 57 ARG CB C 57 30.930 33.401 -2.471 1
1 637 . 8 1 1 A 57 57 ARG N N 57 122.610 118.185 4.425 1
1 638 . 8 1 1 A 58 58 ARG H H 58 8.630 8.582 0.048 1
1 639 . 8 1 1 A 58 58 ARG HA H 58 4.430 4.067 0.363 1
1 646 . 8 1 1 A 58 58 ARG C C 58 175.950 176.953 -1.003 1
1 647 . 8 1 1 A 58 58 ARG CA C 58 55.450 59.448 -3.998 1
1 648 . 8 1 1 A 58 58 ARG CB C 58 31.300 30.085 1.215 1
1 651 . 8 1 1 A 58 58 ARG N N 58 123.320 122.351 0.969 1
1 652 . 8 1 1 A 59 59 LYS H H 59 8.560 7.587 0.973 1
1 653 . 8 1 1 A 59 59 LYS HA H 59 4.410 4.199 0.211 1
1 662 . 8 1 1 A 59 59 LYS C C 59 176.590 175.402 1.188 1
1 663 . 8 1 1 A 59 59 LYS CA C 59 56.720 56.785 -0.065 1
1 664 . 8 1 1 A 59 59 LYS CB C 59 33.150 32.953 0.197 1
1 668 . 8 1 1 A 59 59 LYS N N 59 123.380 121.992 1.388 1
1 669 . 8 1 1 A 60 60 SER H H 60 8.450 8.229 0.221 1
1 670 . 8 1 1 A 60 60 SER HA H 60 4.480 4.862 -0.382 1
1 673 . 8 1 1 A 60 60 SER C C 60 174.280 175.422 -1.142 1
1 674 . 8 1 1 A 60 60 SER CA C 60 58.140 55.995 2.145 1
1 675 . 8 1 1 A 60 60 SER CB C 60 64.160 64.718 -0.558 1
1 676 . 8 1 1 A 60 60 SER N N 60 117.320 121.786 -4.466 1
1 677 . 8 1 1 A 61 61 GLU H H 61 8.550 8.537 0.013 1
1 678 . 8 1 1 A 61 61 GLU HA H 61 4.400 4.235 0.165 1
1 683 . 8 1 1 A 61 61 GLU C C 61 176.150 176.586 -0.436 1
1 684 . 8 1 1 A 61 61 GLU CA C 61 56.300 58.935 -2.635 1
1 685 . 8 1 1 A 61 61 GLU CB C 61 30.790 30.424 0.366 1
1 687 . 8 1 1 A 61 61 GLU N N 61 122.810 125.646 -2.836 1
1 688 . 8 1 1 A 62 62 ARG H H 62 8.310 7.888 0.422 1
1 689 . 8 1 1 A 62 62 ARG HA H 62 4.340 4.867 -0.527 1
1 692 . 8 1 1 A 62 62 ARG C C 62 176.140 175.477 0.663 1
1 693 . 8 1 1 A 62 62 ARG CA C 62 56.230 54.658 1.572 1
1 694 . 8 1 1 A 62 62 ARG CB C 62 30.780 33.250 -2.470 1
1 695 . 8 1 1 A 62 62 ARG N N 62 122.080 118.468 3.612 1
1 696 . 8 1 1 A 63 63 LYS H H 63 8.470 8.781 -0.311 1
1 697 . 8 1 1 A 63 63 LYS HA H 63 4.300 4.460 -0.160 1
1 700 . 8 1 1 A 63 63 LYS C C 63 175.490 174.903 0.587 1
1 701 . 8 1 1 A 63 63 LYS CA C 63 56.200 55.479 0.721 1
1 702 . 8 1 1 A 63 63 LYS CB C 63 30.730 32.473 -1.743 1
1 703 . 8 1 1 A 63 63 LYS N N 63 123.450 122.876 0.574 1
1 704 . 8 1 1 A 64 64 PHE H H 64 8.200 7.689 0.511 1
1 705 . 8 1 1 A 64 64 PHE HA H 64 4.450 4.836 -0.386 1
1 710 . 8 1 1 A 64 64 PHE C C 64 174.250 175.750 -1.500 1
1 711 . 8 1 1 A 64 64 PHE CA C 64 57.430 56.915 0.515 1
1 712 . 8 1 1 A 64 64 PHE CB C 64 40.330 41.416 -1.086 1
1 715 . 8 1 1 A 64 64 PHE N N 64 121.740 119.762 1.978 1
1 716 . 8 1 1 A 65 65 PHE H H 65 8.130 8.526 -0.396 1
1 717 . 8 1 1 A 65 65 PHE HA H 65 4.440 3.922 0.518 1
1 725 . 8 1 1 A 65 65 PHE CA C 65 55.650 58.553 -2.903 1
1 726 . 8 1 1 A 65 65 PHE CB C 65 38.900 36.601 2.299 1
1 731 . 8 1 1 A 65 65 PHE N N 65 120.910 121.024 -0.114 1
1 732 . 8 1 1 A 66 66 PRO C C 66 176.780 177.981 -1.201 1
1 733 . 8 1 1 A 67 67 GLY H H 67 9.970 8.717 1.253 1
1 734 . 8 1 1 A 67 67 GLY HA2 H 67 3.820 4.019 -0.199 1
1 735 . 8 1 1 A 67 67 GLY HA3 H 67 4.400 4.049 0.351 1
1 736 . 8 1 1 A 67 67 GLY C C 67 173.670 174.158 -0.488 1
1 737 . 8 1 1 A 67 67 GLY CA C 67 45.900 46.156 -0.256 1
1 738 . 8 1 1 A 67 67 GLY N N 67 111.550 112.934 -1.384 1
1 739 . 8 1 1 A 68 68 TYR H H 68 7.650 7.694 -0.044 1
1 740 . 8 1 1 A 68 68 TYR HA H 68 5.000 4.949 0.051 1
1 747 . 8 1 1 A 68 68 TYR C C 68 175.220 174.954 0.266 1
1 748 . 8 1 1 A 68 68 TYR CA C 68 57.940 57.196 0.744 1
1 753 . 8 1 1 A 68 68 TYR N N 68 118.800 118.435 0.365 1
1 754 . 8 1 1 A 69 69 VAL H H 69 9.090 8.986 0.104 1
1 755 . 8 1 1 A 69 69 VAL HA H 69 4.330 4.943 -0.613 1
1 763 . 8 1 1 A 69 69 VAL C C 69 174.250 174.907 -0.657 1
1 764 . 8 1 1 A 69 69 VAL CA C 69 62.120 60.242 1.878 1
1 765 . 8 1 1 A 69 69 VAL CB C 69 35.240 35.608 -0.368 1
1 768 . 8 1 1 A 69 69 VAL N N 69 119.300 123.204 -3.904 1
1 769 . 8 1 1 A 70 70 LEU H H 70 9.190 8.754 0.436 1
1 770 . 8 1 1 A 70 70 LEU HA H 70 5.460 5.420 0.040 1
1 780 . 8 1 1 A 70 70 LEU C C 70 176.130 176.207 -0.077 1
1 781 . 8 1 1 A 70 70 LEU CA C 70 54.120 53.372 0.748 1
1 782 . 8 1 1 A 70 70 LEU CB C 70 43.330 43.237 0.093 1
1 786 . 8 1 1 A 70 70 LEU N N 70 126.710 126.516 0.194 1
1 787 . 8 1 1 A 71 71 VAL H H 71 9.350 9.343 0.007 1
1 788 . 8 1 1 A 71 71 VAL HA H 71 5.040 4.810 0.230 1
1 796 . 8 1 1 A 71 71 VAL C C 71 173.670 174.806 -1.136 1
1 797 . 8 1 1 A 71 71 VAL CA C 71 61.090 61.253 -0.163 1
1 798 . 8 1 1 A 71 71 VAL CB C 71 35.800 35.551 0.249 1
1 801 . 8 1 1 A 71 71 VAL N N 71 121.920 124.935 -3.015 1
1 802 . 8 1 1 A 72 72 GLN H H 72 8.390 9.136 -0.746 1
1 803 . 8 1 1 A 72 72 GLN HA H 72 4.610 4.634 -0.024 1
1 810 . 8 1 1 A 72 72 GLN C C 72 175.920 174.527 1.393 1
1 811 . 8 1 1 A 72 72 GLN CA C 72 53.810 55.143 -1.333 1
1 812 . 8 1 1 A 72 72 GLN CB C 72 28.850 28.440 0.410 1
1 814 . 8 1 1 A 72 72 GLN N N 72 130.760 127.937 2.823 1
1 816 . 8 1 1 A 73 73 MET H H 73 9.750 8.911 0.839 1
1 817 . 8 1 1 A 73 73 MET HA H 73 5.060 5.219 -0.159 1
1 825 . 8 1 1 A 73 73 MET C C 73 175.500 174.580 0.920 1
1 826 . 8 1 1 A 73 73 MET CA C 73 55.520 54.555 0.965 1
1 827 . 8 1 1 A 73 73 MET CB C 73 35.350 35.678 -0.328 1
1 830 . 8 1 1 A 73 73 MET N N 73 121.070 125.001 -3.931 1
1 831 . 8 1 1 A 74 74 VAL H H 74 8.530 8.535 -0.005 1
1 832 . 8 1 1 A 74 74 VAL HA H 74 3.970 4.272 -0.302 1
1 840 . 8 1 1 A 74 74 VAL C C 74 174.900 175.959 -1.059 1
1 841 . 8 1 1 A 74 74 VAL CA C 74 62.150 62.171 -0.021 1
1 842 . 8 1 1 A 74 74 VAL CB C 74 32.480 32.438 0.042 1
1 845 . 8 1 1 A 74 74 VAL N N 74 124.120 124.451 -0.331 1
1 846 . 8 1 1 A 75 75 MET H H 75 8.600 8.506 0.094 1
1 847 . 8 1 1 A 75 75 MET HA H 75 4.360 4.421 -0.061 1
1 855 . 8 1 1 A 75 75 MET C C 75 173.480 175.878 -2.398 1
1 856 . 8 1 1 A 75 75 MET CA C 75 53.830 54.107 -0.277 1
1 857 . 8 1 1 A 75 75 MET CB C 75 29.960 31.956 -1.996 1
1 860 . 8 1 1 A 75 75 MET N N 75 128.250 126.500 1.750 1
1 861 . 8 1 1 A 76 76 ASN H H 76 8.410 7.734 0.676 1
1 862 . 8 1 1 A 76 76 ASN HA H 76 4.540 5.101 -0.561 1
1 867 . 8 1 1 A 76 76 ASN C C 76 173.950 175.855 -1.905 1
1 868 . 8 1 1 A 76 76 ASN CA C 76 51.720 51.019 0.701 1
1 869 . 8 1 1 A 76 76 ASN CB C 76 38.430 40.305 -1.875 1
1 870 . 8 1 1 A 76 76 ASN N N 76 127.500 124.010 3.490 1
1 872 . 8 1 1 A 77 77 ASP H H 77 8.470 8.888 -0.418 1
1 873 . 8 1 1 A 77 77 ASP HA H 77 4.410 4.368 0.042 1
1 876 . 8 1 1 A 77 77 ASP C C 77 178.530 178.209 0.321 1
1 877 . 8 1 1 A 77 77 ASP CA C 77 58.730 56.591 2.139 1
1 878 . 8 1 1 A 77 77 ASP CB C 77 40.940 40.734 0.206 1
1 879 . 8 1 1 A 77 77 ASP N N 77 117.090 118.912 -1.822 1
1 880 . 8 1 1 A 78 78 ALA H H 78 8.160 7.854 0.306 1
1 881 . 8 1 1 A 78 78 ALA HA H 78 4.350 4.190 0.160 1
1 885 . 8 1 1 A 78 78 ALA C C 78 181.250 179.614 1.636 1
1 886 . 8 1 1 A 78 78 ALA CA C 78 55.190 55.152 0.038 1
1 887 . 8 1 1 A 78 78 ALA CB C 78 18.260 19.389 -1.129 1
1 888 . 8 1 1 A 78 78 ALA N N 78 122.500 123.428 -0.928 1
1 889 . 8 1 1 A 79 79 SER H H 79 9.320 8.746 0.574 1
1 890 . 8 1 1 A 79 79 SER HA H 79 4.290 4.402 -0.112 1
1 893 . 8 1 1 A 79 79 SER C C 79 176.570 176.877 -0.307 1
1 894 . 8 1 1 A 79 79 SER CA C 79 61.080 61.698 -0.618 1
1 895 . 8 1 1 A 79 79 SER CB C 79 62.200 62.404 -0.204 1
1 896 . 8 1 1 A 79 79 SER N N 79 119.280 112.122 7.158 1
1 897 . 8 1 1 A 80 80 TRP H H 80 8.900 7.835 1.065 1
1 898 . 8 1 1 A 80 80 TRP HA H 80 4.020 4.335 -0.315 1
1 907 . 8 1 1 A 80 80 TRP C C 80 178.210 177.930 0.280 1
1 908 . 8 1 1 A 80 80 TRP CA C 80 62.490 61.491 0.999 1
1 909 . 8 1 1 A 80 80 TRP CB C 80 29.800 30.282 -0.482 1
1 915 . 8 1 1 A 80 80 TRP N N 80 125.870 123.856 2.014 1
1 917 . 8 1 1 A 81 81 HIS H H 81 8.190 8.011 0.179 1
1 918 . 8 1 1 A 81 81 HIS HA H 81 3.930 4.277 -0.347 1
1 923 . 8 1 1 A 81 81 HIS C C 81 177.740 176.502 1.238 1
1 924 . 8 1 1 A 81 81 HIS CA C 81 61.020 59.802 1.218 1
1 925 . 8 1 1 A 81 81 HIS CB C 81 28.910 29.358 -0.448 1
1 927 . 8 1 1 A 81 81 HIS N N 81 114.080 119.674 -5.594 1
1 928 . 8 1 1 A 82 82 LEU H H 82 8.080 8.753 -0.673 1
1 929 . 8 1 1 A 82 82 LEU HA H 82 3.900 3.651 0.249 1
1 939 . 8 1 1 A 82 82 LEU C C 82 180.330 178.459 1.871 1
1 940 . 8 1 1 A 82 82 LEU CA C 82 58.590 58.123 0.467 1
1 941 . 8 1 1 A 82 82 LEU CB C 82 41.350 41.312 0.038 1
1 945 . 8 1 1 A 82 82 LEU N N 82 121.320 120.495 0.825 1
1 946 . 8 1 1 A 83 83 VAL H H 83 8.000 8.469 -0.469 1
1 947 . 8 1 1 A 83 83 VAL HA H 83 3.210 3.307 -0.097 1
1 955 . 8 1 1 A 83 83 VAL C C 83 177.060 177.805 -0.745 1
1 956 . 8 1 1 A 83 83 VAL CA C 83 67.430 66.938 0.492 1
1 957 . 8 1 1 A 83 83 VAL CB C 83 31.680 31.442 0.238 1
1 960 . 8 1 1 A 83 83 VAL N N 83 118.850 118.628 0.222 1
1 961 . 8 1 1 A 84 84 ARG H H 84 7.540 7.568 -0.028 1
1 962 . 8 1 1 A 84 84 ARG HA H 84 3.590 3.688 -0.098 1
1 969 . 8 1 1 A 84 84 ARG C C 84 177.240 178.081 -0.841 1
1 970 . 8 1 1 A 84 84 ARG CA C 84 56.050 59.536 -3.486 1
1 971 . 8 1 1 A 84 84 ARG CB C 84 28.190 29.815 -1.625 1
1 974 . 8 1 1 A 84 84 ARG N N 84 111.460 120.324 -8.864 1
1 975 . 8 1 1 A 85 85 SER H H 85 7.530 7.342 0.188 1
1 976 . 8 1 1 A 85 85 SER HA H 85 4.280 4.089 0.191 1
1 979 . 8 1 1 A 85 85 SER C C 85 173.930 174.697 -0.767 1
1 980 . 8 1 1 A 85 85 SER CA C 85 59.220 61.205 -1.985 1
1 981 . 8 1 1 A 85 85 SER CB C 85 63.830 62.757 1.073 1
1 982 . 8 1 1 A 85 85 SER N N 85 113.660 114.261 -0.601 1
1 983 . 8 1 1 A 86 86 VAL H H 86 7.230 7.459 -0.229 1
1 984 . 8 1 1 A 86 86 VAL HA H 86 3.480 3.907 -0.427 1
1 992 . 8 1 1 A 86 86 VAL CA C 86 61.300 61.181 0.119 1
1 993 . 8 1 1 A 86 86 VAL CB C 86 31.780 32.185 -0.405 1
1 996 . 8 1 1 A 86 86 VAL N N 86 128.120 121.733 6.387 1
1 997 . 8 1 1 A 87 87 PRO HA H 87 4.140 4.363 -0.223 1
1 1004 . 8 1 1 A 87 87 PRO C C 87 176.400 176.751 -0.351 1
1 1005 . 8 1 1 A 87 87 PRO CA C 87 64.100 63.329 0.771 1
1 1006 . 8 1 1 A 87 87 PRO CB C 87 31.710 32.283 -0.573 1
1 1009 . 8 1 1 A 88 88 ARG H H 88 8.320 8.729 -0.409 1
1 1010 . 8 1 1 A 88 88 ARG HA H 88 3.030 4.015 -0.985 1
1 1017 . 8 1 1 A 88 88 ARG C C 88 174.630 174.962 -0.332 1
1 1018 . 8 1 1 A 88 88 ARG CA C 88 57.620 57.360 0.260 1
1 1019 . 8 1 1 A 88 88 ARG CB C 88 26.960 27.939 -0.979 1
1 1022 . 8 1 1 A 88 88 ARG N N 88 111.360 116.224 -4.864 1
1 1023 . 8 1 1 A 89 89 VAL H H 89 7.390 7.798 -0.408 1
1 1024 . 8 1 1 A 89 89 VAL HA H 89 3.910 4.335 -0.425 1
1 1032 . 8 1 1 A 89 89 VAL C C 89 177.370 175.601 1.769 1
1 1033 . 8 1 1 A 89 89 VAL CA C 89 64.170 61.224 2.946 1
1 1034 . 8 1 1 A 89 89 VAL CB C 89 32.070 33.887 -1.817 1
1 1037 . 8 1 1 A 89 89 VAL N N 89 117.900 118.744 -0.844 1
1 1038 . 8 1 1 A 90 90 MET H H 90 9.290 8.543 0.747 1
1 1039 . 8 1 1 A 90 90 MET HA H 90 4.340 4.109 0.231 1
1 1047 . 8 1 1 A 90 90 MET C C 90 175.800 176.116 -0.316 1
1 1048 . 8 1 1 A 90 90 MET CA C 90 56.440 56.898 -0.458 1
1 1049 . 8 1 1 A 90 90 MET CB C 90 34.160 32.934 1.226 1
1 1052 . 8 1 1 A 90 90 MET N N 90 128.200 125.741 2.459 1
1 1053 . 8 1 1 A 91 91 GLY H H 91 7.130 6.758 0.372 1
1 1054 . 8 1 1 A 91 91 GLY HA2 H 91 3.340 3.923 -0.583 1
1 1055 . 8 1 1 A 91 91 GLY HA3 H 91 4.410 4.022 0.388 1
1 1056 . 8 1 1 A 91 91 GLY C C 91 170.920 171.522 -0.602 1
1 1057 . 8 1 1 A 91 91 GLY CA C 91 44.440 45.706 -1.266 1
1 1058 . 8 1 1 A 91 91 GLY N N 91 104.320 103.910 0.410 1
1 1059 . 8 1 1 A 92 92 PHE H H 92 8.790 8.503 0.287 1
1 1060 . 8 1 1 A 92 92 PHE HA H 92 5.270 5.322 -0.052 1
1 1068 . 8 1 1 A 92 92 PHE C C 92 176.230 175.200 1.030 1
1 1069 . 8 1 1 A 92 92 PHE CA C 92 57.480 56.911 0.569 1
1 1070 . 8 1 1 A 92 92 PHE CB C 92 42.190 42.944 -0.754 1
1 1075 . 8 1 1 A 92 92 PHE N N 92 118.770 119.604 -0.834 1
1 1076 . 8 1 1 A 93 93 ILE H H 93 8.800 8.294 0.506 1
1 1077 . 8 1 1 A 93 93 ILE HA H 93 4.310 5.021 -0.711 1
1 1087 . 8 1 1 A 93 93 ILE C C 93 176.380 176.038 0.342 1
1 1088 . 8 1 1 A 93 93 ILE CA C 93 60.480 59.733 0.747 1
1 1089 . 8 1 1 A 93 93 ILE CB C 93 38.010 40.487 -2.477 1
1 1093 . 8 1 1 A 93 93 ILE N N 93 122.300 121.323 0.977 1
1 1094 . 8 1 1 A 94 94 GLY H H 94 8.640 8.382 0.258 1
1 1095 . 8 1 1 A 94 94 GLY HA2 H 94 3.830 4.306 -0.476 1
1 1096 . 8 1 1 A 94 94 GLY HA3 H 94 4.600 4.308 0.292 1
1 1097 . 8 1 1 A 94 94 GLY C C 94 175.080 174.420 0.660 1
1 1098 . 8 1 1 A 94 94 GLY CA C 94 44.530 46.188 -1.658 1
1 1099 . 8 1 1 A 94 94 GLY N N 94 116.550 113.640 2.910 1
1 1100 . 8 1 1 A 95 95 GLY H H 95 8.900 8.790 0.110 1
1 1101 . 8 1 1 A 95 95 GLY HA2 H 95 3.970 3.891 0.079 1
1 1102 . 8 1 1 A 95 95 GLY HA3 H 95 4.370 3.899 0.471 1
1 1103 . 8 1 1 A 95 95 GLY C C 95 174.560 174.045 0.515 1
1 1104 . 8 1 1 A 95 95 GLY CA C 95 45.640 47.055 -1.415 1
1 1105 . 8 1 1 A 95 95 GLY N N 95 112.960 109.873 3.087 1
1 1106 . 8 1 1 A 96 96 THR H H 96 7.830 7.743 0.087 1
1 1107 . 8 1 1 A 96 96 THR HA H 96 4.720 4.858 -0.138 1
1 1112 . 8 1 1 A 96 96 THR C C 96 176.260 173.509 2.751 1
1 1113 . 8 1 1 A 96 96 THR CA C 96 60.360 60.123 0.237 1
1 1114 . 8 1 1 A 96 96 THR CB C 96 70.960 71.149 -0.189 1
1 1116 . 8 1 1 A 96 96 THR N N 96 113.350 113.253 0.097 1
1 1117 . 8 1 1 A 97 97 SER H H 97 8.850 8.864 -0.014 1
1 1118 . 8 1 1 A 97 97 SER HA H 97 4.310 4.679 -0.369 1
1 1121 . 8 1 1 A 97 97 SER C C 97 175.570 174.455 1.115 1
1 1122 . 8 1 1 A 97 97 SER CA C 97 60.850 59.014 1.836 1
1 1123 . 8 1 1 A 97 97 SER CB C 97 63.000 63.384 -0.384 1
1 1124 . 8 1 1 A 97 97 SER N N 97 116.420 118.696 -2.276 1
1 1125 . 8 1 1 A 98 98 ASP H H 98 8.360 8.033 0.327 1
1 1126 . 8 1 1 A 98 98 ASP HA H 98 4.310 5.078 -0.768 1
1 1129 . 8 1 1 A 98 98 ASP C C 98 175.380 175.895 -0.515 1
1 1130 . 8 1 1 A 98 98 ASP CA C 98 54.190 54.486 -0.296 1
1 1131 . 8 1 1 A 98 98 ASP CB C 98 40.740 43.157 -2.417 1
1 1132 . 8 1 1 A 98 98 ASP N N 98 116.320 119.500 -3.180 1
1 1133 . 8 1 1 A 99 99 ARG H H 99 7.450 7.726 -0.276 1
1 1134 . 8 1 1 A 99 99 ARG HA H 99 4.350 4.613 -0.263 1
1 1141 . 8 1 1 A 99 99 ARG CA C 99 52.920 53.148 -0.228 1
1 1142 . 8 1 1 A 99 99 ARG CB C 99 30.340 31.470 -1.130 1
1 1145 . 8 1 1 A 99 99 ARG N N 99 119.960 119.534 0.426 1
1 1146 . 8 1 1 A 100 100 PRO HA H 100 4.750 4.599 0.151 1
1 1153 . 8 1 1 A 100 100 PRO C C 100 175.220 177.065 -1.845 1
1 1154 . 8 1 1 A 100 100 PRO CA C 100 62.680 62.701 -0.021 1
1 1155 . 8 1 1 A 100 100 PRO CB C 100 32.820 31.713 1.107 1
1 1158 . 8 1 1 A 101 101 ALA H H 101 7.210 8.375 -1.165 1
1 1159 . 8 1 1 A 101 101 ALA HA H 101 5.030 4.600 0.430 1
1 1163 . 8 1 1 A 101 101 ALA CA C 101 48.570 50.322 -1.752 1
1 1164 . 8 1 1 A 101 101 ALA CB C 101 19.660 17.337 2.323 1
1 1165 . 8 1 1 A 101 101 ALA N N 101 124.490 124.964 -0.474 1
1 1166 . 8 1 1 A 102 102 PRO HA H 102 4.440 4.354 0.086 1
1 1173 . 8 1 1 A 102 102 PRO C C 102 177.200 176.494 0.706 1
1 1174 . 8 1 1 A 102 102 PRO CA C 102 62.190 62.732 -0.542 1
1 1175 . 8 1 1 A 102 102 PRO CB C 102 32.310 32.741 -0.431 1
1 1178 . 8 1 1 A 103 103 ILE H H 103 8.550 8.124 0.426 1
1 1179 . 8 1 1 A 103 103 ILE HA H 103 4.630 4.891 -0.261 1
1 1189 . 8 1 1 A 103 103 ILE C C 103 175.460 175.211 0.249 1
1 1190 . 8 1 1 A 103 103 ILE CA C 103 59.730 58.490 1.240 1
1 1191 . 8 1 1 A 103 103 ILE CB C 103 40.140 42.069 -1.929 1
1 1195 . 8 1 1 A 103 103 ILE N N 103 115.670 116.432 -0.762 1
1 1196 . 8 1 1 A 104 104 SER H H 104 8.730 8.736 -0.006 1
1 1197 . 8 1 1 A 104 104 SER HA H 104 4.500 4.552 -0.052 1
1 1200 . 8 1 1 A 104 104 SER C C 104 174.840 175.485 -0.645 1
1 1201 . 8 1 1 A 104 104 SER CA C 104 58.010 58.358 -0.348 1
1 1202 . 8 1 1 A 104 104 SER CB C 104 65.470 64.017 1.453 1
1 1203 . 8 1 1 A 104 104 SER N N 104 119.170 120.065 -0.895 1
1 1204 . 8 1 1 A 105 105 ASP H H 105 8.830 9.052 -0.222 1
1 1205 . 8 1 1 A 105 105 ASP HA H 105 4.200 4.241 -0.041 1
1 1208 . 8 1 1 A 105 105 ASP C C 105 178.520 178.319 0.201 1
1 1209 . 8 1 1 A 105 105 ASP CA C 105 57.870 58.011 -0.141 1
1 1210 . 8 1 1 A 105 105 ASP CB C 105 40.040 40.267 -0.227 1
1 1211 . 8 1 1 A 105 105 ASP N N 105 121.640 125.089 -3.449 1
1 1212 . 8 1 1 A 106 106 LYS H H 106 8.130 7.972 0.158 1
1 1213 . 8 1 1 A 106 106 LYS HA H 106 4.100 3.890 0.210 1
1 1222 . 8 1 1 A 106 106 LYS C C 106 179.400 178.699 0.701 1
1 1223 . 8 1 1 A 106 106 LYS CA C 106 58.980 59.480 -0.500 1
1 1224 . 8 1 1 A 106 106 LYS CB C 106 32.330 32.147 0.183 1
1 1228 . 8 1 1 A 106 106 LYS N N 106 118.300 120.554 -2.254 1
1 1229 . 8 1 1 A 107 107 GLU H H 107 7.670 7.866 -0.196 1
1 1230 . 8 1 1 A 107 107 GLU HA H 107 4.020 4.085 -0.065 1
1 1235 . 8 1 1 A 107 107 GLU C C 107 178.750 179.457 -0.707 1
1 1236 . 8 1 1 A 107 107 GLU CA C 107 59.210 59.204 0.006 1
1 1237 . 8 1 1 A 107 107 GLU CB C 107 29.780 29.622 0.158 1
1 1239 . 8 1 1 A 107 107 GLU N N 107 121.270 119.386 1.884 1
1 1240 . 8 1 1 A 108 108 VAL H H 108 7.790 7.841 -0.051 1
1 1241 . 8 1 1 A 108 108 VAL HA H 108 3.050 3.496 -0.446 1
1 1249 . 8 1 1 A 108 108 VAL C C 108 177.550 177.249 0.301 1
1 1250 . 8 1 1 A 108 108 VAL CA C 108 67.080 66.375 0.705 1
1 1251 . 8 1 1 A 108 108 VAL CB C 108 31.220 30.989 0.231 1
1 1254 . 8 1 1 A 108 108 VAL N N 108 120.940 121.177 -0.237 1
1 1255 . 8 1 1 A 109 109 ASP H H 109 7.840 7.856 -0.016 1
1 1256 . 8 1 1 A 109 109 ASP HA H 109 4.110 4.240 -0.130 1
1 1259 . 8 1 1 A 109 109 ASP C C 109 178.190 178.497 -0.307 1
1 1260 . 8 1 1 A 109 109 ASP CA C 109 57.470 57.203 0.267 1
1 1261 . 8 1 1 A 109 109 ASP CB C 109 40.480 39.991 0.489 1
1 1262 . 8 1 1 A 109 109 ASP N N 109 118.780 120.228 -1.448 1
1 1263 . 8 1 1 A 110 110 ALA H H 110 7.520 7.705 -0.185 1
1 1264 . 8 1 1 A 110 110 ALA HA H 110 4.110 4.094 0.016 1
1 1268 . 8 1 1 A 110 110 ALA C C 110 180.550 179.854 0.696 1
1 1269 . 8 1 1 A 110 110 ALA CA C 110 54.880 55.119 -0.239 1
1 1270 . 8 1 1 A 110 110 ALA CB C 110 18.440 18.369 0.071 1
1 1271 . 8 1 1 A 110 110 ALA N N 110 120.640 122.298 -1.658 1
1 1272 . 8 1 1 A 111 111 ILE H H 111 7.840 8.151 -0.311 1
1 1273 . 8 1 1 A 111 111 ILE HA H 111 3.580 3.753 -0.173 1
1 1281 . 8 1 1 A 111 111 ILE C C 111 177.470 178.140 -0.670 1
1 1282 . 8 1 1 A 111 111 ILE CA C 111 64.620 65.102 -0.482 1
1 1283 . 8 1 1 A 111 111 ILE CB C 111 38.600 37.885 0.715 1
1 1286 . 8 1 1 A 111 111 ILE N N 111 119.840 118.753 1.087 1
1 1287 . 8 1 1 A 112 112 MET H H 112 8.100 7.952 0.148 1
1 1288 . 8 1 1 A 112 112 MET HA H 112 4.400 3.903 0.497 1
1 1296 . 8 1 1 A 112 112 MET C C 112 177.710 178.739 -1.029 1
1 1297 . 8 1 1 A 112 112 MET CA C 112 55.300 58.807 -3.507 1
1 1298 . 8 1 1 A 112 112 MET CB C 112 30.510 32.729 -2.219 1
1 1301 . 8 1 1 A 112 112 MET N N 112 115.180 118.344 -3.164 1
1 1302 . 8 1 1 A 113 113 ASN H H 113 8.070 8.003 0.067 1
1 1303 . 8 1 1 A 113 113 ASN HA H 113 4.570 4.432 0.138 1
1 1308 . 8 1 1 A 113 113 ASN C C 113 175.530 178.518 -2.988 1
1 1309 . 8 1 1 A 113 113 ASN CA C 113 54.420 56.223 -1.803 1
1 1310 . 8 1 1 A 113 113 ASN CB C 113 38.350 37.900 0.450 1
1 1311 . 8 1 1 A 113 113 ASN N N 113 117.190 117.254 -0.064 1
1 1313 . 8 1 1 A 114 114 ARG H H 114 8.070 7.811 0.259 1
1 1314 . 8 1 1 A 114 114 ARG HA H 114 4.280 4.017 0.263 1
1 1321 . 8 1 1 A 114 114 ARG C C 114 176.620 178.740 -2.120 1
1 1322 . 8 1 1 A 114 114 ARG CA C 114 56.910 59.251 -2.341 1
1 1323 . 8 1 1 A 114 114 ARG CB C 114 30.370 29.986 0.384 1
1 1326 . 8 1 1 A 114 114 ARG N N 114 118.360 120.019 -1.659 1
1 1327 . 8 1 1 A 115 115 LEU H H 115 8.100 7.939 0.161 1
1 1328 . 8 1 1 A 115 115 LEU HA H 115 4.310 4.053 0.257 1
1 1338 . 8 1 1 A 115 115 LEU C C 115 177.440 178.073 -0.633 1
1 1339 . 8 1 1 A 115 115 LEU CA C 115 55.440 58.038 -2.598 1
1 1340 . 8 1 1 A 115 115 LEU CB C 115 42.250 41.578 0.672 1
1 1344 . 8 1 1 A 115 115 LEU N N 115 120.580 121.502 -0.922 1
1 1345 . 8 1 1 A 116 116 GLN H H 116 8.180 7.498 0.682 1
1 1346 . 8 1 1 A 116 116 GLN HA H 116 4.360 3.981 0.379 1
1 1353 . 8 1 1 A 116 116 GLN C C 116 175.890 176.341 -0.451 1
1 1354 . 8 1 1 A 116 116 GLN CA C 116 55.810 58.929 -3.119 1
1 1355 . 8 1 1 A 116 116 GLN CB C 116 29.500 28.438 1.062 1
1 1357 . 8 1 1 A 116 116 GLN N N 116 119.770 117.796 1.974 1
1 1358 . 8 1 1 A 117 117 GLN H H 117 8.350 8.235 0.115 1
1 1359 . 8 1 1 A 117 117 GLN HA H 117 4.380 4.368 0.012 1
1 1366 . 8 1 1 A 117 117 GLN C C 117 176.130 176.510 -0.380 1
1 1367 . 8 1 1 A 117 117 GLN CA C 117 55.810 55.541 0.269 1
1 1368 . 8 1 1 A 117 117 GLN CB C 117 29.500 30.024 -0.524 1
1 1370 . 8 1 1 A 117 117 GLN N N 117 121.440 119.329 2.111 1
1 1371 . 8 1 1 A 118 118 VAL H H 118 8.240 8.838 -0.598 1
1 1372 . 8 1 1 A 118 118 VAL HA H 118 4.120 3.678 0.442 1
1 1380 . 8 1 1 A 118 118 VAL C C 118 176.650 176.269 0.381 1
1 1381 . 8 1 1 A 118 118 VAL CA C 118 62.720 64.001 -1.281 1
1 1382 . 8 1 1 A 118 118 VAL CB C 118 32.730 32.225 0.505 1
1 1385 . 8 1 1 A 118 118 VAL N N 118 121.250 126.016 -4.766 1
1 1386 . 8 1 1 A 119 119 GLY H H 119 8.460 7.813 0.647 1
1 1387 . 8 1 1 A 119 119 GLY HA2 H 119 3.990 3.921 0.069 1
1 1388 . 8 1 1 A 119 119 GLY HA3 H 119 3.990 3.976 0.014 1
1 1389 . 8 1 1 A 119 119 GLY C C 119 173.770 175.129 -1.359 1
1 1390 . 8 1 1 A 119 119 GLY CA C 119 45.260 45.703 -0.443 1
1 1391 . 8 1 1 A 119 119 GLY N N 119 112.300 109.694 2.606 1
1 1392 . 8 1 1 A 120 120 ASP H H 120 8.230 8.403 -0.173 1
1 1393 . 8 1 1 A 120 120 ASP HA H 120 4.580 4.373 0.207 1
1 1396 . 8 1 1 A 120 120 ASP C C 120 175.180 177.052 -1.872 1
1 1397 . 8 1 1 A 120 120 ASP CA C 120 54.340 56.547 -2.207 1
1 1398 . 8 1 1 A 120 120 ASP CB C 120 41.390 40.980 0.410 1
1 1399 . 8 1 1 A 120 120 ASP N N 120 120.420 119.272 1.148 1
1 1400 . 8 1 1 A 121 121 LYS H H 121 7.950 7.637 0.313 1
1 1401 . 8 1 1 A 121 121 LYS HA H 121 4.240 4.510 -0.270 1
1 1402 . 8 1 1 A 121 121 LYS CA C 121 53.620 54.063 -0.443 1
1 1403 . 8 1 1 A 121 121 LYS N N 121 119.110 117.502 1.608 1
1 1404 . 8 1 1 A 122 122 PRO HA H 122 4.410 4.391 0.019 1
1 1405 . 8 1 1 A 122 122 PRO C C 122 176.560 176.859 -0.299 1
1 1406 . 8 1 1 A 122 122 PRO CA C 122 63.130 63.303 -0.173 1
1 2 . 9 1 1 A 2 2 SER H H 2 7.890 8.075 -0.185 1
1 3 . 9 1 1 A 2 2 SER HA H 2 4.270 4.083 0.187 1
1 4 . 9 1 1 A 2 2 SER C C 2 173.960 177.296 -3.336 1
1 5 . 9 1 1 A 2 2 SER CA C 2 60.800 61.452 -0.652 1
1 6 . 9 1 1 A 2 2 SER N N 2 111.940 114.133 -2.193 1
1 7 . 9 1 1 A 3 3 GLU H H 3 8.010 8.180 -0.170 1
1 8 . 9 1 1 A 3 3 GLU HA H 3 4.360 4.069 0.291 1
1 9 . 9 1 1 A 3 3 GLU C C 3 175.710 176.190 -0.480 1
1 10 . 9 1 1 A 3 3 GLU CA C 3 56.310 59.156 -2.846 1
1 11 . 9 1 1 A 3 3 GLU N N 3 121.280 121.900 -0.620 1
1 12 . 9 1 1 A 4 4 ALA H H 4 8.540 7.622 0.918 1
1 13 . 9 1 1 A 4 4 ALA HA H 4 4.560 4.663 -0.103 1
1 14 . 9 1 1 A 4 4 ALA CA C 4 50.630 48.899 1.731 1
1 15 . 9 1 1 A 4 4 ALA N N 4 127.840 120.162 7.678 1
1 16 . 9 1 1 A 5 5 PRO HA H 5 4.420 4.720 -0.300 1
1 17 . 9 1 1 A 5 5 PRO C C 5 174.240 176.151 -1.911 1
1 18 . 9 1 1 A 5 5 PRO CA C 5 62.840 62.718 0.122 1
1 19 . 9 1 1 A 6 6 LYS H H 6 8.320 8.722 -0.402 1
1 20 . 9 1 1 A 6 6 LYS HA H 6 4.290 4.688 -0.398 1
1 21 . 9 1 1 A 6 6 LYS C C 6 176.100 175.923 0.177 1
1 22 . 9 1 1 A 6 6 LYS CA C 6 55.540 54.450 1.090 1
1 23 . 9 1 1 A 6 6 LYS N N 6 121.910 121.553 0.357 1
1 24 . 9 1 1 A 7 7 LYS H H 7 8.450 8.636 -0.186 1
1 25 . 9 1 1 A 7 7 LYS HA H 7 3.940 4.117 -0.177 1
1 26 . 9 1 1 A 7 7 LYS C C 7 175.700 174.976 0.724 1
1 27 . 9 1 1 A 7 7 LYS CA C 7 56.440 57.130 -0.690 1
1 28 . 9 1 1 A 7 7 LYS N N 7 122.250 117.611 4.639 1
1 29 . 9 1 1 A 8 8 ARG H H 8 8.210 7.547 0.663 1
1 30 . 9 1 1 A 8 8 ARG HA H 8 4.670 4.802 -0.132 1
1 31 . 9 1 1 A 8 8 ARG C C 8 173.760 175.022 -1.262 1
1 32 . 9 1 1 A 8 8 ARG CA C 8 53.420 54.345 -0.925 1
1 33 . 9 1 1 A 8 8 ARG N N 8 122.560 116.770 5.790 1
1 34 . 9 1 1 A 9 9 TRP H H 9 8.610 8.720 -0.110 1
1 35 . 9 1 1 A 9 9 TRP HA H 9 4.910 5.444 -0.534 1
1 44 . 9 1 1 A 9 9 TRP C C 9 174.610 175.410 -0.800 1
1 45 . 9 1 1 A 9 9 TRP CA C 9 57.630 55.249 2.381 1
1 46 . 9 1 1 A 9 9 TRP CB C 9 31.020 31.254 -0.234 1
1 52 . 9 1 1 A 9 9 TRP N N 9 120.540 121.482 -0.942 1
1 54 . 9 1 1 A 10 10 TYR H H 10 9.260 8.918 0.342 1
1 55 . 9 1 1 A 10 10 TYR HA H 10 4.820 5.215 -0.395 1
1 62 . 9 1 1 A 10 10 TYR C C 10 174.340 175.138 -0.798 1
1 63 . 9 1 1 A 10 10 TYR CA C 10 57.050 56.651 0.399 1
1 64 . 9 1 1 A 10 10 TYR CB C 10 41.920 43.000 -1.080 1
1 69 . 9 1 1 A 10 10 TYR N N 10 118.990 122.001 -3.011 1
1 70 . 9 1 1 A 11 11 VAL H H 11 9.450 8.905 0.545 1
1 71 . 9 1 1 A 11 11 VAL HA H 11 4.470 4.693 -0.223 1
1 79 . 9 1 1 A 11 11 VAL C C 11 175.030 175.593 -0.563 1
1 80 . 9 1 1 A 11 11 VAL CA C 11 62.320 61.671 0.649 1
1 81 . 9 1 1 A 11 11 VAL CB C 11 32.400 33.303 -0.903 1
1 84 . 9 1 1 A 11 11 VAL N N 11 120.930 121.635 -0.705 1
1 85 . 9 1 1 A 12 12 VAL H H 12 9.320 9.280 0.040 1
1 86 . 9 1 1 A 12 12 VAL HA H 12 3.940 4.500 -0.560 1
1 94 . 9 1 1 A 12 12 VAL C C 12 173.870 173.774 0.096 1
1 95 . 9 1 1 A 12 12 VAL CA C 12 61.330 60.957 0.373 1
1 96 . 9 1 1 A 12 12 VAL CB C 12 33.500 34.870 -1.370 1
1 99 . 9 1 1 A 12 12 VAL N N 12 128.860 127.078 1.782 1
1 100 . 9 1 1 A 13 13 GLN H H 13 8.830 9.043 -0.213 1
1 101 . 9 1 1 A 13 13 GLN HA H 13 4.710 4.856 -0.146 1
1 108 . 9 1 1 A 13 13 GLN C C 13 174.230 175.020 -0.790 1
1 109 . 9 1 1 A 13 13 GLN CA C 13 54.800 55.003 -0.203 1
1 110 . 9 1 1 A 13 13 GLN CB C 13 29.450 29.708 -0.258 1
1 111 . 9 1 1 A 13 13 GLN N N 13 126.050 128.012 -1.962 1
1 113 . 9 1 1 A 14 14 ALA H H 14 9.420 8.220 1.200 1
1 114 . 9 1 1 A 14 14 ALA HA H 14 5.150 4.819 0.331 1
1 118 . 9 1 1 A 14 14 ALA C C 14 176.400 176.113 0.287 1
1 119 . 9 1 1 A 14 14 ALA CA C 14 49.660 50.852 -1.192 1
1 120 . 9 1 1 A 14 14 ALA CB C 14 22.840 23.239 -0.399 1
1 121 . 9 1 1 A 14 14 ALA N N 14 131.620 127.494 4.126 1
1 122 . 9 1 1 A 15 15 PHE H H 15 8.070 8.720 -0.650 1
1 123 . 9 1 1 A 15 15 PHE HA H 15 4.410 4.691 -0.281 1
1 128 . 9 1 1 A 15 15 PHE C C 15 176.130 175.883 0.247 1
1 129 . 9 1 1 A 15 15 PHE CA C 15 58.550 58.873 -0.323 1
1 130 . 9 1 1 A 15 15 PHE CB C 15 39.780 39.515 0.265 1
1 133 . 9 1 1 A 15 15 PHE N N 15 119.680 119.403 0.277 1
1 134 . 9 1 1 A 16 16 SER H H 16 8.370 8.922 -0.552 1
1 135 . 9 1 1 A 16 16 SER HA H 16 4.140 4.104 0.036 1
1 138 . 9 1 1 A 16 16 SER C C 16 175.820 175.632 0.188 1
1 139 . 9 1 1 A 16 16 SER CA C 16 60.570 60.514 0.056 1
1 140 . 9 1 1 A 16 16 SER CB C 16 63.030 63.082 -0.052 1
1 141 . 9 1 1 A 16 16 SER N N 16 119.700 119.974 -0.274 1
1 142 . 9 1 1 A 17 17 GLY H H 17 9.130 8.773 0.357 1
1 143 . 9 1 1 A 17 17 GLY HA2 H 17 3.640 3.703 -0.063 1
1 144 . 9 1 1 A 17 17 GLY HA3 H 17 4.200 3.809 0.391 1
1 145 . 9 1 1 A 17 17 GLY C C 17 175.520 174.820 0.700 1
1 146 . 9 1 1 A 17 17 GLY CA C 17 45.260 45.372 -0.112 1
1 147 . 9 1 1 A 17 17 GLY N N 17 115.850 113.173 2.677 1
1 148 . 9 1 1 A 18 18 PHE H H 18 8.480 7.805 0.675 1
1 149 . 9 1 1 A 18 18 PHE HA H 18 4.740 4.567 0.173 1
1 154 . 9 1 1 A 18 18 PHE C C 18 175.430 176.448 -1.018 1
1 155 . 9 1 1 A 18 18 PHE CA C 18 58.240 58.283 -0.043 1
1 156 . 9 1 1 A 18 18 PHE CB C 18 39.010 38.720 0.290 1
1 159 . 9 1 1 A 18 18 PHE N N 18 118.550 119.920 -1.370 1
1 160 . 9 1 1 A 19 19 GLU H H 19 10.690 8.298 2.392 1
1 161 . 9 1 1 A 19 19 GLU HA H 19 3.490 4.069 -0.579 1
1 166 . 9 1 1 A 19 19 GLU C C 19 177.650 179.127 -1.477 1
1 167 . 9 1 1 A 19 19 GLU CA C 19 62.280 59.775 2.505 1
1 168 . 9 1 1 A 19 19 GLU CB C 19 28.380 29.406 -1.026 1
1 170 . 9 1 1 A 19 19 GLU N N 19 123.470 122.970 0.500 1
1 171 . 9 1 1 A 20 20 GLY H H 20 8.740 8.177 0.563 1
1 172 . 9 1 1 A 20 20 GLY HA2 H 20 3.840 3.758 0.082 1
1 173 . 9 1 1 A 20 20 GLY HA3 H 20 3.940 3.773 0.167 1
1 174 . 9 1 1 A 20 20 GLY C C 20 176.860 175.610 1.250 1
1 175 . 9 1 1 A 20 20 GLY CA C 20 47.140 47.005 0.135 1
1 176 . 9 1 1 A 20 20 GLY N N 20 105.480 107.840 -2.360 1
1 177 . 9 1 1 A 21 21 ARG H H 21 7.690 8.273 -0.583 1
1 178 . 9 1 1 A 21 21 ARG HA H 21 4.180 4.120 0.060 1
1 185 . 9 1 1 A 21 21 ARG C C 21 179.490 178.615 0.875 1
1 186 . 9 1 1 A 21 21 ARG CA C 21 58.660 59.149 -0.489 1
1 187 . 9 1 1 A 21 21 ARG CB C 21 30.100 29.868 0.232 1
1 190 . 9 1 1 A 21 21 ARG N N 21 123.120 122.184 0.936 1
1 191 . 9 1 1 A 22 22 VAL H H 22 8.980 9.220 -0.240 1
1 192 . 9 1 1 A 22 22 VAL HA H 22 3.560 3.638 -0.078 1
1 200 . 9 1 1 A 22 22 VAL C C 22 177.320 178.183 -0.863 1
1 201 . 9 1 1 A 22 22 VAL CA C 22 66.960 66.629 0.331 1
1 202 . 9 1 1 A 22 22 VAL CB C 22 31.050 31.715 -0.665 1
1 205 . 9 1 1 A 22 22 VAL N N 22 122.760 120.217 2.543 1
1 206 . 9 1 1 A 23 23 ALA H H 23 8.280 7.878 0.402 1
1 207 . 9 1 1 A 23 23 ALA HA H 23 3.850 4.009 -0.159 1
1 211 . 9 1 1 A 23 23 ALA C C 23 179.340 179.765 -0.425 1
1 212 . 9 1 1 A 23 23 ALA CA C 23 56.260 55.282 0.978 1
1 213 . 9 1 1 A 23 23 ALA CB C 23 18.260 18.290 -0.030 1
1 214 . 9 1 1 A 23 23 ALA N N 23 122.120 121.468 0.652 1
1 215 . 9 1 1 A 24 24 THR H H 24 8.020 7.756 0.264 1
1 216 . 9 1 1 A 24 24 THR HA H 24 3.920 3.882 0.038 1
1 221 . 9 1 1 A 24 24 THR C C 24 176.940 176.732 0.208 1
1 222 . 9 1 1 A 24 24 THR CA C 24 66.820 66.800 0.020 1
1 223 . 9 1 1 A 24 24 THR CB C 24 68.930 68.431 0.499 1
1 225 . 9 1 1 A 24 24 THR N N 24 113.410 115.292 -1.882 1
1 226 . 9 1 1 A 25 25 SER H H 25 8.570 8.374 0.196 1
1 227 . 9 1 1 A 25 25 SER HA H 25 4.400 4.078 0.322 1
1 230 . 9 1 1 A 25 25 SER C C 25 177.610 176.257 1.353 1
1 231 . 9 1 1 A 25 25 SER CA C 25 61.920 62.044 -0.124 1
1 232 . 9 1 1 A 25 25 SER CB C 25 63.540 62.882 0.658 1
1 233 . 9 1 1 A 25 25 SER N N 25 118.260 117.611 0.649 1
1 234 . 9 1 1 A 26 26 LEU H H 26 9.430 8.079 1.351 1
1 235 . 9 1 1 A 26 26 LEU HA H 26 3.900 4.071 -0.171 1
1 245 . 9 1 1 A 26 26 LEU C C 26 177.710 178.617 -0.907 1
1 246 . 9 1 1 A 26 26 LEU CA C 26 58.910 58.652 0.258 1
1 247 . 9 1 1 A 26 26 LEU CB C 26 41.300 41.447 -0.147 1
1 251 . 9 1 1 A 26 26 LEU N N 26 124.120 122.461 1.659 1
1 252 . 9 1 1 A 27 27 ARG H H 27 7.790 7.891 -0.101 1
1 253 . 9 1 1 A 27 27 ARG HA H 27 3.880 3.669 0.211 1
1 260 . 9 1 1 A 27 27 ARG C C 27 179.380 178.421 0.959 1
1 261 . 9 1 1 A 27 27 ARG CA C 27 60.510 59.068 1.442 1
1 262 . 9 1 1 A 27 27 ARG CB C 27 29.670 29.914 -0.244 1
1 265 . 9 1 1 A 27 27 ARG N N 27 116.710 119.068 -2.358 1
1 266 . 9 1 1 A 28 28 GLU H H 28 7.900 8.229 -0.329 1
1 267 . 9 1 1 A 28 28 GLU HA H 28 4.070 3.977 0.093 1
1 272 . 9 1 1 A 28 28 GLU C C 28 179.450 178.922 0.528 1
1 273 . 9 1 1 A 28 28 GLU CA C 28 59.450 59.488 -0.038 1
1 274 . 9 1 1 A 28 28 GLU CB C 28 29.610 29.249 0.361 1
1 276 . 9 1 1 A 28 28 GLU N N 28 118.340 119.194 -0.854 1
1 277 . 9 1 1 A 29 29 HIS H H 29 8.940 7.497 1.443 1
1 278 . 9 1 1 A 29 29 HIS HA H 29 4.160 4.466 -0.306 1
1 283 . 9 1 1 A 29 29 HIS C C 29 177.750 177.855 -0.105 1
1 284 . 9 1 1 A 29 29 HIS CA C 29 61.260 60.105 1.155 1
1 285 . 9 1 1 A 29 29 HIS CB C 29 29.870 31.035 -1.165 1
1 287 . 9 1 1 A 29 29 HIS N N 29 120.440 117.936 2.504 1
1 288 . 9 1 1 A 30 30 ILE H H 30 8.580 8.485 0.095 1
1 289 . 9 1 1 A 30 30 ILE HA H 30 3.160 3.760 -0.600 1
1 299 . 9 1 1 A 30 30 ILE C C 30 177.230 178.238 -1.008 1
1 300 . 9 1 1 A 30 30 ILE CA C 30 66.460 65.397 1.063 1
1 301 . 9 1 1 A 30 30 ILE CB C 30 38.630 37.759 0.871 1
1 305 . 9 1 1 A 30 30 ILE N N 30 121.010 120.313 0.697 1
1 306 . 9 1 1 A 31 31 LYS H H 31 7.020 7.996 -0.976 1
1 307 . 9 1 1 A 31 31 LYS HA H 31 4.170 4.025 0.145 1
1 316 . 9 1 1 A 31 31 LYS C C 31 180.570 178.701 1.869 1
1 317 . 9 1 1 A 31 31 LYS CA C 31 58.920 59.854 -0.934 1
1 318 . 9 1 1 A 31 31 LYS CB C 31 32.490 31.919 0.571 1
1 322 . 9 1 1 A 31 31 LYS N N 31 117.400 121.122 -3.722 1
1 323 . 9 1 1 A 32 32 LEU H H 32 8.400 7.721 0.679 1
1 324 . 9 1 1 A 32 32 LEU HA H 32 3.990 3.933 0.057 1
1 334 . 9 1 1 A 32 32 LEU C C 32 178.230 178.375 -0.145 1
1 335 . 9 1 1 A 32 32 LEU CA C 32 57.700 57.774 -0.074 1
1 336 . 9 1 1 A 32 32 LEU CB C 32 42.540 41.695 0.845 1
1 340 . 9 1 1 A 32 32 LEU N N 32 121.180 119.663 1.517 1
1 341 . 9 1 1 A 33 33 HIS H H 33 7.620 8.289 -0.669 1
1 342 . 9 1 1 A 33 33 HIS HA H 33 4.600 4.653 -0.053 1
1 347 . 9 1 1 A 33 33 HIS C C 33 177.090 173.969 3.121 1
1 348 . 9 1 1 A 33 33 HIS CA C 33 55.840 55.450 0.390 1
1 349 . 9 1 1 A 33 33 HIS CB C 33 29.330 29.947 -0.617 1
1 351 . 9 1 1 A 33 33 HIS N N 33 112.220 115.792 -3.572 1
1 352 . 9 1 1 A 34 34 ASN H H 34 8.030 7.913 0.117 1
1 353 . 9 1 1 A 34 34 ASN HA H 34 4.890 4.357 0.533 1
1 358 . 9 1 1 A 34 34 ASN C C 34 175.910 175.520 0.390 1
1 359 . 9 1 1 A 34 34 ASN CA C 34 54.530 54.499 0.031 1
1 360 . 9 1 1 A 34 34 ASN CB C 34 37.380 36.504 0.876 1
1 361 . 9 1 1 A 34 34 ASN N N 34 117.600 114.380 3.220 1
1 363 . 9 1 1 A 35 35 MET H H 35 8.330 9.243 -0.913 1
1 364 . 9 1 1 A 35 35 MET HA H 35 4.940 4.825 0.115 1
1 372 . 9 1 1 A 35 35 MET C C 35 176.880 176.761 0.119 1
1 373 . 9 1 1 A 35 35 MET CA C 35 55.600 54.449 1.151 1
1 374 . 9 1 1 A 35 35 MET CB C 35 33.790 33.028 0.762 1
1 377 . 9 1 1 A 35 35 MET N N 35 116.190 116.165 0.025 1
1 378 . 9 1 1 A 36 36 GLU H H 36 9.730 8.219 1.511 1
1 379 . 9 1 1 A 36 36 GLU HA H 36 3.850 4.158 -0.308 1
1 384 . 9 1 1 A 36 36 GLU C C 36 178.290 179.326 -1.036 1
1 385 . 9 1 1 A 36 36 GLU CA C 36 61.280 59.651 1.629 1
1 386 . 9 1 1 A 36 36 GLU CB C 36 29.270 29.116 0.154 1
1 388 . 9 1 1 A 36 36 GLU N N 36 121.630 120.587 1.043 1
1 389 . 9 1 1 A 37 37 ASP H H 37 8.850 8.126 0.724 1
1 390 . 9 1 1 A 37 37 ASP HA H 37 4.470 4.483 -0.013 1
1 393 . 9 1 1 A 37 37 ASP C C 37 177.190 178.978 -1.788 1
1 394 . 9 1 1 A 37 37 ASP CA C 37 56.140 57.248 -1.108 1
1 395 . 9 1 1 A 37 37 ASP CB C 37 40.050 40.801 -0.751 1
1 396 . 9 1 1 A 37 37 ASP N N 37 114.390 119.825 -5.435 1
1 397 . 9 1 1 A 38 38 LEU H H 38 7.880 7.622 0.258 1
1 398 . 9 1 1 A 38 38 LEU HA H 38 4.290 3.993 0.297 1
1 408 . 9 1 1 A 38 38 LEU C C 38 175.090 177.566 -2.476 1
1 409 . 9 1 1 A 38 38 LEU CA C 38 54.670 57.892 -3.222 1
1 410 . 9 1 1 A 38 38 LEU CB C 38 42.940 41.836 1.104 1
1 414 . 9 1 1 A 38 38 LEU N N 38 116.550 119.045 -2.495 1
1 415 . 9 1 1 A 39 39 PHE H H 39 7.500 7.823 -0.323 1
1 416 . 9 1 1 A 39 39 PHE HA H 39 4.970 4.745 0.225 1
1 424 . 9 1 1 A 39 39 PHE C C 39 175.380 175.596 -0.216 1
1 425 . 9 1 1 A 39 39 PHE CA C 39 57.580 57.992 -0.412 1
1 426 . 9 1 1 A 39 39 PHE CB C 39 44.990 39.527 5.463 1
1 432 . 9 1 1 A 39 39 PHE N N 39 115.370 116.867 -1.497 1
1 433 . 9 1 1 A 40 40 GLY H H 40 8.680 8.304 0.376 1
1 434 . 9 1 1 A 40 40 GLY HA2 H 40 3.370 3.985 -0.615 1
1 435 . 9 1 1 A 40 40 GLY HA3 H 40 4.550 4.056 0.494 1
1 436 . 9 1 1 A 40 40 GLY C C 40 173.090 173.840 -0.750 1
1 437 . 9 1 1 A 40 40 GLY CA C 40 44.180 46.383 -2.203 1
1 438 . 9 1 1 A 40 40 GLY N N 40 110.930 111.760 -0.830 1
1 439 . 9 1 1 A 41 41 GLU H H 41 8.320 7.768 0.552 1
1 440 . 9 1 1 A 41 41 GLU HA H 41 4.280 4.959 -0.679 1
1 445 . 9 1 1 A 41 41 GLU C C 41 173.900 174.516 -0.616 1
1 446 . 9 1 1 A 41 41 GLU CA C 41 56.900 54.872 2.028 1
1 447 . 9 1 1 A 41 41 GLU CB C 41 32.110 33.402 -1.292 1
1 449 . 9 1 1 A 41 41 GLU N N 41 126.730 120.123 6.607 1
1 450 . 9 1 1 A 42 42 VAL H H 42 8.100 8.641 -0.541 1
1 451 . 9 1 1 A 42 42 VAL HA H 42 5.160 5.099 0.061 1
1 459 . 9 1 1 A 42 42 VAL C C 42 176.340 175.072 1.268 1
1 460 . 9 1 1 A 42 42 VAL CA C 42 61.200 60.570 0.630 1
1 461 . 9 1 1 A 42 42 VAL CB C 42 34.770 35.247 -0.477 1
1 464 . 9 1 1 A 42 42 VAL N N 42 119.360 124.509 -5.149 1
1 465 . 9 1 1 A 43 43 MET H H 43 9.870 9.530 0.340 1
1 466 . 9 1 1 A 43 43 MET HA H 43 5.070 5.593 -0.523 1
1 474 . 9 1 1 A 43 43 MET C C 43 173.890 175.197 -1.307 1
1 475 . 9 1 1 A 43 43 MET CA C 43 54.740 53.960 0.780 1
1 476 . 9 1 1 A 43 43 MET CB C 43 37.500 36.870 0.630 1
1 479 . 9 1 1 A 43 43 MET N N 43 125.720 124.349 1.371 1
1 480 . 9 1 1 A 44 44 VAL H H 44 8.800 8.700 0.100 1
1 481 . 9 1 1 A 44 44 VAL HA H 44 4.720 4.700 0.020 1
1 489 . 9 1 1 A 44 44 VAL CA C 44 59.090 59.119 -0.029 1
1 490 . 9 1 1 A 44 44 VAL CB C 44 33.710 35.808 -2.098 1
1 493 . 9 1 1 A 44 44 VAL N N 44 122.340 121.156 1.184 1
1 494 . 9 1 1 A 45 45 PRO HA H 45 4.480 4.506 -0.026 1
1 501 . 9 1 1 A 45 45 PRO C C 45 177.080 175.098 1.982 1
1 502 . 9 1 1 A 45 45 PRO CA C 45 63.240 63.868 -0.628 1
1 503 . 9 1 1 A 45 45 PRO CB C 45 32.170 31.197 0.973 1
1 506 . 9 1 1 A 46 46 THR H H 46 8.200 7.237 0.963 1
1 507 . 9 1 1 A 46 46 THR HA H 46 4.290 4.864 -0.574 1
1 512 . 9 1 1 A 46 46 THR C C 46 174.600 173.593 1.007 1
1 513 . 9 1 1 A 46 46 THR CA C 46 62.100 59.334 2.766 1
1 514 . 9 1 1 A 46 46 THR CB C 46 69.990 72.246 -2.256 1
1 516 . 9 1 1 A 46 46 THR N N 46 113.410 107.859 5.551 1
1 517 . 9 1 1 A 47 47 GLU H H 47 8.380 8.556 -0.176 1
1 518 . 9 1 1 A 47 47 GLU HA H 47 4.400 4.262 0.138 1
1 521 . 9 1 1 A 47 47 GLU C C 47 175.970 177.664 -1.694 1
1 522 . 9 1 1 A 47 47 GLU CA C 47 55.200 57.274 -2.074 1
1 523 . 9 1 1 A 47 47 GLU CB C 47 32.300 30.054 2.246 1
1 524 . 9 1 1 A 47 47 GLU N N 47 122.830 121.963 0.867 1
1 525 . 9 1 1 A 48 48 GLU H H 48 8.400 8.815 -0.415 1
1 526 . 9 1 1 A 48 48 GLU HA H 48 4.280 4.138 0.142 1
1 531 . 9 1 1 A 48 48 GLU C C 48 175.750 175.630 0.120 1
1 532 . 9 1 1 A 48 48 GLU CA C 48 55.190 58.998 -3.808 1
1 533 . 9 1 1 A 48 48 GLU CB C 48 31.980 30.050 1.930 1
1 535 . 9 1 1 A 48 48 GLU N N 48 121.950 123.840 -1.890 1
1 536 . 9 1 1 A 49 49 VAL H H 49 8.240 7.686 0.554 1
1 537 . 9 1 1 A 49 49 VAL HA H 49 4.170 4.797 -0.627 1
1 542 . 9 1 1 A 49 49 VAL C C 49 174.610 173.126 1.484 1
1 543 . 9 1 1 A 49 49 VAL CA C 49 62.280 60.053 2.227 1
1 544 . 9 1 1 A 49 49 VAL CB C 49 32.930 35.648 -2.718 1
1 546 . 9 1 1 A 49 49 VAL N N 49 123.990 117.639 6.351 1
1 547 . 9 1 1 A 50 50 VAL H H 50 8.230 8.906 -0.676 1
1 548 . 9 1 1 A 50 50 VAL HA H 50 4.220 4.916 -0.696 1
1 553 . 9 1 1 A 50 50 VAL C C 50 175.770 173.942 1.828 1
1 554 . 9 1 1 A 50 50 VAL CA C 50 62.170 60.762 1.408 1
1 555 . 9 1 1 A 50 50 VAL CB C 50 33.110 34.536 -1.426 1
1 557 . 9 1 1 A 50 50 VAL N N 50 123.960 128.017 -4.057 1
1 558 . 9 1 1 A 51 51 GLU H H 51 8.570 8.813 -0.243 1
1 559 . 9 1 1 A 51 51 GLU HA H 51 4.380 4.876 -0.496 1
1 564 . 9 1 1 A 51 51 GLU C C 51 175.920 176.465 -0.545 1
1 565 . 9 1 1 A 51 51 GLU CA C 51 56.050 54.806 1.244 1
1 566 . 9 1 1 A 51 51 GLU CB C 51 31.080 32.441 -1.361 1
1 568 . 9 1 1 A 51 51 GLU N N 51 125.070 126.447 -1.377 1
1 569 . 9 1 1 A 52 52 ILE H H 52 8.320 8.731 -0.411 1
1 570 . 9 1 1 A 52 52 ILE HA H 52 4.290 3.726 0.564 1
1 580 . 9 1 1 A 52 52 ILE C C 52 176.330 177.493 -1.163 1
1 581 . 9 1 1 A 52 52 ILE CA C 52 60.940 64.654 -3.714 1
1 582 . 9 1 1 A 52 52 ILE CB C 52 38.510 37.359 1.151 1
1 586 . 9 1 1 A 52 52 ILE N N 52 122.760 126.884 -4.124 1
1 587 . 9 1 1 A 53 53 ARG H H 53 8.500 8.276 0.224 1
1 588 . 9 1 1 A 53 53 ARG HA H 53 4.430 4.061 0.369 1
1 595 . 9 1 1 A 53 53 ARG C C 53 176.950 179.802 -2.852 1
1 596 . 9 1 1 A 53 53 ARG CA C 53 56.150 59.109 -2.959 1
1 597 . 9 1 1 A 53 53 ARG CB C 53 30.200 29.999 0.201 1
1 600 . 9 1 1 A 53 53 ARG N N 53 125.250 119.759 5.491 1
1 601 . 9 1 1 A 54 54 GLY H H 54 8.760 7.794 0.966 1
1 602 . 9 1 1 A 54 54 GLY HA2 H 54 3.920 3.950 -0.030 1
1 603 . 9 1 1 A 54 54 GLY HA3 H 54 4.010 3.951 0.059 1
1 604 . 9 1 1 A 54 54 GLY C C 54 175.110 174.950 0.160 1
1 605 . 9 1 1 A 54 54 GLY CA C 54 46.030 47.376 -1.346 1
1 606 . 9 1 1 A 54 54 GLY N N 54 112.510 108.062 4.448 1
1 607 . 9 1 1 A 55 55 GLY H H 55 8.350 7.585 0.765 1
1 608 . 9 1 1 A 55 55 GLY HA2 H 55 3.980 4.084 -0.104 1
1 609 . 9 1 1 A 55 55 GLY HA3 H 55 3.980 4.085 -0.105 1
1 610 . 9 1 1 A 55 55 GLY C C 55 173.920 174.368 -0.448 1
1 611 . 9 1 1 A 55 55 GLY CA C 55 45.200 45.546 -0.346 1
1 612 . 9 1 1 A 55 55 GLY N N 55 107.940 105.773 2.167 1
1 613 . 9 1 1 A 56 56 GLN H H 56 8.100 8.701 -0.601 1
1 614 . 9 1 1 A 56 56 GLN HA H 56 4.420 4.061 0.359 1
1 619 . 9 1 1 A 56 56 GLN C C 56 175.570 176.954 -1.384 1
1 620 . 9 1 1 A 56 56 GLN CA C 56 55.420 58.431 -3.011 1
1 621 . 9 1 1 A 56 56 GLN CB C 56 30.100 28.799 1.301 1
1 623 . 9 1 1 A 56 56 GLN N N 56 119.350 122.569 -3.219 1
1 624 . 9 1 1 A 57 57 ARG H H 57 8.520 7.778 0.742 1
1 625 . 9 1 1 A 57 57 ARG HA H 57 4.400 4.373 0.027 1
1 632 . 9 1 1 A 57 57 ARG C C 57 176.210 175.201 1.009 1
1 633 . 9 1 1 A 57 57 ARG CA C 57 56.440 56.487 -0.047 1
1 634 . 9 1 1 A 57 57 ARG CB C 57 30.930 30.842 0.088 1
1 637 . 9 1 1 A 57 57 ARG N N 57 122.610 118.095 4.515 1
1 638 . 9 1 1 A 58 58 ARG H H 58 8.630 8.639 -0.009 1
1 639 . 9 1 1 A 58 58 ARG HA H 58 4.430 4.918 -0.488 1
1 646 . 9 1 1 A 58 58 ARG C C 58 175.950 175.137 0.813 1
1 647 . 9 1 1 A 58 58 ARG CA C 58 55.450 54.861 0.589 1
1 648 . 9 1 1 A 58 58 ARG CB C 58 31.300 31.911 -0.611 1
1 651 . 9 1 1 A 58 58 ARG N N 58 123.320 123.171 0.149 1
1 652 . 9 1 1 A 59 59 LYS H H 59 8.560 8.675 -0.115 1
1 653 . 9 1 1 A 59 59 LYS HA H 59 4.410 4.592 -0.182 1
1 662 . 9 1 1 A 59 59 LYS C C 59 176.590 177.190 -0.600 1
1 663 . 9 1 1 A 59 59 LYS CA C 59 56.720 54.482 2.238 1
1 664 . 9 1 1 A 59 59 LYS CB C 59 33.150 34.554 -1.404 1
1 668 . 9 1 1 A 59 59 LYS N N 59 123.380 125.397 -2.017 1
1 669 . 9 1 1 A 60 60 SER H H 60 8.450 9.105 -0.655 1
1 670 . 9 1 1 A 60 60 SER HA H 60 4.480 4.052 0.428 1
1 673 . 9 1 1 A 60 60 SER C C 60 174.280 174.094 0.186 1
1 674 . 9 1 1 A 60 60 SER CA C 60 58.140 60.597 -2.457 1
1 675 . 9 1 1 A 60 60 SER CB C 60 64.160 63.946 0.214 1
1 676 . 9 1 1 A 60 60 SER N N 60 117.320 118.095 -0.775 1
1 677 . 9 1 1 A 61 61 GLU H H 61 8.550 7.996 0.554 1
1 678 . 9 1 1 A 61 61 GLU HA H 61 4.400 4.194 0.206 1
1 683 . 9 1 1 A 61 61 GLU C C 61 176.150 175.134 1.016 1
1 684 . 9 1 1 A 61 61 GLU CA C 61 56.300 57.432 -1.132 1
1 685 . 9 1 1 A 61 61 GLU CB C 61 30.790 28.705 2.085 1
1 687 . 9 1 1 A 61 61 GLU N N 61 122.810 118.745 4.065 1
1 688 . 9 1 1 A 62 62 ARG H H 62 8.310 9.054 -0.744 1
1 689 . 9 1 1 A 62 62 ARG HA H 62 4.340 5.072 -0.732 1
1 692 . 9 1 1 A 62 62 ARG C C 62 176.140 174.694 1.446 1
1 693 . 9 1 1 A 62 62 ARG CA C 62 56.230 54.246 1.984 1
1 694 . 9 1 1 A 62 62 ARG CB C 62 30.780 33.786 -3.006 1
1 695 . 9 1 1 A 62 62 ARG N N 62 122.080 124.351 -2.271 1
1 696 . 9 1 1 A 63 63 LYS H H 63 8.470 8.511 -0.041 1
1 697 . 9 1 1 A 63 63 LYS HA H 63 4.300 4.752 -0.452 1
1 700 . 9 1 1 A 63 63 LYS C C 63 175.490 176.473 -0.983 1
1 701 . 9 1 1 A 63 63 LYS CA C 63 56.200 54.434 1.766 1
1 702 . 9 1 1 A 63 63 LYS CB C 63 30.730 34.625 -3.895 1
1 703 . 9 1 1 A 63 63 LYS N N 63 123.450 122.073 1.377 1
1 704 . 9 1 1 A 64 64 PHE H H 64 8.200 8.574 -0.374 1
1 705 . 9 1 1 A 64 64 PHE HA H 64 4.450 4.214 0.236 1
1 710 . 9 1 1 A 64 64 PHE C C 64 174.250 176.384 -2.134 1
1 711 . 9 1 1 A 64 64 PHE CA C 64 57.430 60.142 -2.712 1
1 712 . 9 1 1 A 64 64 PHE CB C 64 40.330 38.733 1.597 1
1 715 . 9 1 1 A 64 64 PHE N N 64 121.740 122.492 -0.752 1
1 716 . 9 1 1 A 65 65 PHE H H 65 8.130 7.118 1.012 1
1 717 . 9 1 1 A 65 65 PHE HA H 65 4.440 4.833 -0.393 1
1 725 . 9 1 1 A 65 65 PHE CA C 65 55.650 54.530 1.120 1
1 726 . 9 1 1 A 65 65 PHE CB C 65 38.900 38.848 0.052 1
1 731 . 9 1 1 A 65 65 PHE N N 65 120.910 113.822 7.088 1
1 732 . 9 1 1 A 66 66 PRO C C 66 176.780 177.736 -0.956 1
1 733 . 9 1 1 A 67 67 GLY H H 67 9.970 8.909 1.061 1
1 734 . 9 1 1 A 67 67 GLY HA2 H 67 3.820 4.039 -0.219 1
1 735 . 9 1 1 A 67 67 GLY HA3 H 67 4.400 4.077 0.323 1
1 736 . 9 1 1 A 67 67 GLY C C 67 173.670 173.510 0.160 1
1 737 . 9 1 1 A 67 67 GLY CA C 67 45.900 45.614 0.286 1
1 738 . 9 1 1 A 67 67 GLY N N 67 111.550 111.727 -0.177 1
1 739 . 9 1 1 A 68 68 TYR H H 68 7.650 7.911 -0.261 1
1 740 . 9 1 1 A 68 68 TYR HA H 68 5.000 5.066 -0.066 1
1 747 . 9 1 1 A 68 68 TYR C C 68 175.220 174.979 0.241 1
1 748 . 9 1 1 A 68 68 TYR CA C 68 57.940 56.809 1.131 1
1 753 . 9 1 1 A 68 68 TYR N N 68 118.800 119.078 -0.278 1
1 754 . 9 1 1 A 69 69 VAL H H 69 9.090 8.809 0.281 1
1 755 . 9 1 1 A 69 69 VAL HA H 69 4.330 4.894 -0.564 1
1 763 . 9 1 1 A 69 69 VAL C C 69 174.250 174.878 -0.628 1
1 764 . 9 1 1 A 69 69 VAL CA C 69 62.120 60.364 1.756 1
1 765 . 9 1 1 A 69 69 VAL CB C 69 35.240 35.949 -0.709 1
1 768 . 9 1 1 A 69 69 VAL N N 69 119.300 123.244 -3.944 1
1 769 . 9 1 1 A 70 70 LEU H H 70 9.190 8.934 0.256 1
1 770 . 9 1 1 A 70 70 LEU HA H 70 5.460 5.435 0.025 1
1 780 . 9 1 1 A 70 70 LEU C C 70 176.130 176.232 -0.102 1
1 781 . 9 1 1 A 70 70 LEU CA C 70 54.120 53.381 0.739 1
1 782 . 9 1 1 A 70 70 LEU CB C 70 43.330 43.261 0.069 1
1 786 . 9 1 1 A 70 70 LEU N N 70 126.710 126.859 -0.149 1
1 787 . 9 1 1 A 71 71 VAL H H 71 9.350 9.184 0.166 1
1 788 . 9 1 1 A 71 71 VAL HA H 71 5.040 4.817 0.223 1
1 796 . 9 1 1 A 71 71 VAL C C 71 173.670 174.510 -0.840 1
1 797 . 9 1 1 A 71 71 VAL CA C 71 61.090 61.144 -0.054 1
1 798 . 9 1 1 A 71 71 VAL CB C 71 35.800 35.459 0.341 1
1 801 . 9 1 1 A 71 71 VAL N N 71 121.920 125.150 -3.230 1
1 802 . 9 1 1 A 72 72 GLN H H 72 8.390 8.407 -0.017 1
1 803 . 9 1 1 A 72 72 GLN HA H 72 4.610 4.404 0.206 1
1 810 . 9 1 1 A 72 72 GLN C C 72 175.920 174.498 1.422 1
1 811 . 9 1 1 A 72 72 GLN CA C 72 53.810 55.185 -1.375 1
1 812 . 9 1 1 A 72 72 GLN CB C 72 28.850 28.708 0.142 1
1 814 . 9 1 1 A 72 72 GLN N N 72 130.760 127.515 3.245 1
1 816 . 9 1 1 A 73 73 MET H H 73 9.750 8.695 1.055 1
1 817 . 9 1 1 A 73 73 MET HA H 73 5.060 5.288 -0.228 1
1 825 . 9 1 1 A 73 73 MET C C 73 175.500 174.641 0.859 1
1 826 . 9 1 1 A 73 73 MET CA C 73 55.520 54.672 0.848 1
1 827 . 9 1 1 A 73 73 MET CB C 73 35.350 35.383 -0.033 1
1 830 . 9 1 1 A 73 73 MET N N 73 121.070 123.813 -2.743 1
1 831 . 9 1 1 A 74 74 VAL H H 74 8.530 8.580 -0.050 1
1 832 . 9 1 1 A 74 74 VAL HA H 74 3.970 4.304 -0.334 1
1 840 . 9 1 1 A 74 74 VAL C C 74 174.900 175.992 -1.092 1
1 841 . 9 1 1 A 74 74 VAL CA C 74 62.150 62.195 -0.045 1
1 842 . 9 1 1 A 74 74 VAL CB C 74 32.480 32.323 0.157 1
1 845 . 9 1 1 A 74 74 VAL N N 74 124.120 123.813 0.307 1
1 846 . 9 1 1 A 75 75 MET H H 75 8.600 8.434 0.166 1
1 847 . 9 1 1 A 75 75 MET HA H 75 4.360 4.482 -0.122 1
1 855 . 9 1 1 A 75 75 MET C C 75 173.480 175.935 -2.455 1
1 856 . 9 1 1 A 75 75 MET CA C 75 53.830 54.659 -0.829 1
1 857 . 9 1 1 A 75 75 MET CB C 75 29.960 32.024 -2.064 1
1 860 . 9 1 1 A 75 75 MET N N 75 128.250 126.594 1.656 1
1 861 . 9 1 1 A 76 76 ASN H H 76 8.410 8.467 -0.057 1
1 862 . 9 1 1 A 76 76 ASN HA H 76 4.540 4.959 -0.419 1
1 867 . 9 1 1 A 76 76 ASN C C 76 173.950 174.924 -0.974 1
1 868 . 9 1 1 A 76 76 ASN CA C 76 51.720 51.906 -0.186 1
1 869 . 9 1 1 A 76 76 ASN CB C 76 38.430 40.152 -1.722 1
1 870 . 9 1 1 A 76 76 ASN N N 76 127.500 122.048 5.452 1
1 872 . 9 1 1 A 77 77 ASP H H 77 8.470 8.964 -0.494 1
1 873 . 9 1 1 A 77 77 ASP HA H 77 4.410 4.114 0.296 1
1 876 . 9 1 1 A 77 77 ASP C C 77 178.530 178.424 0.106 1
1 877 . 9 1 1 A 77 77 ASP CA C 77 58.730 57.456 1.274 1
1 878 . 9 1 1 A 77 77 ASP CB C 77 40.940 40.594 0.346 1
1 879 . 9 1 1 A 77 77 ASP N N 77 117.090 120.349 -3.259 1
1 880 . 9 1 1 A 78 78 ALA H H 78 8.160 8.016 0.144 1
1 881 . 9 1 1 A 78 78 ALA HA H 78 4.350 4.159 0.191 1
1 885 . 9 1 1 A 78 78 ALA C C 78 181.250 179.987 1.263 1
1 886 . 9 1 1 A 78 78 ALA CA C 78 55.190 55.317 -0.127 1
1 887 . 9 1 1 A 78 78 ALA CB C 78 18.260 19.171 -0.911 1
1 888 . 9 1 1 A 78 78 ALA N N 78 122.500 123.618 -1.118 1
1 889 . 9 1 1 A 79 79 SER H H 79 9.320 8.389 0.931 1
1 890 . 9 1 1 A 79 79 SER HA H 79 4.290 4.241 0.049 1
1 893 . 9 1 1 A 79 79 SER C C 79 176.570 176.437 0.133 1
1 894 . 9 1 1 A 79 79 SER CA C 79 61.080 62.394 -1.314 1
1 895 . 9 1 1 A 79 79 SER CB C 79 62.200 62.519 -0.319 1
1 896 . 9 1 1 A 79 79 SER N N 79 119.280 114.082 5.198 1
1 897 . 9 1 1 A 80 80 TRP H H 80 8.900 7.931 0.969 1
1 898 . 9 1 1 A 80 80 TRP HA H 80 4.020 4.442 -0.422 1
1 907 . 9 1 1 A 80 80 TRP C C 80 178.210 178.518 -0.308 1
1 908 . 9 1 1 A 80 80 TRP CA C 80 62.490 61.406 1.084 1
1 909 . 9 1 1 A 80 80 TRP CB C 80 29.800 29.758 0.042 1
1 915 . 9 1 1 A 80 80 TRP N N 80 125.870 123.713 2.157 1
1 917 . 9 1 1 A 81 81 HIS H H 81 8.190 8.153 0.037 1
1 918 . 9 1 1 A 81 81 HIS HA H 81 3.930 4.308 -0.378 1
1 923 . 9 1 1 A 81 81 HIS C C 81 177.740 177.721 0.019 1
1 924 . 9 1 1 A 81 81 HIS CA C 81 61.020 59.697 1.323 1
1 925 . 9 1 1 A 81 81 HIS CB C 81 28.910 29.738 -0.828 1
1 927 . 9 1 1 A 81 81 HIS N N 81 114.080 117.298 -3.218 1
1 928 . 9 1 1 A 82 82 LEU H H 82 8.080 9.097 -1.017 1
1 929 . 9 1 1 A 82 82 LEU HA H 82 3.900 3.783 0.117 1
1 939 . 9 1 1 A 82 82 LEU C C 82 180.330 178.600 1.730 1
1 940 . 9 1 1 A 82 82 LEU CA C 82 58.590 58.209 0.381 1
1 941 . 9 1 1 A 82 82 LEU CB C 82 41.350 41.534 -0.184 1
1 945 . 9 1 1 A 82 82 LEU N N 82 121.320 121.571 -0.251 1
1 946 . 9 1 1 A 83 83 VAL H H 83 8.000 7.946 0.054 1
1 947 . 9 1 1 A 83 83 VAL HA H 83 3.210 3.364 -0.154 1
1 955 . 9 1 1 A 83 83 VAL C C 83 177.060 178.218 -1.158 1
1 956 . 9 1 1 A 83 83 VAL CA C 83 67.430 66.750 0.680 1
1 957 . 9 1 1 A 83 83 VAL CB C 83 31.680 31.015 0.665 1
1 960 . 9 1 1 A 83 83 VAL N N 83 118.850 118.768 0.082 1
1 961 . 9 1 1 A 84 84 ARG H H 84 7.540 7.286 0.254 1
1 962 . 9 1 1 A 84 84 ARG HA H 84 3.590 3.863 -0.273 1
1 969 . 9 1 1 A 84 84 ARG C C 84 177.240 178.575 -1.335 1
1 970 . 9 1 1 A 84 84 ARG CA C 84 56.050 59.696 -3.646 1
1 971 . 9 1 1 A 84 84 ARG CB C 84 28.190 29.761 -1.571 1
1 974 . 9 1 1 A 84 84 ARG N N 84 111.460 120.664 -9.204 1
1 975 . 9 1 1 A 85 85 SER H H 85 7.530 7.790 -0.260 1
1 976 . 9 1 1 A 85 85 SER HA H 85 4.280 4.118 0.162 1
1 979 . 9 1 1 A 85 85 SER C C 85 173.930 175.353 -1.423 1
1 980 . 9 1 1 A 85 85 SER CA C 85 59.220 62.372 -3.152 1
1 981 . 9 1 1 A 85 85 SER CB C 85 63.830 62.960 0.870 1
1 982 . 9 1 1 A 85 85 SER N N 85 113.660 114.907 -1.247 1
1 983 . 9 1 1 A 86 86 VAL H H 86 7.230 7.014 0.216 1
1 984 . 9 1 1 A 86 86 VAL HA H 86 3.480 4.157 -0.677 1
1 992 . 9 1 1 A 86 86 VAL CA C 86 61.300 59.937 1.363 1
1 993 . 9 1 1 A 86 86 VAL CB C 86 31.780 32.523 -0.743 1
1 996 . 9 1 1 A 86 86 VAL N N 86 128.120 119.731 8.389 1
1 997 . 9 1 1 A 87 87 PRO HA H 87 4.140 4.457 -0.317 1
1 1004 . 9 1 1 A 87 87 PRO C C 87 176.400 176.542 -0.142 1
1 1005 . 9 1 1 A 87 87 PRO CA C 87 64.100 62.703 1.397 1
1 1006 . 9 1 1 A 87 87 PRO CB C 87 31.710 32.576 -0.866 1
1 1009 . 9 1 1 A 88 88 ARG H H 88 8.320 8.772 -0.452 1
1 1010 . 9 1 1 A 88 88 ARG HA H 88 3.030 4.012 -0.982 1
1 1017 . 9 1 1 A 88 88 ARG C C 88 174.630 174.926 -0.296 1
1 1018 . 9 1 1 A 88 88 ARG CA C 88 57.620 57.941 -0.321 1
1 1019 . 9 1 1 A 88 88 ARG CB C 88 26.960 28.169 -1.209 1
1 1022 . 9 1 1 A 88 88 ARG N N 88 111.360 115.910 -4.550 1
1 1023 . 9 1 1 A 89 89 VAL H H 89 7.390 7.885 -0.495 1
1 1024 . 9 1 1 A 89 89 VAL HA H 89 3.910 4.175 -0.265 1
1 1032 . 9 1 1 A 89 89 VAL C C 89 177.370 175.865 1.505 1
1 1033 . 9 1 1 A 89 89 VAL CA C 89 64.170 61.617 2.553 1
1 1034 . 9 1 1 A 89 89 VAL CB C 89 32.070 32.628 -0.558 1
1 1037 . 9 1 1 A 89 89 VAL N N 89 117.900 118.739 -0.839 1
1 1038 . 9 1 1 A 90 90 MET H H 90 9.290 8.471 0.819 1
1 1039 . 9 1 1 A 90 90 MET HA H 90 4.340 3.942 0.398 1
1 1047 . 9 1 1 A 90 90 MET C C 90 175.800 176.084 -0.284 1
1 1048 . 9 1 1 A 90 90 MET CA C 90 56.440 57.043 -0.603 1
1 1049 . 9 1 1 A 90 90 MET CB C 90 34.160 32.744 1.416 1
1 1052 . 9 1 1 A 90 90 MET N N 90 128.200 126.686 1.514 1
1 1053 . 9 1 1 A 91 91 GLY H H 91 7.130 6.751 0.379 1
1 1054 . 9 1 1 A 91 91 GLY HA2 H 91 3.340 3.854 -0.514 1
1 1055 . 9 1 1 A 91 91 GLY HA3 H 91 4.410 4.021 0.389 1
1 1056 . 9 1 1 A 91 91 GLY C C 91 170.920 171.670 -0.750 1
1 1057 . 9 1 1 A 91 91 GLY CA C 91 44.440 44.982 -0.542 1
1 1058 . 9 1 1 A 91 91 GLY N N 91 104.320 104.153 0.167 1
1 1059 . 9 1 1 A 92 92 PHE H H 92 8.790 8.499 0.291 1
1 1060 . 9 1 1 A 92 92 PHE HA H 92 5.270 5.165 0.105 1
1 1068 . 9 1 1 A 92 92 PHE C C 92 176.230 175.180 1.050 1
1 1069 . 9 1 1 A 92 92 PHE CA C 92 57.480 56.961 0.519 1
1 1070 . 9 1 1 A 92 92 PHE CB C 92 42.190 42.588 -0.398 1
1 1075 . 9 1 1 A 92 92 PHE N N 92 118.770 120.148 -1.378 1
1 1076 . 9 1 1 A 93 93 ILE H H 93 8.800 8.706 0.094 1
1 1077 . 9 1 1 A 93 93 ILE HA H 93 4.310 5.061 -0.751 1
1 1087 . 9 1 1 A 93 93 ILE C C 93 176.380 175.635 0.745 1
1 1088 . 9 1 1 A 93 93 ILE CA C 93 60.480 59.912 0.568 1
1 1089 . 9 1 1 A 93 93 ILE CB C 93 38.010 40.771 -2.761 1
1 1093 . 9 1 1 A 93 93 ILE N N 93 122.300 121.612 0.688 1
1 1094 . 9 1 1 A 94 94 GLY H H 94 8.640 8.286 0.354 1
1 1095 . 9 1 1 A 94 94 GLY HA2 H 94 3.830 4.237 -0.407 1
1 1096 . 9 1 1 A 94 94 GLY HA3 H 94 4.600 4.249 0.351 1
1 1097 . 9 1 1 A 94 94 GLY C C 94 175.080 174.524 0.556 1
1 1098 . 9 1 1 A 94 94 GLY CA C 94 44.530 44.629 -0.099 1
1 1099 . 9 1 1 A 94 94 GLY N N 94 116.550 112.727 3.823 1
1 1100 . 9 1 1 A 95 95 GLY H H 95 8.900 8.712 0.188 1
1 1101 . 9 1 1 A 95 95 GLY HA2 H 95 3.970 3.777 0.193 1
1 1102 . 9 1 1 A 95 95 GLY HA3 H 95 4.370 3.782 0.588 1
1 1103 . 9 1 1 A 95 95 GLY C C 95 174.560 174.441 0.119 1
1 1104 . 9 1 1 A 95 95 GLY CA C 95 45.640 47.439 -1.799 1
1 1105 . 9 1 1 A 95 95 GLY N N 95 112.960 111.346 1.614 1
1 1106 . 9 1 1 A 96 96 THR H H 96 7.830 7.938 -0.108 1
1 1107 . 9 1 1 A 96 96 THR HA H 96 4.720 4.885 -0.165 1
1 1112 . 9 1 1 A 96 96 THR C C 96 176.260 174.264 1.996 1
1 1113 . 9 1 1 A 96 96 THR CA C 96 60.360 59.918 0.442 1
1 1114 . 9 1 1 A 96 96 THR CB C 96 70.960 72.157 -1.197 1
1 1116 . 9 1 1 A 96 96 THR N N 96 113.350 110.900 2.450 1
1 1117 . 9 1 1 A 97 97 SER H H 97 8.850 8.899 -0.049 1
1 1118 . 9 1 1 A 97 97 SER HA H 97 4.310 4.740 -0.430 1
1 1121 . 9 1 1 A 97 97 SER C C 97 175.570 174.175 1.395 1
1 1122 . 9 1 1 A 97 97 SER CA C 97 60.850 59.213 1.637 1
1 1123 . 9 1 1 A 97 97 SER CB C 97 63.000 63.293 -0.293 1
1 1124 . 9 1 1 A 97 97 SER N N 97 116.420 116.296 0.124 1
1 1125 . 9 1 1 A 98 98 ASP H H 98 8.360 7.860 0.500 1
1 1126 . 9 1 1 A 98 98 ASP HA H 98 4.310 5.042 -0.732 1
1 1129 . 9 1 1 A 98 98 ASP C C 98 175.380 176.144 -0.764 1
1 1130 . 9 1 1 A 98 98 ASP CA C 98 54.190 54.968 -0.778 1
1 1131 . 9 1 1 A 98 98 ASP CB C 98 40.740 43.391 -2.651 1
1 1132 . 9 1 1 A 98 98 ASP N N 98 116.320 119.415 -3.095 1
1 1133 . 9 1 1 A 99 99 ARG H H 99 7.450 7.827 -0.377 1
1 1134 . 9 1 1 A 99 99 ARG HA H 99 4.350 4.535 -0.185 1
1 1141 . 9 1 1 A 99 99 ARG CA C 99 52.920 53.105 -0.185 1
1 1142 . 9 1 1 A 99 99 ARG CB C 99 30.340 31.139 -0.799 1
1 1145 . 9 1 1 A 99 99 ARG N N 99 119.960 119.940 0.020 1
1 1146 . 9 1 1 A 100 100 PRO HA H 100 4.750 4.522 0.228 1
1 1153 . 9 1 1 A 100 100 PRO C C 100 175.220 177.014 -1.794 1
1 1154 . 9 1 1 A 100 100 PRO CA C 100 62.680 62.711 -0.031 1
1 1155 . 9 1 1 A 100 100 PRO CB C 100 32.820 31.485 1.335 1
1 1158 . 9 1 1 A 101 101 ALA H H 101 7.210 8.367 -1.157 1
1 1159 . 9 1 1 A 101 101 ALA HA H 101 5.030 4.539 0.491 1
1 1163 . 9 1 1 A 101 101 ALA CA C 101 48.570 50.588 -2.018 1
1 1164 . 9 1 1 A 101 101 ALA CB C 101 19.660 17.696 1.964 1
1 1165 . 9 1 1 A 101 101 ALA N N 101 124.490 124.990 -0.500 1
1 1166 . 9 1 1 A 102 102 PRO HA H 102 4.440 4.407 0.033 1
1 1173 . 9 1 1 A 102 102 PRO C C 102 177.200 176.469 0.731 1
1 1174 . 9 1 1 A 102 102 PRO CA C 102 62.190 62.709 -0.519 1
1 1175 . 9 1 1 A 102 102 PRO CB C 102 32.310 32.791 -0.481 1
1 1178 . 9 1 1 A 103 103 ILE H H 103 8.550 7.686 0.864 1
1 1179 . 9 1 1 A 103 103 ILE HA H 103 4.630 4.913 -0.283 1
1 1189 . 9 1 1 A 103 103 ILE C C 103 175.460 175.219 0.241 1
1 1190 . 9 1 1 A 103 103 ILE CA C 103 59.730 58.477 1.253 1
1 1191 . 9 1 1 A 103 103 ILE CB C 103 40.140 42.065 -1.925 1
1 1195 . 9 1 1 A 103 103 ILE N N 103 115.670 116.520 -0.850 1
1 1196 . 9 1 1 A 104 104 SER H H 104 8.730 8.679 0.051 1
1 1197 . 9 1 1 A 104 104 SER HA H 104 4.500 4.521 -0.021 1
1 1200 . 9 1 1 A 104 104 SER C C 104 174.840 175.175 -0.335 1
1 1201 . 9 1 1 A 104 104 SER CA C 104 58.010 59.074 -1.064 1
1 1202 . 9 1 1 A 104 104 SER CB C 104 65.470 63.387 2.083 1
1 1203 . 9 1 1 A 104 104 SER N N 104 119.170 119.987 -0.817 1
1 1204 . 9 1 1 A 105 105 ASP H H 105 8.830 8.966 -0.136 1
1 1205 . 9 1 1 A 105 105 ASP HA H 105 4.200 4.195 0.005 1
1 1208 . 9 1 1 A 105 105 ASP C C 105 178.520 178.305 0.215 1
1 1209 . 9 1 1 A 105 105 ASP CA C 105 57.870 57.725 0.145 1
1 1210 . 9 1 1 A 105 105 ASP CB C 105 40.040 40.202 -0.162 1
1 1211 . 9 1 1 A 105 105 ASP N N 105 121.640 125.242 -3.602 1
1 1212 . 9 1 1 A 106 106 LYS H H 106 8.130 7.921 0.209 1
1 1213 . 9 1 1 A 106 106 LYS HA H 106 4.100 3.894 0.206 1
1 1222 . 9 1 1 A 106 106 LYS C C 106 179.400 178.700 0.700 1
1 1223 . 9 1 1 A 106 106 LYS CA C 106 58.980 59.547 -0.567 1
1 1224 . 9 1 1 A 106 106 LYS CB C 106 32.330 32.064 0.266 1
1 1228 . 9 1 1 A 106 106 LYS N N 106 118.300 120.859 -2.559 1
1 1229 . 9 1 1 A 107 107 GLU H H 107 7.670 7.641 0.029 1
1 1230 . 9 1 1 A 107 107 GLU HA H 107 4.020 3.996 0.024 1
1 1235 . 9 1 1 A 107 107 GLU C C 107 178.750 179.175 -0.425 1
1 1236 . 9 1 1 A 107 107 GLU CA C 107 59.210 59.314 -0.104 1
1 1237 . 9 1 1 A 107 107 GLU CB C 107 29.780 29.498 0.282 1
1 1239 . 9 1 1 A 107 107 GLU N N 107 121.270 118.998 2.272 1
1 1240 . 9 1 1 A 108 108 VAL H H 108 7.790 7.703 0.087 1
1 1241 . 9 1 1 A 108 108 VAL HA H 108 3.050 3.369 -0.319 1
1 1249 . 9 1 1 A 108 108 VAL C C 108 177.550 177.128 0.422 1
1 1250 . 9 1 1 A 108 108 VAL CA C 108 67.080 66.181 0.899 1
1 1251 . 9 1 1 A 108 108 VAL CB C 108 31.220 30.819 0.401 1
1 1254 . 9 1 1 A 108 108 VAL N N 108 120.940 119.441 1.499 1
1 1255 . 9 1 1 A 109 109 ASP H H 109 7.840 7.582 0.258 1
1 1256 . 9 1 1 A 109 109 ASP HA H 109 4.110 4.217 -0.107 1
1 1259 . 9 1 1 A 109 109 ASP C C 109 178.190 178.642 -0.452 1
1 1260 . 9 1 1 A 109 109 ASP CA C 109 57.470 57.139 0.331 1
1 1261 . 9 1 1 A 109 109 ASP CB C 109 40.480 39.902 0.578 1
1 1262 . 9 1 1 A 109 109 ASP N N 109 118.780 119.644 -0.864 1
1 1263 . 9 1 1 A 110 110 ALA H H 110 7.520 7.763 -0.243 1
1 1264 . 9 1 1 A 110 110 ALA HA H 110 4.110 4.029 0.081 1
1 1268 . 9 1 1 A 110 110 ALA C C 110 180.550 179.747 0.803 1
1 1269 . 9 1 1 A 110 110 ALA CA C 110 54.880 55.085 -0.205 1
1 1270 . 9 1 1 A 110 110 ALA CB C 110 18.440 18.047 0.393 1
1 1271 . 9 1 1 A 110 110 ALA N N 110 120.640 122.203 -1.563 1
1 1272 . 9 1 1 A 111 111 ILE H H 111 7.840 7.721 0.119 1
1 1273 . 9 1 1 A 111 111 ILE HA H 111 3.580 3.332 0.248 1
1 1281 . 9 1 1 A 111 111 ILE C C 111 177.470 178.051 -0.581 1
1 1282 . 9 1 1 A 111 111 ILE CA C 111 64.620 64.747 -0.127 1
1 1283 . 9 1 1 A 111 111 ILE CB C 111 38.600 37.556 1.044 1
1 1286 . 9 1 1 A 111 111 ILE N N 111 119.840 118.393 1.447 1
1 1287 . 9 1 1 A 112 112 MET H H 112 8.100 7.776 0.324 1
1 1288 . 9 1 1 A 112 112 MET HA H 112 4.400 4.272 0.128 1
1 1296 . 9 1 1 A 112 112 MET C C 112 177.710 178.780 -1.070 1
1 1297 . 9 1 1 A 112 112 MET CA C 112 55.300 58.449 -3.149 1
1 1298 . 9 1 1 A 112 112 MET CB C 112 30.510 31.981 -1.471 1
1 1301 . 9 1 1 A 112 112 MET N N 112 115.180 118.431 -3.251 1
1 1302 . 9 1 1 A 113 113 ASN H H 113 8.070 7.997 0.073 1
1 1303 . 9 1 1 A 113 113 ASN HA H 113 4.570 4.445 0.125 1
1 1308 . 9 1 1 A 113 113 ASN C C 113 175.530 178.396 -2.866 1
1 1309 . 9 1 1 A 113 113 ASN CA C 113 54.420 56.118 -1.698 1
1 1310 . 9 1 1 A 113 113 ASN CB C 113 38.350 37.712 0.638 1
1 1311 . 9 1 1 A 113 113 ASN N N 113 117.190 117.334 -0.144 1
1 1313 . 9 1 1 A 114 114 ARG H H 114 8.070 7.690 0.380 1
1 1314 . 9 1 1 A 114 114 ARG HA H 114 4.280 3.781 0.499 1
1 1321 . 9 1 1 A 114 114 ARG C C 114 176.620 178.262 -1.642 1
1 1322 . 9 1 1 A 114 114 ARG CA C 114 56.910 58.727 -1.817 1
1 1323 . 9 1 1 A 114 114 ARG CB C 114 30.370 29.553 0.817 1
1 1326 . 9 1 1 A 114 114 ARG N N 114 118.360 119.829 -1.469 1
1 1327 . 9 1 1 A 115 115 LEU H H 115 8.100 8.023 0.077 1
1 1328 . 9 1 1 A 115 115 LEU HA H 115 4.310 3.986 0.324 1
1 1338 . 9 1 1 A 115 115 LEU C C 115 177.440 179.400 -1.960 1
1 1339 . 9 1 1 A 115 115 LEU CA C 115 55.440 58.015 -2.575 1
1 1340 . 9 1 1 A 115 115 LEU CB C 115 42.250 41.687 0.563 1
1 1344 . 9 1 1 A 115 115 LEU N N 115 120.580 119.997 0.583 1
1 1345 . 9 1 1 A 116 116 GLN H H 116 8.180 7.477 0.703 1
1 1346 . 9 1 1 A 116 116 GLN HA H 116 4.360 4.145 0.215 1
1 1353 . 9 1 1 A 116 116 GLN C C 116 175.890 176.572 -0.682 1
1 1354 . 9 1 1 A 116 116 GLN CA C 116 55.810 59.026 -3.216 1
1 1355 . 9 1 1 A 116 116 GLN CB C 116 29.500 28.613 0.887 1
1 1357 . 9 1 1 A 116 116 GLN N N 116 119.770 116.740 3.030 1
1 1358 . 9 1 1 A 117 117 GLN H H 117 8.350 7.323 1.027 1
1 1359 . 9 1 1 A 117 117 GLN HA H 117 4.380 4.171 0.209 1
1 1366 . 9 1 1 A 117 117 GLN C C 117 176.130 175.126 1.004 1
1 1367 . 9 1 1 A 117 117 GLN CA C 117 55.810 56.023 -0.213 1
1 1368 . 9 1 1 A 117 117 GLN CB C 117 29.500 29.236 0.264 1
1 1370 . 9 1 1 A 117 117 GLN N N 117 121.440 120.093 1.347 1
1 1371 . 9 1 1 A 118 118 VAL H H 118 8.240 8.773 -0.533 1
1 1372 . 9 1 1 A 118 118 VAL HA H 118 4.120 4.673 -0.553 1
1 1380 . 9 1 1 A 118 118 VAL C C 118 176.650 177.440 -0.790 1
1 1381 . 9 1 1 A 118 118 VAL CA C 118 62.720 60.748 1.972 1
1 1382 . 9 1 1 A 118 118 VAL CB C 118 32.730 34.849 -2.119 1
1 1385 . 9 1 1 A 118 118 VAL N N 118 121.250 125.905 -4.655 1
1 1386 . 9 1 1 A 119 119 GLY H H 119 8.460 8.845 -0.385 1
1 1387 . 9 1 1 A 119 119 GLY HA2 H 119 3.990 3.869 0.121 1
1 1388 . 9 1 1 A 119 119 GLY HA3 H 119 3.990 3.916 0.074 1
1 1389 . 9 1 1 A 119 119 GLY C C 119 173.770 174.378 -0.608 1
1 1390 . 9 1 1 A 119 119 GLY CA C 119 45.260 47.637 -2.377 1
1 1391 . 9 1 1 A 119 119 GLY N N 119 112.300 113.975 -1.675 1
1 1392 . 9 1 1 A 120 120 ASP H H 120 8.230 8.047 0.183 1
1 1393 . 9 1 1 A 120 120 ASP HA H 120 4.580 4.920 -0.340 1
1 1396 . 9 1 1 A 120 120 ASP C C 120 175.180 176.093 -0.913 1
1 1397 . 9 1 1 A 120 120 ASP CA C 120 54.340 55.283 -0.943 1
1 1398 . 9 1 1 A 120 120 ASP CB C 120 41.390 43.519 -2.129 1
1 1399 . 9 1 1 A 120 120 ASP N N 120 120.420 119.368 1.052 1
1 1400 . 9 1 1 A 121 121 LYS H H 121 7.950 8.089 -0.139 1
1 1401 . 9 1 1 A 121 121 LYS HA H 121 4.240 3.951 0.289 1
1 1402 . 9 1 1 A 121 121 LYS CA C 121 53.620 57.182 -3.562 1
1 1403 . 9 1 1 A 121 121 LYS N N 121 119.110 119.270 -0.160 1
1 1404 . 9 1 1 A 122 122 PRO HA H 122 4.410 4.670 -0.260 1
1 1405 . 9 1 1 A 122 122 PRO C C 122 176.560 176.226 0.334 1
1 1406 . 9 1 1 A 122 122 PRO CA C 122 63.130 62.866 0.264 1
1 2 . 10 1 1 A 2 2 SER H H 2 7.890 8.666 -0.776 1
1 3 . 10 1 1 A 2 2 SER HA H 2 4.270 4.204 0.066 1
1 4 . 10 1 1 A 2 2 SER C C 2 173.960 173.963 -0.003 1
1 5 . 10 1 1 A 2 2 SER CA C 2 60.800 61.245 -0.445 1
1 6 . 10 1 1 A 2 2 SER N N 2 111.940 116.680 -4.740 1
1 7 . 10 1 1 A 3 3 GLU H H 3 8.010 7.831 0.179 1
1 8 . 10 1 1 A 3 3 GLU HA H 3 4.360 4.724 -0.364 1
1 9 . 10 1 1 A 3 3 GLU C C 3 175.710 176.219 -0.509 1
1 10 . 10 1 1 A 3 3 GLU CA C 3 56.310 54.704 1.606 1
1 11 . 10 1 1 A 3 3 GLU N N 3 121.280 119.800 1.480 1
1 12 . 10 1 1 A 4 4 ALA H H 4 8.540 8.564 -0.024 1
1 13 . 10 1 1 A 4 4 ALA HA H 4 4.560 4.368 0.192 1
1 14 . 10 1 1 A 4 4 ALA CA C 4 50.630 51.273 -0.643 1
1 15 . 10 1 1 A 4 4 ALA N N 4 127.840 125.185 2.655 1
1 16 . 10 1 1 A 5 5 PRO HA H 5 4.420 4.678 -0.258 1
1 17 . 10 1 1 A 5 5 PRO C C 5 174.240 177.330 -3.090 1
1 18 . 10 1 1 A 5 5 PRO CA C 5 62.840 62.661 0.179 1
1 19 . 10 1 1 A 6 6 LYS H H 6 8.320 8.733 -0.413 1
1 20 . 10 1 1 A 6 6 LYS HA H 6 4.290 4.471 -0.181 1
1 21 . 10 1 1 A 6 6 LYS C C 6 176.100 176.058 0.042 1
1 22 . 10 1 1 A 6 6 LYS CA C 6 55.540 56.123 -0.583 1
1 23 . 10 1 1 A 6 6 LYS N N 6 121.910 119.988 1.922 1
1 24 . 10 1 1 A 7 7 LYS H H 7 8.450 7.562 0.888 1
1 25 . 10 1 1 A 7 7 LYS HA H 7 3.940 4.551 -0.611 1
1 26 . 10 1 1 A 7 7 LYS C C 7 175.700 176.312 -0.612 1
1 27 . 10 1 1 A 7 7 LYS CA C 7 56.440 55.580 0.860 1
1 28 . 10 1 1 A 7 7 LYS N N 7 122.250 119.558 2.692 1
1 29 . 10 1 1 A 8 8 ARG H H 8 8.210 9.000 -0.790 1
1 30 . 10 1 1 A 8 8 ARG HA H 8 4.670 4.791 -0.121 1
1 31 . 10 1 1 A 8 8 ARG C C 8 173.760 174.998 -1.238 1
1 32 . 10 1 1 A 8 8 ARG CA C 8 53.420 53.886 -0.466 1
1 33 . 10 1 1 A 8 8 ARG N N 8 122.560 123.787 -1.227 1
1 34 . 10 1 1 A 9 9 TRP H H 9 8.610 8.777 -0.167 1
1 35 . 10 1 1 A 9 9 TRP HA H 9 4.910 5.291 -0.381 1
1 44 . 10 1 1 A 9 9 TRP C C 9 174.610 175.534 -0.924 1
1 45 . 10 1 1 A 9 9 TRP CA C 9 57.630 55.976 1.654 1
1 46 . 10 1 1 A 9 9 TRP CB C 9 31.020 30.553 0.467 1
1 52 . 10 1 1 A 9 9 TRP N N 9 120.540 120.700 -0.160 1
1 54 . 10 1 1 A 10 10 TYR H H 10 9.260 8.870 0.390 1
1 55 . 10 1 1 A 10 10 TYR HA H 10 4.820 5.225 -0.405 1
1 62 . 10 1 1 A 10 10 TYR C C 10 174.340 175.431 -1.091 1
1 63 . 10 1 1 A 10 10 TYR CA C 10 57.050 56.489 0.561 1
1 64 . 10 1 1 A 10 10 TYR CB C 10 41.920 42.077 -0.157 1
1 69 . 10 1 1 A 10 10 TYR N N 10 118.990 122.330 -3.340 1
1 70 . 10 1 1 A 11 11 VAL H H 11 9.450 8.752 0.698 1
1 71 . 10 1 1 A 11 11 VAL HA H 11 4.470 4.601 -0.131 1
1 79 . 10 1 1 A 11 11 VAL C C 11 175.030 175.261 -0.231 1
1 80 . 10 1 1 A 11 11 VAL CA C 11 62.320 61.821 0.499 1
1 81 . 10 1 1 A 11 11 VAL CB C 11 32.400 32.782 -0.382 1
1 84 . 10 1 1 A 11 11 VAL N N 11 120.930 123.316 -2.386 1
1 85 . 10 1 1 A 12 12 VAL H H 12 9.320 8.472 0.848 1
1 86 . 10 1 1 A 12 12 VAL HA H 12 3.940 4.262 -0.322 1
1 94 . 10 1 1 A 12 12 VAL C C 12 173.870 175.881 -2.011 1
1 95 . 10 1 1 A 12 12 VAL CA C 12 61.330 61.546 -0.216 1
1 96 . 10 1 1 A 12 12 VAL CB C 12 33.500 34.334 -0.834 1
1 99 . 10 1 1 A 12 12 VAL N N 12 128.860 125.720 3.140 1
1 100 . 10 1 1 A 13 13 GLN H H 13 8.830 8.104 0.726 1
1 101 . 10 1 1 A 13 13 GLN HA H 13 4.710 3.706 1.004 1
1 108 . 10 1 1 A 13 13 GLN C C 13 174.230 175.586 -1.356 1
1 109 . 10 1 1 A 13 13 GLN CA C 13 54.800 59.270 -4.470 1
1 110 . 10 1 1 A 13 13 GLN CB C 13 29.450 28.361 1.089 1
1 111 . 10 1 1 A 13 13 GLN N N 13 126.050 128.380 -2.330 1
1 113 . 10 1 1 A 14 14 ALA H H 14 9.420 7.692 1.728 1
1 114 . 10 1 1 A 14 14 ALA HA H 14 5.150 4.061 1.089 1
1 118 . 10 1 1 A 14 14 ALA C C 14 176.400 176.550 -0.150 1
1 119 . 10 1 1 A 14 14 ALA CA C 14 49.660 54.255 -4.595 1
1 120 . 10 1 1 A 14 14 ALA CB C 14 22.840 17.800 5.040 1
1 121 . 10 1 1 A 14 14 ALA N N 14 131.620 120.973 10.647 1
1 122 . 10 1 1 A 15 15 PHE H H 15 8.070 8.624 -0.554 1
1 123 . 10 1 1 A 15 15 PHE HA H 15 4.410 5.129 -0.719 1
1 128 . 10 1 1 A 15 15 PHE C C 15 176.130 175.018 1.112 1
1 129 . 10 1 1 A 15 15 PHE CA C 15 58.550 57.029 1.521 1
1 130 . 10 1 1 A 15 15 PHE CB C 15 39.780 41.568 -1.788 1
1 133 . 10 1 1 A 15 15 PHE N N 15 119.680 121.005 -1.325 1
1 134 . 10 1 1 A 16 16 SER H H 16 8.370 7.793 0.577 1
1 135 . 10 1 1 A 16 16 SER HA H 16 4.140 4.649 -0.509 1
1 138 . 10 1 1 A 16 16 SER C C 16 175.820 174.658 1.162 1
1 139 . 10 1 1 A 16 16 SER CA C 16 60.570 59.419 1.151 1
1 140 . 10 1 1 A 16 16 SER CB C 16 63.030 62.380 0.650 1
1 141 . 10 1 1 A 16 16 SER N N 16 119.700 117.701 1.999 1
1 142 . 10 1 1 A 17 17 GLY H H 17 9.130 8.985 0.145 1
1 143 . 10 1 1 A 17 17 GLY HA2 H 17 3.640 3.778 -0.138 1
1 144 . 10 1 1 A 17 17 GLY HA3 H 17 4.200 3.933 0.267 1
1 145 . 10 1 1 A 17 17 GLY C C 17 175.520 175.352 0.168 1
1 146 . 10 1 1 A 17 17 GLY CA C 17 45.260 45.239 0.021 1
1 147 . 10 1 1 A 17 17 GLY N N 17 115.850 112.836 3.014 1
1 148 . 10 1 1 A 18 18 PHE H H 18 8.480 7.597 0.883 1
1 149 . 10 1 1 A 18 18 PHE HA H 18 4.740 4.624 0.116 1
1 154 . 10 1 1 A 18 18 PHE C C 18 175.430 176.298 -0.868 1
1 155 . 10 1 1 A 18 18 PHE CA C 18 58.240 58.070 0.170 1
1 156 . 10 1 1 A 18 18 PHE CB C 18 39.010 38.662 0.348 1
1 159 . 10 1 1 A 18 18 PHE N N 18 118.550 119.901 -1.351 1
1 160 . 10 1 1 A 19 19 GLU H H 19 10.690 8.210 2.480 1
1 161 . 10 1 1 A 19 19 GLU HA H 19 3.490 4.124 -0.634 1
1 166 . 10 1 1 A 19 19 GLU C C 19 177.650 180.194 -2.544 1
1 167 . 10 1 1 A 19 19 GLU CA C 19 62.280 59.432 2.848 1
1 168 . 10 1 1 A 19 19 GLU CB C 19 28.380 29.101 -0.721 1
1 170 . 10 1 1 A 19 19 GLU N N 19 123.470 121.258 2.212 1
1 171 . 10 1 1 A 20 20 GLY H H 20 8.740 8.244 0.496 1
1 172 . 10 1 1 A 20 20 GLY HA2 H 20 3.840 3.776 0.064 1
1 173 . 10 1 1 A 20 20 GLY HA3 H 20 3.940 3.781 0.159 1
1 174 . 10 1 1 A 20 20 GLY C C 20 176.860 175.411 1.449 1
1 175 . 10 1 1 A 20 20 GLY CA C 20 47.140 47.050 0.090 1
1 176 . 10 1 1 A 20 20 GLY N N 20 105.480 109.587 -4.107 1
1 177 . 10 1 1 A 21 21 ARG H H 21 7.690 8.322 -0.632 1
1 178 . 10 1 1 A 21 21 ARG HA H 21 4.180 4.081 0.099 1
1 185 . 10 1 1 A 21 21 ARG C C 21 179.490 178.701 0.789 1
1 186 . 10 1 1 A 21 21 ARG CA C 21 58.660 59.275 -0.615 1
1 187 . 10 1 1 A 21 21 ARG CB C 21 30.100 29.621 0.479 1
1 190 . 10 1 1 A 21 21 ARG N N 21 123.120 122.181 0.939 1
1 191 . 10 1 1 A 22 22 VAL H H 22 8.980 9.197 -0.217 1
1 192 . 10 1 1 A 22 22 VAL HA H 22 3.560 3.615 -0.055 1
1 200 . 10 1 1 A 22 22 VAL C C 22 177.320 178.268 -0.948 1
1 201 . 10 1 1 A 22 22 VAL CA C 22 66.960 66.560 0.400 1
1 202 . 10 1 1 A 22 22 VAL CB C 22 31.050 31.765 -0.715 1
1 205 . 10 1 1 A 22 22 VAL N N 22 122.760 119.989 2.771 1
1 206 . 10 1 1 A 23 23 ALA H H 23 8.280 7.996 0.284 1
1 207 . 10 1 1 A 23 23 ALA HA H 23 3.850 3.999 -0.149 1
1 211 . 10 1 1 A 23 23 ALA C C 23 179.340 179.768 -0.428 1
1 212 . 10 1 1 A 23 23 ALA CA C 23 56.260 55.407 0.853 1
1 213 . 10 1 1 A 23 23 ALA CB C 23 18.260 18.602 -0.342 1
1 214 . 10 1 1 A 23 23 ALA N N 23 122.120 121.937 0.183 1
1 215 . 10 1 1 A 24 24 THR H H 24 8.020 7.921 0.099 1
1 216 . 10 1 1 A 24 24 THR HA H 24 3.920 3.866 0.054 1
1 221 . 10 1 1 A 24 24 THR C C 24 176.940 175.902 1.038 1
1 222 . 10 1 1 A 24 24 THR CA C 24 66.820 66.822 -0.002 1
1 223 . 10 1 1 A 24 24 THR CB C 24 68.930 68.206 0.724 1
1 225 . 10 1 1 A 24 24 THR N N 24 113.410 115.076 -1.666 1
1 226 . 10 1 1 A 25 25 SER H H 25 8.570 8.088 0.482 1
1 227 . 10 1 1 A 25 25 SER HA H 25 4.400 4.017 0.383 1
1 230 . 10 1 1 A 25 25 SER C C 25 177.610 177.222 0.388 1
1 231 . 10 1 1 A 25 25 SER CA C 25 61.920 61.752 0.168 1
1 232 . 10 1 1 A 25 25 SER CB C 25 63.540 63.057 0.483 1
1 233 . 10 1 1 A 25 25 SER N N 25 118.260 115.565 2.695 1
1 234 . 10 1 1 A 26 26 LEU H H 26 9.430 8.107 1.323 1
1 235 . 10 1 1 A 26 26 LEU HA H 26 3.900 3.914 -0.014 1
1 245 . 10 1 1 A 26 26 LEU C C 26 177.710 178.916 -1.206 1
1 246 . 10 1 1 A 26 26 LEU CA C 26 58.910 58.004 0.906 1
1 247 . 10 1 1 A 26 26 LEU CB C 26 41.300 41.425 -0.125 1
1 251 . 10 1 1 A 26 26 LEU N N 26 124.120 121.388 2.732 1
1 252 . 10 1 1 A 27 27 ARG H H 27 7.790 7.742 0.048 1
1 253 . 10 1 1 A 27 27 ARG HA H 27 3.880 3.662 0.218 1
1 260 . 10 1 1 A 27 27 ARG C C 27 179.380 178.283 1.097 1
1 261 . 10 1 1 A 27 27 ARG CA C 27 60.510 59.355 1.155 1
1 262 . 10 1 1 A 27 27 ARG CB C 27 29.670 29.961 -0.291 1
1 265 . 10 1 1 A 27 27 ARG N N 27 116.710 118.859 -2.149 1
1 266 . 10 1 1 A 28 28 GLU H H 28 7.900 8.239 -0.339 1
1 267 . 10 1 1 A 28 28 GLU HA H 28 4.070 3.935 0.135 1
1 272 . 10 1 1 A 28 28 GLU C C 28 179.450 178.670 0.780 1
1 273 . 10 1 1 A 28 28 GLU CA C 28 59.450 59.441 0.009 1
1 274 . 10 1 1 A 28 28 GLU CB C 28 29.610 29.271 0.339 1
1 276 . 10 1 1 A 28 28 GLU N N 28 118.340 119.733 -1.393 1
1 277 . 10 1 1 A 29 29 HIS H H 29 8.940 7.538 1.402 1
1 278 . 10 1 1 A 29 29 HIS HA H 29 4.160 4.460 -0.300 1
1 283 . 10 1 1 A 29 29 HIS C C 29 177.750 177.884 -0.134 1
1 284 . 10 1 1 A 29 29 HIS CA C 29 61.260 59.674 1.586 1
1 285 . 10 1 1 A 29 29 HIS CB C 29 29.870 30.446 -0.576 1
1 287 . 10 1 1 A 29 29 HIS N N 29 120.440 117.478 2.962 1
1 288 . 10 1 1 A 30 30 ILE H H 30 8.580 9.089 -0.509 1
1 289 . 10 1 1 A 30 30 ILE HA H 30 3.160 3.598 -0.438 1
1 299 . 10 1 1 A 30 30 ILE C C 30 177.230 177.952 -0.722 1
1 300 . 10 1 1 A 30 30 ILE CA C 30 66.460 65.228 1.232 1
1 301 . 10 1 1 A 30 30 ILE CB C 30 38.630 37.672 0.958 1
1 305 . 10 1 1 A 30 30 ILE N N 30 121.010 120.499 0.511 1
1 306 . 10 1 1 A 31 31 LYS H H 31 7.020 8.304 -1.284 1
1 307 . 10 1 1 A 31 31 LYS HA H 31 4.170 3.995 0.175 1
1 316 . 10 1 1 A 31 31 LYS C C 31 180.570 178.738 1.832 1
1 317 . 10 1 1 A 31 31 LYS CA C 31 58.920 59.777 -0.857 1
1 318 . 10 1 1 A 31 31 LYS CB C 31 32.490 31.979 0.511 1
1 322 . 10 1 1 A 31 31 LYS N N 31 117.400 121.020 -3.620 1
1 323 . 10 1 1 A 32 32 LEU H H 32 8.400 8.063 0.337 1
1 324 . 10 1 1 A 32 32 LEU HA H 32 3.990 3.978 0.012 1
1 334 . 10 1 1 A 32 32 LEU C C 32 178.230 178.594 -0.364 1
1 335 . 10 1 1 A 32 32 LEU CA C 32 57.700 57.824 -0.124 1
1 336 . 10 1 1 A 32 32 LEU CB C 32 42.540 41.948 0.592 1
1 340 . 10 1 1 A 32 32 LEU N N 32 121.180 119.636 1.544 1
1 341 . 10 1 1 A 33 33 HIS H H 33 7.620 8.162 -0.542 1
1 342 . 10 1 1 A 33 33 HIS HA H 33 4.600 4.652 -0.052 1
1 347 . 10 1 1 A 33 33 HIS C C 33 177.090 174.114 2.976 1
1 348 . 10 1 1 A 33 33 HIS CA C 33 55.840 55.802 0.038 1
1 349 . 10 1 1 A 33 33 HIS CB C 33 29.330 29.847 -0.517 1
1 351 . 10 1 1 A 33 33 HIS N N 33 112.220 115.888 -3.668 1
1 352 . 10 1 1 A 34 34 ASN H H 34 8.030 8.051 -0.021 1
1 353 . 10 1 1 A 34 34 ASN HA H 34 4.890 4.377 0.513 1
1 358 . 10 1 1 A 34 34 ASN C C 34 175.910 175.535 0.375 1
1 359 . 10 1 1 A 34 34 ASN CA C 34 54.530 54.314 0.216 1
1 360 . 10 1 1 A 34 34 ASN CB C 34 37.380 36.454 0.926 1
1 361 . 10 1 1 A 34 34 ASN N N 34 117.600 114.355 3.245 1
1 363 . 10 1 1 A 35 35 MET H H 35 8.330 8.785 -0.455 1
1 364 . 10 1 1 A 35 35 MET HA H 35 4.940 4.727 0.213 1
1 372 . 10 1 1 A 35 35 MET C C 35 176.880 176.923 -0.043 1
1 373 . 10 1 1 A 35 35 MET CA C 35 55.600 54.840 0.760 1
1 374 . 10 1 1 A 35 35 MET CB C 35 33.790 32.971 0.819 1
1 377 . 10 1 1 A 35 35 MET N N 35 116.190 115.922 0.268 1
1 378 . 10 1 1 A 36 36 GLU H H 36 9.730 8.164 1.566 1
1 379 . 10 1 1 A 36 36 GLU HA H 36 3.850 4.139 -0.289 1
1 384 . 10 1 1 A 36 36 GLU C C 36 178.290 178.646 -0.356 1
1 385 . 10 1 1 A 36 36 GLU CA C 36 61.280 59.581 1.699 1
1 386 . 10 1 1 A 36 36 GLU CB C 36 29.270 29.136 0.134 1
1 388 . 10 1 1 A 36 36 GLU N N 36 121.630 120.423 1.207 1
1 389 . 10 1 1 A 37 37 ASP H H 37 8.850 8.529 0.321 1
1 390 . 10 1 1 A 37 37 ASP HA H 37 4.470 4.363 0.107 1
1 393 . 10 1 1 A 37 37 ASP C C 37 177.190 178.922 -1.732 1
1 394 . 10 1 1 A 37 37 ASP CA C 37 56.140 57.942 -1.802 1
1 395 . 10 1 1 A 37 37 ASP CB C 37 40.050 41.752 -1.702 1
1 396 . 10 1 1 A 37 37 ASP N N 37 114.390 119.394 -5.004 1
1 397 . 10 1 1 A 38 38 LEU H H 38 7.880 7.802 0.078 1
1 398 . 10 1 1 A 38 38 LEU HA H 38 4.290 4.030 0.260 1
1 408 . 10 1 1 A 38 38 LEU C C 38 175.090 177.625 -2.535 1
1 409 . 10 1 1 A 38 38 LEU CA C 38 54.670 58.039 -3.369 1
1 410 . 10 1 1 A 38 38 LEU CB C 38 42.940 41.977 0.963 1
1 414 . 10 1 1 A 38 38 LEU N N 38 116.550 118.515 -1.965 1
1 415 . 10 1 1 A 39 39 PHE H H 39 7.500 7.871 -0.371 1
1 416 . 10 1 1 A 39 39 PHE HA H 39 4.970 4.556 0.414 1
1 424 . 10 1 1 A 39 39 PHE C C 39 175.380 175.493 -0.113 1
1 425 . 10 1 1 A 39 39 PHE CA C 39 57.580 58.719 -1.139 1
1 426 . 10 1 1 A 39 39 PHE CB C 39 44.990 39.525 5.465 1
1 432 . 10 1 1 A 39 39 PHE N N 39 115.370 117.402 -2.032 1
1 433 . 10 1 1 A 40 40 GLY H H 40 8.680 8.280 0.400 1
1 434 . 10 1 1 A 40 40 GLY HA2 H 40 3.370 4.026 -0.656 1
1 435 . 10 1 1 A 40 40 GLY HA3 H 40 4.550 4.099 0.451 1
1 436 . 10 1 1 A 40 40 GLY C C 40 173.090 173.754 -0.664 1
1 437 . 10 1 1 A 40 40 GLY CA C 40 44.180 46.147 -1.967 1
1 438 . 10 1 1 A 40 40 GLY N N 40 110.930 110.719 0.211 1
1 439 . 10 1 1 A 41 41 GLU H H 41 8.320 7.723 0.597 1
1 440 . 10 1 1 A 41 41 GLU HA H 41 4.280 4.918 -0.638 1
1 445 . 10 1 1 A 41 41 GLU C C 41 173.900 175.446 -1.546 1
1 446 . 10 1 1 A 41 41 GLU CA C 41 56.900 54.426 2.474 1
1 447 . 10 1 1 A 41 41 GLU CB C 41 32.110 33.825 -1.715 1
1 449 . 10 1 1 A 41 41 GLU N N 41 126.730 117.344 9.386 1
1 450 . 10 1 1 A 42 42 VAL H H 42 8.100 8.611 -0.511 1
1 451 . 10 1 1 A 42 42 VAL HA H 42 5.160 5.125 0.035 1
1 459 . 10 1 1 A 42 42 VAL C C 42 176.340 175.378 0.962 1
1 460 . 10 1 1 A 42 42 VAL CA C 42 61.200 60.561 0.639 1
1 461 . 10 1 1 A 42 42 VAL CB C 42 34.770 35.270 -0.500 1
1 464 . 10 1 1 A 42 42 VAL N N 42 119.360 121.461 -2.101 1
1 465 . 10 1 1 A 43 43 MET H H 43 9.870 9.278 0.592 1
1 466 . 10 1 1 A 43 43 MET HA H 43 5.070 5.322 -0.252 1
1 474 . 10 1 1 A 43 43 MET C C 43 173.890 175.238 -1.348 1
1 475 . 10 1 1 A 43 43 MET CA C 43 54.740 54.190 0.550 1
1 476 . 10 1 1 A 43 43 MET CB C 43 37.500 36.590 0.910 1
1 479 . 10 1 1 A 43 43 MET N N 43 125.720 124.018 1.702 1
1 480 . 10 1 1 A 44 44 VAL H H 44 8.800 8.932 -0.132 1
1 481 . 10 1 1 A 44 44 VAL HA H 44 4.720 4.835 -0.115 1
1 489 . 10 1 1 A 44 44 VAL CA C 44 59.090 58.965 0.125 1
1 490 . 10 1 1 A 44 44 VAL CB C 44 33.710 32.304 1.406 1
1 493 . 10 1 1 A 44 44 VAL N N 44 122.340 122.648 -0.308 1
1 494 . 10 1 1 A 45 45 PRO HA H 45 4.480 4.323 0.157 1
1 501 . 10 1 1 A 45 45 PRO C C 45 177.080 175.614 1.466 1
1 502 . 10 1 1 A 45 45 PRO CA C 45 63.240 63.886 -0.646 1
1 503 . 10 1 1 A 45 45 PRO CB C 45 32.170 31.622 0.548 1
1 506 . 10 1 1 A 46 46 THR H H 46 8.200 7.660 0.540 1
1 507 . 10 1 1 A 46 46 THR HA H 46 4.290 4.588 -0.298 1
1 512 . 10 1 1 A 46 46 THR C C 46 174.600 173.507 1.093 1
1 513 . 10 1 1 A 46 46 THR CA C 46 62.100 59.217 2.883 1
1 514 . 10 1 1 A 46 46 THR CB C 46 69.990 71.707 -1.717 1
1 516 . 10 1 1 A 46 46 THR N N 46 113.410 112.612 0.798 1
1 517 . 10 1 1 A 47 47 GLU H H 47 8.380 8.960 -0.580 1
1 518 . 10 1 1 A 47 47 GLU HA H 47 4.400 4.193 0.207 1
1 521 . 10 1 1 A 47 47 GLU C C 47 175.970 176.282 -0.312 1
1 522 . 10 1 1 A 47 47 GLU CA C 47 55.200 57.750 -2.550 1
1 523 . 10 1 1 A 47 47 GLU CB C 47 32.300 28.623 3.677 1
1 524 . 10 1 1 A 47 47 GLU N N 47 122.830 123.515 -0.685 1
1 525 . 10 1 1 A 48 48 GLU H H 48 8.400 8.858 -0.458 1
1 526 . 10 1 1 A 48 48 GLU HA H 48 4.280 4.250 0.030 1
1 531 . 10 1 1 A 48 48 GLU C C 48 175.750 176.237 -0.487 1
1 532 . 10 1 1 A 48 48 GLU CA C 48 55.190 59.184 -3.994 1
1 533 . 10 1 1 A 48 48 GLU CB C 48 31.980 30.277 1.703 1
1 535 . 10 1 1 A 48 48 GLU N N 48 121.950 125.736 -3.786 1
1 536 . 10 1 1 A 49 49 VAL H H 49 8.240 7.611 0.629 1
1 537 . 10 1 1 A 49 49 VAL HA H 49 4.170 4.581 -0.411 1
1 542 . 10 1 1 A 49 49 VAL C C 49 174.610 176.049 -1.439 1
1 543 . 10 1 1 A 49 49 VAL CA C 49 62.280 58.830 3.450 1
1 544 . 10 1 1 A 49 49 VAL CB C 49 32.930 35.192 -2.262 1
1 546 . 10 1 1 A 49 49 VAL N N 49 123.990 113.864 10.126 1
1 547 . 10 1 1 A 50 50 VAL H H 50 8.230 8.444 -0.214 1
1 548 . 10 1 1 A 50 50 VAL HA H 50 4.220 4.002 0.218 1
1 553 . 10 1 1 A 50 50 VAL C C 50 175.770 176.143 -0.373 1
1 554 . 10 1 1 A 50 50 VAL CA C 50 62.170 64.590 -2.420 1
1 555 . 10 1 1 A 50 50 VAL CB C 50 33.110 32.283 0.827 1
1 557 . 10 1 1 A 50 50 VAL N N 50 123.960 121.385 2.575 1
1 558 . 10 1 1 A 51 51 GLU H H 51 8.570 7.716 0.854 1
1 559 . 10 1 1 A 51 51 GLU HA H 51 4.380 4.392 -0.012 1
1 564 . 10 1 1 A 51 51 GLU C C 51 175.920 177.509 -1.589 1
1 565 . 10 1 1 A 51 51 GLU CA C 51 56.050 56.473 -0.423 1
1 566 . 10 1 1 A 51 51 GLU CB C 51 31.080 31.671 -0.591 1
1 568 . 10 1 1 A 51 51 GLU N N 51 125.070 121.609 3.461 1
1 569 . 10 1 1 A 52 52 ILE H H 52 8.320 8.626 -0.306 1
1 570 . 10 1 1 A 52 52 ILE HA H 52 4.290 3.751 0.539 1
1 580 . 10 1 1 A 52 52 ILE C C 52 176.330 177.103 -0.773 1
1 581 . 10 1 1 A 52 52 ILE CA C 52 60.940 65.118 -4.178 1
1 582 . 10 1 1 A 52 52 ILE CB C 52 38.510 37.673 0.837 1
1 586 . 10 1 1 A 52 52 ILE N N 52 122.760 127.263 -4.503 1
1 587 . 10 1 1 A 53 53 ARG H H 53 8.500 7.638 0.862 1
1 588 . 10 1 1 A 53 53 ARG HA H 53 4.430 4.142 0.288 1
1 595 . 10 1 1 A 53 53 ARG C C 53 176.950 177.161 -0.211 1
1 596 . 10 1 1 A 53 53 ARG CA C 53 56.150 58.308 -2.158 1
1 597 . 10 1 1 A 53 53 ARG CB C 53 30.200 30.463 -0.263 1
1 600 . 10 1 1 A 53 53 ARG N N 53 125.250 122.009 3.241 1
1 601 . 10 1 1 A 54 54 GLY H H 54 8.760 8.782 -0.022 1
1 602 . 10 1 1 A 54 54 GLY HA2 H 54 3.920 3.954 -0.034 1
1 603 . 10 1 1 A 54 54 GLY HA3 H 54 4.010 3.958 0.052 1
1 604 . 10 1 1 A 54 54 GLY C C 54 175.110 173.941 1.169 1
1 605 . 10 1 1 A 54 54 GLY CA C 54 46.030 46.514 -0.484 1
1 606 . 10 1 1 A 54 54 GLY N N 54 112.510 111.295 1.215 1
1 607 . 10 1 1 A 55 55 GLY H H 55 8.350 7.671 0.679 1
1 608 . 10 1 1 A 55 55 GLY HA2 H 55 3.980 4.144 -0.164 1
1 609 . 10 1 1 A 55 55 GLY HA3 H 55 3.980 4.154 -0.174 1
1 610 . 10 1 1 A 55 55 GLY C C 55 173.920 173.171 0.749 1
1 611 . 10 1 1 A 55 55 GLY CA C 55 45.200 45.865 -0.665 1
1 612 . 10 1 1 A 55 55 GLY N N 55 107.940 106.104 1.836 1
1 613 . 10 1 1 A 56 56 GLN H H 56 8.100 8.692 -0.592 1
1 614 . 10 1 1 A 56 56 GLN HA H 56 4.420 3.841 0.579 1
1 619 . 10 1 1 A 56 56 GLN C C 56 175.570 175.123 0.447 1
1 620 . 10 1 1 A 56 56 GLN CA C 56 55.420 56.842 -1.422 1
1 621 . 10 1 1 A 56 56 GLN CB C 56 30.100 26.933 3.167 1
1 623 . 10 1 1 A 56 56 GLN N N 56 119.350 117.487 1.863 1
1 624 . 10 1 1 A 57 57 ARG H H 57 8.520 7.874 0.646 1
1 625 . 10 1 1 A 57 57 ARG HA H 57 4.400 4.609 -0.209 1
1 632 . 10 1 1 A 57 57 ARG C C 57 176.210 175.836 0.374 1
1 633 . 10 1 1 A 57 57 ARG CA C 57 56.440 54.887 1.553 1
1 634 . 10 1 1 A 57 57 ARG CB C 57 30.930 31.777 -0.847 1
1 637 . 10 1 1 A 57 57 ARG N N 57 122.610 117.860 4.750 1
1 638 . 10 1 1 A 58 58 ARG H H 58 8.630 8.709 -0.079 1
1 639 . 10 1 1 A 58 58 ARG HA H 58 4.430 4.549 -0.119 1
1 646 . 10 1 1 A 58 58 ARG C C 58 175.950 176.919 -0.969 1
1 647 . 10 1 1 A 58 58 ARG CA C 58 55.450 55.622 -0.172 1
1 648 . 10 1 1 A 58 58 ARG CB C 58 31.300 31.486 -0.186 1
1 651 . 10 1 1 A 58 58 ARG N N 58 123.320 122.081 1.239 1
1 652 . 10 1 1 A 59 59 LYS H H 59 8.560 8.973 -0.413 1
1 653 . 10 1 1 A 59 59 LYS HA H 59 4.410 3.903 0.507 1
1 662 . 10 1 1 A 59 59 LYS C C 59 176.590 175.092 1.498 1
1 663 . 10 1 1 A 59 59 LYS CA C 59 56.720 57.216 -0.496 1
1 664 . 10 1 1 A 59 59 LYS CB C 59 33.150 31.188 1.962 1
1 668 . 10 1 1 A 59 59 LYS N N 59 123.380 123.712 -0.332 1
1 669 . 10 1 1 A 60 60 SER H H 60 8.450 7.773 0.677 1
1 670 . 10 1 1 A 60 60 SER HA H 60 4.480 5.138 -0.658 1
1 673 . 10 1 1 A 60 60 SER C C 60 174.280 173.689 0.591 1
1 674 . 10 1 1 A 60 60 SER CA C 60 58.140 55.775 2.365 1
1 675 . 10 1 1 A 60 60 SER CB C 60 64.160 66.316 -2.156 1
1 676 . 10 1 1 A 60 60 SER N N 60 117.320 109.752 7.568 1
1 677 . 10 1 1 A 61 61 GLU H H 61 8.550 8.673 -0.123 1
1 678 . 10 1 1 A 61 61 GLU HA H 61 4.400 4.958 -0.558 1
1 683 . 10 1 1 A 61 61 GLU C C 61 176.150 175.222 0.928 1
1 684 . 10 1 1 A 61 61 GLU CA C 61 56.300 55.180 1.120 1
1 685 . 10 1 1 A 61 61 GLU CB C 61 30.790 32.505 -1.715 1
1 687 . 10 1 1 A 61 61 GLU N N 61 122.810 121.489 1.321 1
1 688 . 10 1 1 A 62 62 ARG H H 62 8.310 8.639 -0.329 1
1 689 . 10 1 1 A 62 62 ARG HA H 62 4.340 4.793 -0.453 1
1 692 . 10 1 1 A 62 62 ARG C C 62 176.140 175.688 0.452 1
1 693 . 10 1 1 A 62 62 ARG CA C 62 56.230 54.214 2.016 1
1 694 . 10 1 1 A 62 62 ARG CB C 62 30.780 33.436 -2.656 1
1 695 . 10 1 1 A 62 62 ARG N N 62 122.080 120.574 1.506 1
1 696 . 10 1 1 A 63 63 LYS H H 63 8.470 8.088 0.382 1
1 697 . 10 1 1 A 63 63 LYS HA H 63 4.300 4.426 -0.126 1
1 700 . 10 1 1 A 63 63 LYS C C 63 175.490 175.672 -0.182 1
1 701 . 10 1 1 A 63 63 LYS CA C 63 56.200 56.399 -0.199 1
1 702 . 10 1 1 A 63 63 LYS CB C 63 30.730 32.302 -1.572 1
1 703 . 10 1 1 A 63 63 LYS N N 63 123.450 120.289 3.161 1
1 704 . 10 1 1 A 64 64 PHE H H 64 8.200 7.351 0.849 1
1 705 . 10 1 1 A 64 64 PHE HA H 64 4.450 4.837 -0.387 1
1 710 . 10 1 1 A 64 64 PHE C C 64 174.250 173.777 0.473 1
1 711 . 10 1 1 A 64 64 PHE CA C 64 57.430 56.347 1.083 1
1 712 . 10 1 1 A 64 64 PHE CB C 64 40.330 41.725 -1.395 1
1 715 . 10 1 1 A 64 64 PHE N N 64 121.740 118.997 2.743 1
1 716 . 10 1 1 A 65 65 PHE H H 65 8.130 7.894 0.236 1
1 717 . 10 1 1 A 65 65 PHE HA H 65 4.440 5.244 -0.804 1
1 725 . 10 1 1 A 65 65 PHE CA C 65 55.650 54.756 0.894 1
1 726 . 10 1 1 A 65 65 PHE CB C 65 38.900 39.950 -1.050 1
1 731 . 10 1 1 A 65 65 PHE N N 65 120.910 118.126 2.784 1
1 732 . 10 1 1 A 66 66 PRO C C 66 176.780 177.368 -0.588 1
1 733 . 10 1 1 A 67 67 GLY H H 67 9.970 9.050 0.920 1
1 734 . 10 1 1 A 67 67 GLY HA2 H 67 3.820 3.899 -0.079 1
1 735 . 10 1 1 A 67 67 GLY HA3 H 67 4.400 3.963 0.437 1
1 736 . 10 1 1 A 67 67 GLY C C 67 173.670 173.291 0.379 1
1 737 . 10 1 1 A 67 67 GLY CA C 67 45.900 45.199 0.701 1
1 738 . 10 1 1 A 67 67 GLY N N 67 111.550 111.526 0.024 1
1 739 . 10 1 1 A 68 68 TYR H H 68 7.650 8.186 -0.536 1
1 740 . 10 1 1 A 68 68 TYR HA H 68 5.000 5.067 -0.067 1
1 747 . 10 1 1 A 68 68 TYR C C 68 175.220 174.893 0.327 1
1 748 . 10 1 1 A 68 68 TYR CA C 68 57.940 56.621 1.319 1
1 753 . 10 1 1 A 68 68 TYR N N 68 118.800 119.050 -0.250 1
1 754 . 10 1 1 A 69 69 VAL H H 69 9.090 8.999 0.091 1
1 755 . 10 1 1 A 69 69 VAL HA H 69 4.330 4.842 -0.512 1
1 763 . 10 1 1 A 69 69 VAL C C 69 174.250 174.866 -0.616 1
1 764 . 10 1 1 A 69 69 VAL CA C 69 62.120 60.361 1.759 1
1 765 . 10 1 1 A 69 69 VAL CB C 69 35.240 35.909 -0.669 1
1 768 . 10 1 1 A 69 69 VAL N N 69 119.300 122.935 -3.635 1
1 769 . 10 1 1 A 70 70 LEU H H 70 9.190 8.861 0.329 1
1 770 . 10 1 1 A 70 70 LEU HA H 70 5.460 5.330 0.130 1
1 780 . 10 1 1 A 70 70 LEU C C 70 176.130 176.329 -0.199 1
1 781 . 10 1 1 A 70 70 LEU CA C 70 54.120 53.398 0.722 1
1 782 . 10 1 1 A 70 70 LEU CB C 70 43.330 43.457 -0.127 1
1 786 . 10 1 1 A 70 70 LEU N N 70 126.710 126.774 -0.064 1
1 787 . 10 1 1 A 71 71 VAL H H 71 9.350 9.355 -0.005 1
1 788 . 10 1 1 A 71 71 VAL HA H 71 5.040 4.865 0.175 1
1 796 . 10 1 1 A 71 71 VAL C C 71 173.670 174.991 -1.321 1
1 797 . 10 1 1 A 71 71 VAL CA C 71 61.090 61.438 -0.348 1
1 798 . 10 1 1 A 71 71 VAL CB C 71 35.800 35.502 0.298 1
1 801 . 10 1 1 A 71 71 VAL N N 71 121.920 124.329 -2.409 1
1 802 . 10 1 1 A 72 72 GLN H H 72 8.390 8.628 -0.238 1
1 803 . 10 1 1 A 72 72 GLN HA H 72 4.610 4.336 0.274 1
1 810 . 10 1 1 A 72 72 GLN C C 72 175.920 174.536 1.384 1
1 811 . 10 1 1 A 72 72 GLN CA C 72 53.810 55.789 -1.979 1
1 812 . 10 1 1 A 72 72 GLN CB C 72 28.850 28.843 0.007 1
1 814 . 10 1 1 A 72 72 GLN N N 72 130.760 127.831 2.929 1
1 816 . 10 1 1 A 73 73 MET H H 73 9.750 8.680 1.070 1
1 817 . 10 1 1 A 73 73 MET HA H 73 5.060 5.227 -0.167 1
1 825 . 10 1 1 A 73 73 MET C C 73 175.500 174.651 0.849 1
1 826 . 10 1 1 A 73 73 MET CA C 73 55.520 54.729 0.791 1
1 827 . 10 1 1 A 73 73 MET CB C 73 35.350 35.500 -0.150 1
1 830 . 10 1 1 A 73 73 MET N N 73 121.070 124.194 -3.124 1
1 831 . 10 1 1 A 74 74 VAL H H 74 8.530 8.574 -0.044 1
1 832 . 10 1 1 A 74 74 VAL HA H 74 3.970 4.260 -0.290 1
1 840 . 10 1 1 A 74 74 VAL C C 74 174.900 175.786 -0.886 1
1 841 . 10 1 1 A 74 74 VAL CA C 74 62.150 62.027 0.123 1
1 842 . 10 1 1 A 74 74 VAL CB C 74 32.480 32.290 0.190 1
1 845 . 10 1 1 A 74 74 VAL N N 74 124.120 122.929 1.191 1
1 846 . 10 1 1 A 75 75 MET H H 75 8.600 8.434 0.166 1
1 847 . 10 1 1 A 75 75 MET HA H 75 4.360 4.625 -0.265 1
1 855 . 10 1 1 A 75 75 MET C C 75 173.480 175.339 -1.859 1
1 856 . 10 1 1 A 75 75 MET CA C 75 53.830 53.836 -0.006 1
1 857 . 10 1 1 A 75 75 MET CB C 75 29.960 32.439 -2.479 1
1 860 . 10 1 1 A 75 75 MET N N 75 128.250 124.703 3.547 1
1 861 . 10 1 1 A 76 76 ASN H H 76 8.410 8.674 -0.264 1
1 862 . 10 1 1 A 76 76 ASN HA H 76 4.540 4.962 -0.422 1
1 867 . 10 1 1 A 76 76 ASN C C 76 173.950 175.026 -1.076 1
1 868 . 10 1 1 A 76 76 ASN CA C 76 51.720 52.005 -0.285 1
1 869 . 10 1 1 A 76 76 ASN CB C 76 38.430 40.728 -2.298 1
1 870 . 10 1 1 A 76 76 ASN N N 76 127.500 121.194 6.306 1
1 872 . 10 1 1 A 77 77 ASP H H 77 8.470 8.981 -0.511 1
1 873 . 10 1 1 A 77 77 ASP HA H 77 4.410 4.295 0.115 1
1 876 . 10 1 1 A 77 77 ASP C C 77 178.530 178.231 0.299 1
1 877 . 10 1 1 A 77 77 ASP CA C 77 58.730 57.118 1.612 1
1 878 . 10 1 1 A 77 77 ASP CB C 77 40.940 40.355 0.585 1
1 879 . 10 1 1 A 77 77 ASP N N 77 117.090 121.299 -4.209 1
1 880 . 10 1 1 A 78 78 ALA H H 78 8.160 7.972 0.188 1
1 881 . 10 1 1 A 78 78 ALA HA H 78 4.350 4.122 0.228 1
1 885 . 10 1 1 A 78 78 ALA C C 78 181.250 179.727 1.523 1
1 886 . 10 1 1 A 78 78 ALA CA C 78 55.190 55.299 -0.109 1
1 887 . 10 1 1 A 78 78 ALA CB C 78 18.260 19.174 -0.914 1
1 888 . 10 1 1 A 78 78 ALA N N 78 122.500 123.323 -0.823 1
1 889 . 10 1 1 A 79 79 SER H H 79 9.320 8.596 0.724 1
1 890 . 10 1 1 A 79 79 SER HA H 79 4.290 4.256 0.034 1
1 893 . 10 1 1 A 79 79 SER C C 79 176.570 176.199 0.371 1
1 894 . 10 1 1 A 79 79 SER CA C 79 61.080 62.277 -1.197 1
1 895 . 10 1 1 A 79 79 SER CB C 79 62.200 62.455 -0.255 1
1 896 . 10 1 1 A 79 79 SER N N 79 119.280 114.101 5.179 1
1 897 . 10 1 1 A 80 80 TRP H H 80 8.900 7.967 0.933 1
1 898 . 10 1 1 A 80 80 TRP HA H 80 4.020 4.269 -0.249 1
1 907 . 10 1 1 A 80 80 TRP C C 80 178.210 177.824 0.386 1
1 908 . 10 1 1 A 80 80 TRP CA C 80 62.490 61.420 1.070 1
1 909 . 10 1 1 A 80 80 TRP CB C 80 29.800 29.552 0.248 1
1 915 . 10 1 1 A 80 80 TRP N N 80 125.870 123.988 1.882 1
1 917 . 10 1 1 A 81 81 HIS H H 81 8.190 8.104 0.086 1
1 918 . 10 1 1 A 81 81 HIS HA H 81 3.930 4.312 -0.382 1
1 923 . 10 1 1 A 81 81 HIS C C 81 177.740 176.811 0.929 1
1 924 . 10 1 1 A 81 81 HIS CA C 81 61.020 59.940 1.080 1
1 925 . 10 1 1 A 81 81 HIS CB C 81 28.910 29.560 -0.650 1
1 927 . 10 1 1 A 81 81 HIS N N 81 114.080 119.735 -5.655 1
1 928 . 10 1 1 A 82 82 LEU H H 82 8.080 8.487 -0.407 1
1 929 . 10 1 1 A 82 82 LEU HA H 82 3.900 3.834 0.066 1
1 939 . 10 1 1 A 82 82 LEU C C 82 180.330 178.588 1.742 1
1 940 . 10 1 1 A 82 82 LEU CA C 82 58.590 58.256 0.334 1
1 941 . 10 1 1 A 82 82 LEU CB C 82 41.350 41.532 -0.182 1
1 945 . 10 1 1 A 82 82 LEU N N 82 121.320 120.553 0.767 1
1 946 . 10 1 1 A 83 83 VAL H H 83 8.000 8.030 -0.030 1
1 947 . 10 1 1 A 83 83 VAL HA H 83 3.210 3.522 -0.312 1
1 955 . 10 1 1 A 83 83 VAL C C 83 177.060 178.275 -1.215 1
1 956 . 10 1 1 A 83 83 VAL CA C 83 67.430 66.473 0.957 1
1 957 . 10 1 1 A 83 83 VAL CB C 83 31.680 31.558 0.122 1
1 960 . 10 1 1 A 83 83 VAL N N 83 118.850 118.706 0.144 1
1 961 . 10 1 1 A 84 84 ARG H H 84 7.540 7.596 -0.056 1
1 962 . 10 1 1 A 84 84 ARG HA H 84 3.590 3.812 -0.222 1
1 969 . 10 1 1 A 84 84 ARG C C 84 177.240 178.220 -0.980 1
1 970 . 10 1 1 A 84 84 ARG CA C 84 56.050 59.687 -3.637 1
1 971 . 10 1 1 A 84 84 ARG CB C 84 28.190 29.645 -1.455 1
1 974 . 10 1 1 A 84 84 ARG N N 84 111.460 120.759 -9.299 1
1 975 . 10 1 1 A 85 85 SER H H 85 7.530 8.104 -0.574 1
1 976 . 10 1 1 A 85 85 SER HA H 85 4.280 4.033 0.247 1
1 979 . 10 1 1 A 85 85 SER C C 85 173.930 174.413 -0.483 1
1 980 . 10 1 1 A 85 85 SER CA C 85 59.220 61.128 -1.908 1
1 981 . 10 1 1 A 85 85 SER CB C 85 63.830 61.708 2.122 1
1 982 . 10 1 1 A 85 85 SER N N 85 113.660 113.698 -0.038 1
1 983 . 10 1 1 A 86 86 VAL H H 86 7.230 6.956 0.274 1
1 984 . 10 1 1 A 86 86 VAL HA H 86 3.480 4.073 -0.593 1
1 992 . 10 1 1 A 86 86 VAL CA C 86 61.300 59.790 1.510 1
1 993 . 10 1 1 A 86 86 VAL CB C 86 31.780 32.485 -0.705 1
1 996 . 10 1 1 A 86 86 VAL N N 86 128.120 120.739 7.381 1
1 997 . 10 1 1 A 87 87 PRO HA H 87 4.140 4.437 -0.297 1
1 1004 . 10 1 1 A 87 87 PRO C C 87 176.400 176.516 -0.116 1
1 1005 . 10 1 1 A 87 87 PRO CA C 87 64.100 62.609 1.491 1
1 1006 . 10 1 1 A 87 87 PRO CB C 87 31.710 32.537 -0.827 1
1 1009 . 10 1 1 A 88 88 ARG H H 88 8.320 8.775 -0.455 1
1 1010 . 10 1 1 A 88 88 ARG HA H 88 3.030 3.902 -0.872 1
1 1017 . 10 1 1 A 88 88 ARG C C 88 174.630 174.885 -0.255 1
1 1018 . 10 1 1 A 88 88 ARG CA C 88 57.620 58.002 -0.382 1
1 1019 . 10 1 1 A 88 88 ARG CB C 88 26.960 28.108 -1.148 1
1 1022 . 10 1 1 A 88 88 ARG N N 88 111.360 116.060 -4.700 1
1 1023 . 10 1 1 A 89 89 VAL H H 89 7.390 7.738 -0.348 1
1 1024 . 10 1 1 A 89 89 VAL HA H 89 3.910 4.253 -0.343 1
1 1032 . 10 1 1 A 89 89 VAL C C 89 177.370 175.959 1.411 1
1 1033 . 10 1 1 A 89 89 VAL CA C 89 64.170 61.702 2.468 1
1 1034 . 10 1 1 A 89 89 VAL CB C 89 32.070 32.646 -0.576 1
1 1037 . 10 1 1 A 89 89 VAL N N 89 117.900 118.726 -0.826 1
1 1038 . 10 1 1 A 90 90 MET H H 90 9.290 9.006 0.284 1
1 1039 . 10 1 1 A 90 90 MET HA H 90 4.340 4.334 0.006 1
1 1047 . 10 1 1 A 90 90 MET C C 90 175.800 175.954 -0.154 1
1 1048 . 10 1 1 A 90 90 MET CA C 90 56.440 57.259 -0.819 1
1 1049 . 10 1 1 A 90 90 MET CB C 90 34.160 33.399 0.761 1
1 1052 . 10 1 1 A 90 90 MET N N 90 128.200 126.841 1.359 1
1 1053 . 10 1 1 A 91 91 GLY H H 91 7.130 7.196 -0.066 1
1 1054 . 10 1 1 A 91 91 GLY HA2 H 91 3.340 3.933 -0.593 1
1 1055 . 10 1 1 A 91 91 GLY HA3 H 91 4.410 4.044 0.366 1
1 1056 . 10 1 1 A 91 91 GLY C C 91 170.920 171.309 -0.389 1
1 1057 . 10 1 1 A 91 91 GLY CA C 91 44.440 45.683 -1.243 1
1 1058 . 10 1 1 A 91 91 GLY N N 91 104.320 103.925 0.395 1
1 1059 . 10 1 1 A 92 92 PHE H H 92 8.790 8.516 0.274 1
1 1060 . 10 1 1 A 92 92 PHE HA H 92 5.270 4.959 0.311 1
1 1068 . 10 1 1 A 92 92 PHE C C 92 176.230 175.256 0.974 1
1 1069 . 10 1 1 A 92 92 PHE CA C 92 57.480 57.533 -0.053 1
1 1070 . 10 1 1 A 92 92 PHE CB C 92 42.190 42.069 0.121 1
1 1075 . 10 1 1 A 92 92 PHE N N 92 118.770 118.997 -0.227 1
1 1076 . 10 1 1 A 93 93 ILE H H 93 8.800 8.824 -0.024 1
1 1077 . 10 1 1 A 93 93 ILE HA H 93 4.310 5.017 -0.707 1
1 1087 . 10 1 1 A 93 93 ILE C C 93 176.380 175.984 0.396 1
1 1088 . 10 1 1 A 93 93 ILE CA C 93 60.480 59.756 0.724 1
1 1089 . 10 1 1 A 93 93 ILE CB C 93 38.010 40.044 -2.034 1
1 1093 . 10 1 1 A 93 93 ILE N N 93 122.300 121.478 0.822 1
1 1094 . 10 1 1 A 94 94 GLY H H 94 8.640 8.406 0.234 1
1 1095 . 10 1 1 A 94 94 GLY HA2 H 94 3.830 4.270 -0.440 1
1 1096 . 10 1 1 A 94 94 GLY HA3 H 94 4.600 4.289 0.311 1
1 1097 . 10 1 1 A 94 94 GLY C C 94 175.080 174.327 0.753 1
1 1098 . 10 1 1 A 94 94 GLY CA C 94 44.530 46.224 -1.694 1
1 1099 . 10 1 1 A 94 94 GLY N N 94 116.550 113.833 2.717 1
1 1100 . 10 1 1 A 95 95 GLY H H 95 8.900 8.836 0.064 1
1 1101 . 10 1 1 A 95 95 GLY HA2 H 95 3.970 3.906 0.064 1
1 1102 . 10 1 1 A 95 95 GLY HA3 H 95 4.370 3.911 0.459 1
1 1103 . 10 1 1 A 95 95 GLY C C 95 174.560 174.083 0.477 1
1 1104 . 10 1 1 A 95 95 GLY CA C 95 45.640 46.908 -1.268 1
1 1105 . 10 1 1 A 95 95 GLY N N 95 112.960 110.777 2.183 1
1 1106 . 10 1 1 A 96 96 THR H H 96 7.830 7.707 0.123 1
1 1107 . 10 1 1 A 96 96 THR HA H 96 4.720 4.825 -0.105 1
1 1112 . 10 1 1 A 96 96 THR C C 96 176.260 174.465 1.795 1
1 1113 . 10 1 1 A 96 96 THR CA C 96 60.360 59.330 1.030 1
1 1114 . 10 1 1 A 96 96 THR CB C 96 70.960 72.286 -1.326 1
1 1116 . 10 1 1 A 96 96 THR N N 96 113.350 111.010 2.340 1
1 1117 . 10 1 1 A 97 97 SER H H 97 8.850 8.907 -0.057 1
1 1118 . 10 1 1 A 97 97 SER HA H 97 4.310 4.649 -0.339 1
1 1121 . 10 1 1 A 97 97 SER C C 97 175.570 174.215 1.355 1
1 1122 . 10 1 1 A 97 97 SER CA C 97 60.850 59.551 1.299 1
1 1123 . 10 1 1 A 97 97 SER CB C 97 63.000 63.440 -0.440 1
1 1124 . 10 1 1 A 97 97 SER N N 97 116.420 116.409 0.011 1
1 1125 . 10 1 1 A 98 98 ASP H H 98 8.360 7.920 0.440 1
1 1126 . 10 1 1 A 98 98 ASP HA H 98 4.310 5.213 -0.903 1
1 1129 . 10 1 1 A 98 98 ASP C C 98 175.380 175.643 -0.263 1
1 1130 . 10 1 1 A 98 98 ASP CA C 98 54.190 54.799 -0.609 1
1 1131 . 10 1 1 A 98 98 ASP CB C 98 40.740 43.517 -2.777 1
1 1132 . 10 1 1 A 98 98 ASP N N 98 116.320 119.590 -3.270 1
1 1133 . 10 1 1 A 99 99 ARG H H 99 7.450 7.798 -0.348 1
1 1134 . 10 1 1 A 99 99 ARG HA H 99 4.350 4.649 -0.299 1
1 1141 . 10 1 1 A 99 99 ARG CA C 99 52.920 52.826 0.094 1
1 1142 . 10 1 1 A 99 99 ARG CB C 99 30.340 31.799 -1.459 1
1 1145 . 10 1 1 A 99 99 ARG N N 99 119.960 118.273 1.687 1
1 1146 . 10 1 1 A 100 100 PRO HA H 100 4.750 4.744 0.006 1
1 1153 . 10 1 1 A 100 100 PRO C C 100 175.220 177.093 -1.873 1
1 1154 . 10 1 1 A 100 100 PRO CA C 100 62.680 62.805 -0.125 1
1 1155 . 10 1 1 A 100 100 PRO CB C 100 32.820 31.788 1.032 1
1 1158 . 10 1 1 A 101 101 ALA H H 101 7.210 8.367 -1.157 1
1 1159 . 10 1 1 A 101 101 ALA HA H 101 5.030 4.448 0.582 1
1 1163 . 10 1 1 A 101 101 ALA CA C 101 48.570 50.680 -2.110 1
1 1164 . 10 1 1 A 101 101 ALA CB C 101 19.660 17.809 1.851 1
1 1165 . 10 1 1 A 101 101 ALA N N 101 124.490 125.602 -1.112 1
1 1166 . 10 1 1 A 102 102 PRO HA H 102 4.440 4.221 0.219 1
1 1173 . 10 1 1 A 102 102 PRO C C 102 177.200 176.457 0.743 1
1 1174 . 10 1 1 A 102 102 PRO CA C 102 62.190 62.556 -0.366 1
1 1175 . 10 1 1 A 102 102 PRO CB C 102 32.310 32.621 -0.311 1
1 1178 . 10 1 1 A 103 103 ILE H H 103 8.550 7.674 0.876 1
1 1179 . 10 1 1 A 103 103 ILE HA H 103 4.630 4.854 -0.224 1
1 1189 . 10 1 1 A 103 103 ILE C C 103 175.460 175.269 0.191 1
1 1190 . 10 1 1 A 103 103 ILE CA C 103 59.730 58.469 1.261 1
1 1191 . 10 1 1 A 103 103 ILE CB C 103 40.140 42.078 -1.938 1
1 1195 . 10 1 1 A 103 103 ILE N N 103 115.670 116.205 -0.535 1
1 1196 . 10 1 1 A 104 104 SER H H 104 8.730 8.618 0.112 1
1 1197 . 10 1 1 A 104 104 SER HA H 104 4.500 4.533 -0.033 1
1 1200 . 10 1 1 A 104 104 SER C C 104 174.840 175.297 -0.457 1
1 1201 . 10 1 1 A 104 104 SER CA C 104 58.010 58.671 -0.661 1
1 1202 . 10 1 1 A 104 104 SER CB C 104 65.470 63.663 1.807 1
1 1203 . 10 1 1 A 104 104 SER N N 104 119.170 119.874 -0.704 1
1 1204 . 10 1 1 A 105 105 ASP H H 105 8.830 9.018 -0.188 1
1 1205 . 10 1 1 A 105 105 ASP HA H 105 4.200 4.329 -0.129 1
1 1208 . 10 1 1 A 105 105 ASP C C 105 178.520 178.400 0.120 1
1 1209 . 10 1 1 A 105 105 ASP CA C 105 57.870 57.919 -0.049 1
1 1210 . 10 1 1 A 105 105 ASP CB C 105 40.040 40.260 -0.220 1
1 1211 . 10 1 1 A 105 105 ASP N N 105 121.640 125.336 -3.696 1
1 1212 . 10 1 1 A 106 106 LYS H H 106 8.130 8.073 0.057 1
1 1213 . 10 1 1 A 106 106 LYS HA H 106 4.100 3.926 0.174 1
1 1222 . 10 1 1 A 106 106 LYS C C 106 179.400 178.744 0.656 1
1 1223 . 10 1 1 A 106 106 LYS CA C 106 58.980 59.703 -0.723 1
1 1224 . 10 1 1 A 106 106 LYS CB C 106 32.330 32.228 0.102 1
1 1228 . 10 1 1 A 106 106 LYS N N 106 118.300 120.604 -2.304 1
1 1229 . 10 1 1 A 107 107 GLU H H 107 7.670 7.841 -0.171 1
1 1230 . 10 1 1 A 107 107 GLU HA H 107 4.020 4.051 -0.031 1
1 1235 . 10 1 1 A 107 107 GLU C C 107 178.750 179.217 -0.467 1
1 1236 . 10 1 1 A 107 107 GLU CA C 107 59.210 59.260 -0.050 1
1 1237 . 10 1 1 A 107 107 GLU CB C 107 29.780 29.293 0.487 1
1 1239 . 10 1 1 A 107 107 GLU N N 107 121.270 118.990 2.280 1
1 1240 . 10 1 1 A 108 108 VAL H H 108 7.790 7.542 0.248 1
1 1241 . 10 1 1 A 108 108 VAL HA H 108 3.050 3.420 -0.370 1
1 1249 . 10 1 1 A 108 108 VAL C C 108 177.550 177.152 0.398 1
1 1250 . 10 1 1 A 108 108 VAL CA C 108 67.080 66.392 0.688 1
1 1251 . 10 1 1 A 108 108 VAL CB C 108 31.220 30.800 0.420 1
1 1254 . 10 1 1 A 108 108 VAL N N 108 120.940 119.126 1.814 1
1 1255 . 10 1 1 A 109 109 ASP H H 109 7.840 7.769 0.071 1
1 1256 . 10 1 1 A 109 109 ASP HA H 109 4.110 4.192 -0.082 1
1 1259 . 10 1 1 A 109 109 ASP C C 109 178.190 178.712 -0.522 1
1 1260 . 10 1 1 A 109 109 ASP CA C 109 57.470 57.324 0.146 1
1 1261 . 10 1 1 A 109 109 ASP CB C 109 40.480 40.060 0.420 1
1 1262 . 10 1 1 A 109 109 ASP N N 109 118.780 119.461 -0.681 1
1 1263 . 10 1 1 A 110 110 ALA H H 110 7.520 7.980 -0.460 1
1 1264 . 10 1 1 A 110 110 ALA HA H 110 4.110 4.074 0.036 1
1 1268 . 10 1 1 A 110 110 ALA C C 110 180.550 179.890 0.660 1
1 1269 . 10 1 1 A 110 110 ALA CA C 110 54.880 55.139 -0.259 1
1 1270 . 10 1 1 A 110 110 ALA CB C 110 18.440 18.446 -0.006 1
1 1271 . 10 1 1 A 110 110 ALA N N 110 120.640 121.971 -1.331 1
1 1272 . 10 1 1 A 111 111 ILE H H 111 7.840 8.011 -0.171 1
1 1273 . 10 1 1 A 111 111 ILE HA H 111 3.580 3.734 -0.154 1
1 1281 . 10 1 1 A 111 111 ILE C C 111 177.470 178.014 -0.544 1
1 1282 . 10 1 1 A 111 111 ILE CA C 111 64.620 65.057 -0.437 1
1 1283 . 10 1 1 A 111 111 ILE CB C 111 38.600 37.922 0.678 1
1 1286 . 10 1 1 A 111 111 ILE N N 111 119.840 118.078 1.762 1
1 1287 . 10 1 1 A 112 112 MET H H 112 8.100 8.059 0.041 1
1 1288 . 10 1 1 A 112 112 MET HA H 112 4.400 4.087 0.313 1
1 1296 . 10 1 1 A 112 112 MET C C 112 177.710 179.040 -1.330 1
1 1297 . 10 1 1 A 112 112 MET CA C 112 55.300 58.950 -3.650 1
1 1298 . 10 1 1 A 112 112 MET CB C 112 30.510 32.857 -2.347 1
1 1301 . 10 1 1 A 112 112 MET N N 112 115.180 118.295 -3.115 1
1 1302 . 10 1 1 A 113 113 ASN H H 113 8.070 8.431 -0.361 1
1 1303 . 10 1 1 A 113 113 ASN HA H 113 4.570 4.359 0.211 1
1 1308 . 10 1 1 A 113 113 ASN C C 113 175.530 178.120 -2.590 1
1 1309 . 10 1 1 A 113 113 ASN CA C 113 54.420 56.568 -2.148 1
1 1310 . 10 1 1 A 113 113 ASN CB C 113 38.350 37.646 0.704 1
1 1311 . 10 1 1 A 113 113 ASN N N 113 117.190 117.378 -0.188 1
1 1313 . 10 1 1 A 114 114 ARG H H 114 8.070 7.826 0.244 1
1 1314 . 10 1 1 A 114 114 ARG HA H 114 4.280 3.979 0.301 1
1 1321 . 10 1 1 A 114 114 ARG C C 114 176.620 178.607 -1.987 1
1 1322 . 10 1 1 A 114 114 ARG CA C 114 56.910 59.282 -2.372 1
1 1323 . 10 1 1 A 114 114 ARG CB C 114 30.370 30.084 0.286 1
1 1326 . 10 1 1 A 114 114 ARG N N 114 118.360 119.581 -1.221 1
1 1327 . 10 1 1 A 115 115 LEU H H 115 8.100 7.793 0.307 1
1 1328 . 10 1 1 A 115 115 LEU HA H 115 4.310 3.870 0.440 1
1 1338 . 10 1 1 A 115 115 LEU C C 115 177.440 178.513 -1.073 1
1 1339 . 10 1 1 A 115 115 LEU CA C 115 55.440 57.563 -2.123 1
1 1340 . 10 1 1 A 115 115 LEU CB C 115 42.250 41.370 0.880 1
1 1344 . 10 1 1 A 115 115 LEU N N 115 120.580 121.521 -0.941 1
1 1345 . 10 1 1 A 116 116 GLN H H 116 8.180 7.760 0.420 1
1 1346 . 10 1 1 A 116 116 GLN HA H 116 4.360 4.060 0.300 1
1 1353 . 10 1 1 A 116 116 GLN C C 116 175.890 176.473 -0.583 1
1 1354 . 10 1 1 A 116 116 GLN CA C 116 55.810 58.314 -2.504 1
1 1355 . 10 1 1 A 116 116 GLN CB C 116 29.500 28.468 1.032 1
1 1357 . 10 1 1 A 116 116 GLN N N 116 119.770 118.151 1.619 1
1 1358 . 10 1 1 A 117 117 GLN H H 117 8.350 8.573 -0.223 1
1 1359 . 10 1 1 A 117 117 GLN HA H 117 4.380 4.418 -0.038 1
1 1366 . 10 1 1 A 117 117 GLN C C 117 176.130 176.277 -0.147 1
1 1367 . 10 1 1 A 117 117 GLN CA C 117 55.810 55.353 0.457 1
1 1368 . 10 1 1 A 117 117 GLN CB C 117 29.500 29.464 0.036 1
1 1370 . 10 1 1 A 117 117 GLN N N 117 121.440 119.475 1.965 1
1 1371 . 10 1 1 A 118 118 VAL H H 118 8.240 8.866 -0.626 1
1 1372 . 10 1 1 A 118 118 VAL HA H 118 4.120 3.937 0.183 1
1 1380 . 10 1 1 A 118 118 VAL C C 118 176.650 176.256 0.394 1
1 1381 . 10 1 1 A 118 118 VAL CA C 118 62.720 63.426 -0.706 1
1 1382 . 10 1 1 A 118 118 VAL CB C 118 32.730 32.126 0.604 1
1 1385 . 10 1 1 A 118 118 VAL N N 118 121.250 125.547 -4.297 1
1 1386 . 10 1 1 A 119 119 GLY H H 119 8.460 7.964 0.496 1
1 1387 . 10 1 1 A 119 119 GLY HA2 H 119 3.990 3.971 0.019 1
1 1388 . 10 1 1 A 119 119 GLY HA3 H 119 3.990 3.974 0.016 1
1 1389 . 10 1 1 A 119 119 GLY C C 119 173.770 174.292 -0.522 1
1 1390 . 10 1 1 A 119 119 GLY CA C 119 45.260 45.705 -0.445 1
1 1391 . 10 1 1 A 119 119 GLY N N 119 112.300 108.694 3.606 1
1 1392 . 10 1 1 A 120 120 ASP H H 120 8.230 7.992 0.238 1
1 1393 . 10 1 1 A 120 120 ASP HA H 120 4.580 4.630 -0.050 1
1 1396 . 10 1 1 A 120 120 ASP C C 120 175.180 175.739 -0.559 1
1 1397 . 10 1 1 A 120 120 ASP CA C 120 54.340 55.073 -0.733 1
1 1398 . 10 1 1 A 120 120 ASP CB C 120 41.390 41.834 -0.444 1
1 1399 . 10 1 1 A 120 120 ASP N N 120 120.420 120.101 0.319 1
1 1400 . 10 1 1 A 121 121 LYS H H 121 7.950 8.692 -0.742 1
1 1401 . 10 1 1 A 121 121 LYS HA H 121 4.240 4.580 -0.340 1
1 1402 . 10 1 1 A 121 121 LYS CA C 121 53.620 57.435 -3.815 1
1 1403 . 10 1 1 A 121 121 LYS N N 121 119.110 121.187 -2.077 1
1 1404 . 10 1 1 A 122 122 PRO HA H 122 4.410 4.375 0.035 1
1 1405 . 10 1 1 A 122 122 PRO C C 122 176.560 176.439 0.121 1
1 1406 . 10 1 1 A 122 122 PRO CA C 122 63.130 64.639 -1.509 1
1 2 . 11 1 1 A 2 2 SER H H 2 7.890 8.735 -0.845 1
1 3 . 11 1 1 A 2 2 SER HA H 2 4.270 4.951 -0.681 1
1 4 . 11 1 1 A 2 2 SER C C 2 173.960 175.091 -1.131 1
1 5 . 11 1 1 A 2 2 SER CA C 2 60.800 56.080 4.720 1
1 6 . 11 1 1 A 2 2 SER N N 2 111.940 119.877 -7.937 1
1 7 . 11 1 1 A 3 3 GLU H H 3 8.010 9.075 -1.065 1
1 8 . 11 1 1 A 3 3 GLU HA H 3 4.360 4.004 0.356 1
1 9 . 11 1 1 A 3 3 GLU C C 3 175.710 176.250 -0.540 1
1 10 . 11 1 1 A 3 3 GLU CA C 3 56.310 59.401 -3.091 1
1 11 . 11 1 1 A 3 3 GLU N N 3 121.280 126.843 -5.563 1
1 12 . 11 1 1 A 4 4 ALA H H 4 8.540 7.873 0.667 1
1 13 . 11 1 1 A 4 4 ALA HA H 4 4.560 4.034 0.526 1
1 14 . 11 1 1 A 4 4 ALA CA C 4 50.630 52.732 -2.102 1
1 15 . 11 1 1 A 4 4 ALA N N 4 127.840 120.214 7.626 1
1 16 . 11 1 1 A 5 5 PRO HA H 5 4.420 4.322 0.098 1
1 17 . 11 1 1 A 5 5 PRO C C 5 174.240 176.818 -2.578 1
1 18 . 11 1 1 A 5 5 PRO CA C 5 62.840 64.239 -1.399 1
1 19 . 11 1 1 A 6 6 LYS H H 6 8.320 7.842 0.478 1
1 20 . 11 1 1 A 6 6 LYS HA H 6 4.290 3.811 0.479 1
1 21 . 11 1 1 A 6 6 LYS C C 6 176.100 174.644 1.456 1
1 22 . 11 1 1 A 6 6 LYS CA C 6 55.540 57.352 -1.812 1
1 23 . 11 1 1 A 6 6 LYS N N 6 121.910 116.465 5.445 1
1 24 . 11 1 1 A 7 7 LYS H H 7 8.450 7.384 1.066 1
1 25 . 11 1 1 A 7 7 LYS HA H 7 3.940 4.674 -0.734 1
1 26 . 11 1 1 A 7 7 LYS C C 7 175.700 175.413 0.287 1
1 27 . 11 1 1 A 7 7 LYS CA C 7 56.440 54.764 1.676 1
1 28 . 11 1 1 A 7 7 LYS N N 7 122.250 116.687 5.563 1
1 29 . 11 1 1 A 8 8 ARG H H 8 8.210 8.695 -0.485 1
1 30 . 11 1 1 A 8 8 ARG HA H 8 4.670 4.791 -0.121 1
1 31 . 11 1 1 A 8 8 ARG C C 8 173.760 174.294 -0.534 1
1 32 . 11 1 1 A 8 8 ARG CA C 8 53.420 53.854 -0.434 1
1 33 . 11 1 1 A 8 8 ARG N N 8 122.560 122.982 -0.422 1
1 34 . 11 1 1 A 9 9 TRP H H 9 8.610 8.594 0.016 1
1 35 . 11 1 1 A 9 9 TRP HA H 9 4.910 5.329 -0.419 1
1 44 . 11 1 1 A 9 9 TRP C C 9 174.610 175.032 -0.422 1
1 45 . 11 1 1 A 9 9 TRP CA C 9 57.630 55.406 2.224 1
1 46 . 11 1 1 A 9 9 TRP CB C 9 31.020 30.991 0.029 1
1 52 . 11 1 1 A 9 9 TRP N N 9 120.540 121.769 -1.229 1
1 54 . 11 1 1 A 10 10 TYR H H 10 9.260 9.232 0.028 1
1 55 . 11 1 1 A 10 10 TYR HA H 10 4.820 5.191 -0.371 1
1 62 . 11 1 1 A 10 10 TYR C C 10 174.340 174.902 -0.562 1
1 63 . 11 1 1 A 10 10 TYR CA C 10 57.050 56.380 0.670 1
1 64 . 11 1 1 A 10 10 TYR CB C 10 41.920 43.113 -1.193 1
1 69 . 11 1 1 A 10 10 TYR N N 10 118.990 121.091 -2.101 1
1 70 . 11 1 1 A 11 11 VAL H H 11 9.450 8.939 0.511 1
1 71 . 11 1 1 A 11 11 VAL HA H 11 4.470 4.877 -0.407 1
1 79 . 11 1 1 A 11 11 VAL C C 11 175.030 175.563 -0.533 1
1 80 . 11 1 1 A 11 11 VAL CA C 11 62.320 61.812 0.508 1
1 81 . 11 1 1 A 11 11 VAL CB C 11 32.400 33.277 -0.877 1
1 84 . 11 1 1 A 11 11 VAL N N 11 120.930 122.863 -1.933 1
1 85 . 11 1 1 A 12 12 VAL H H 12 9.320 9.956 -0.636 1
1 86 . 11 1 1 A 12 12 VAL HA H 12 3.940 4.465 -0.525 1
1 94 . 11 1 1 A 12 12 VAL C C 12 173.870 174.706 -0.836 1
1 95 . 11 1 1 A 12 12 VAL CA C 12 61.330 60.880 0.450 1
1 96 . 11 1 1 A 12 12 VAL CB C 12 33.500 34.484 -0.984 1
1 99 . 11 1 1 A 12 12 VAL N N 12 128.860 127.872 0.988 1
1 100 . 11 1 1 A 13 13 GLN H H 13 8.830 8.122 0.708 1
1 101 . 11 1 1 A 13 13 GLN HA H 13 4.710 5.247 -0.537 1
1 108 . 11 1 1 A 13 13 GLN C C 13 174.230 175.335 -1.105 1
1 109 . 11 1 1 A 13 13 GLN CA C 13 54.800 55.261 -0.461 1
1 110 . 11 1 1 A 13 13 GLN CB C 13 29.450 30.350 -0.900 1
1 111 . 11 1 1 A 13 13 GLN N N 13 126.050 126.345 -0.295 1
1 113 . 11 1 1 A 14 14 ALA H H 14 9.420 8.472 0.948 1
1 114 . 11 1 1 A 14 14 ALA HA H 14 5.150 4.816 0.334 1
1 118 . 11 1 1 A 14 14 ALA C C 14 176.400 176.145 0.255 1
1 119 . 11 1 1 A 14 14 ALA CA C 14 49.660 51.101 -1.441 1
1 120 . 11 1 1 A 14 14 ALA CB C 14 22.840 22.935 -0.095 1
1 121 . 11 1 1 A 14 14 ALA N N 14 131.620 122.164 9.456 1
1 122 . 11 1 1 A 15 15 PHE H H 15 8.070 8.285 -0.215 1
1 123 . 11 1 1 A 15 15 PHE HA H 15 4.410 4.734 -0.324 1
1 128 . 11 1 1 A 15 15 PHE C C 15 176.130 176.000 0.130 1
1 129 . 11 1 1 A 15 15 PHE CA C 15 58.550 58.886 -0.336 1
1 130 . 11 1 1 A 15 15 PHE CB C 15 39.780 39.759 0.021 1
1 133 . 11 1 1 A 15 15 PHE N N 15 119.680 119.700 -0.020 1
1 134 . 11 1 1 A 16 16 SER H H 16 8.370 8.896 -0.526 1
1 135 . 11 1 1 A 16 16 SER HA H 16 4.140 4.151 -0.011 1
1 138 . 11 1 1 A 16 16 SER C C 16 175.820 175.665 0.155 1
1 139 . 11 1 1 A 16 16 SER CA C 16 60.570 60.684 -0.114 1
1 140 . 11 1 1 A 16 16 SER CB C 16 63.030 62.895 0.135 1
1 141 . 11 1 1 A 16 16 SER N N 16 119.700 119.486 0.214 1
1 142 . 11 1 1 A 17 17 GLY H H 17 9.130 8.823 0.307 1
1 143 . 11 1 1 A 17 17 GLY HA2 H 17 3.640 3.710 -0.070 1
1 144 . 11 1 1 A 17 17 GLY HA3 H 17 4.200 3.830 0.370 1
1 145 . 11 1 1 A 17 17 GLY C C 17 175.520 174.993 0.527 1
1 146 . 11 1 1 A 17 17 GLY CA C 17 45.260 45.259 0.001 1
1 147 . 11 1 1 A 17 17 GLY N N 17 115.850 113.595 2.255 1
1 148 . 11 1 1 A 18 18 PHE H H 18 8.480 8.029 0.451 1
1 149 . 11 1 1 A 18 18 PHE HA H 18 4.740 4.544 0.196 1
1 154 . 11 1 1 A 18 18 PHE C C 18 175.430 176.513 -1.083 1
1 155 . 11 1 1 A 18 18 PHE CA C 18 58.240 58.676 -0.436 1
1 156 . 11 1 1 A 18 18 PHE CB C 18 39.010 38.536 0.474 1
1 159 . 11 1 1 A 18 18 PHE N N 18 118.550 119.852 -1.302 1
1 160 . 11 1 1 A 19 19 GLU H H 19 10.690 8.266 2.424 1
1 161 . 11 1 1 A 19 19 GLU HA H 19 3.490 4.077 -0.587 1
1 166 . 11 1 1 A 19 19 GLU C C 19 177.650 179.179 -1.529 1
1 167 . 11 1 1 A 19 19 GLU CA C 19 62.280 59.713 2.567 1
1 168 . 11 1 1 A 19 19 GLU CB C 19 28.380 29.301 -0.921 1
1 170 . 11 1 1 A 19 19 GLU N N 19 123.470 123.109 0.361 1
1 171 . 11 1 1 A 20 20 GLY H H 20 8.740 8.224 0.516 1
1 172 . 11 1 1 A 20 20 GLY HA2 H 20 3.840 3.850 -0.010 1
1 173 . 11 1 1 A 20 20 GLY HA3 H 20 3.940 3.861 0.079 1
1 174 . 11 1 1 A 20 20 GLY C C 20 176.860 175.630 1.230 1
1 175 . 11 1 1 A 20 20 GLY CA C 20 47.140 46.853 0.287 1
1 176 . 11 1 1 A 20 20 GLY N N 20 105.480 107.509 -2.029 1
1 177 . 11 1 1 A 21 21 ARG H H 21 7.690 8.212 -0.522 1
1 178 . 11 1 1 A 21 21 ARG HA H 21 4.180 4.130 0.050 1
1 185 . 11 1 1 A 21 21 ARG C C 21 179.490 178.889 0.601 1
1 186 . 11 1 1 A 21 21 ARG CA C 21 58.660 59.384 -0.724 1
1 187 . 11 1 1 A 21 21 ARG CB C 21 30.100 30.113 -0.013 1
1 190 . 11 1 1 A 21 21 ARG N N 21 123.120 122.266 0.854 1
1 191 . 11 1 1 A 22 22 VAL H H 22 8.980 8.475 0.505 1
1 192 . 11 1 1 A 22 22 VAL HA H 22 3.560 3.747 -0.187 1
1 200 . 11 1 1 A 22 22 VAL C C 22 177.320 178.257 -0.937 1
1 201 . 11 1 1 A 22 22 VAL CA C 22 66.960 66.224 0.736 1
1 202 . 11 1 1 A 22 22 VAL CB C 22 31.050 31.563 -0.513 1
1 205 . 11 1 1 A 22 22 VAL N N 22 122.760 120.090 2.670 1
1 206 . 11 1 1 A 23 23 ALA H H 23 8.280 8.253 0.027 1
1 207 . 11 1 1 A 23 23 ALA HA H 23 3.850 4.057 -0.207 1
1 211 . 11 1 1 A 23 23 ALA C C 23 179.340 179.533 -0.193 1
1 212 . 11 1 1 A 23 23 ALA CA C 23 56.260 55.215 1.045 1
1 213 . 11 1 1 A 23 23 ALA CB C 23 18.260 18.117 0.143 1
1 214 . 11 1 1 A 23 23 ALA N N 23 122.120 121.681 0.439 1
1 215 . 11 1 1 A 24 24 THR H H 24 8.020 7.653 0.367 1
1 216 . 11 1 1 A 24 24 THR HA H 24 3.920 3.953 -0.033 1
1 221 . 11 1 1 A 24 24 THR C C 24 176.940 176.275 0.665 1
1 222 . 11 1 1 A 24 24 THR CA C 24 66.820 66.427 0.393 1
1 223 . 11 1 1 A 24 24 THR CB C 24 68.930 68.550 0.380 1
1 225 . 11 1 1 A 24 24 THR N N 24 113.410 115.293 -1.883 1
1 226 . 11 1 1 A 25 25 SER H H 25 8.570 8.045 0.525 1
1 227 . 11 1 1 A 25 25 SER HA H 25 4.400 3.987 0.413 1
1 230 . 11 1 1 A 25 25 SER C C 25 177.610 176.050 1.560 1
1 231 . 11 1 1 A 25 25 SER CA C 25 61.920 62.299 -0.379 1
1 232 . 11 1 1 A 25 25 SER CB C 25 63.540 63.055 0.485 1
1 233 . 11 1 1 A 25 25 SER N N 25 118.260 118.260 0.000 1
1 234 . 11 1 1 A 26 26 LEU H H 26 9.430 8.207 1.223 1
1 235 . 11 1 1 A 26 26 LEU HA H 26 3.900 3.922 -0.022 1
1 245 . 11 1 1 A 26 26 LEU C C 26 177.710 178.644 -0.934 1
1 246 . 11 1 1 A 26 26 LEU CA C 26 58.910 58.062 0.848 1
1 247 . 11 1 1 A 26 26 LEU CB C 26 41.300 41.438 -0.138 1
1 251 . 11 1 1 A 26 26 LEU N N 26 124.120 121.070 3.050 1
1 252 . 11 1 1 A 27 27 ARG H H 27 7.790 7.610 0.180 1
1 253 . 11 1 1 A 27 27 ARG HA H 27 3.880 3.692 0.188 1
1 260 . 11 1 1 A 27 27 ARG C C 27 179.380 178.734 0.646 1
1 261 . 11 1 1 A 27 27 ARG CA C 27 60.510 59.564 0.946 1
1 262 . 11 1 1 A 27 27 ARG CB C 27 29.670 29.695 -0.025 1
1 265 . 11 1 1 A 27 27 ARG N N 27 116.710 119.282 -2.572 1
1 266 . 11 1 1 A 28 28 GLU H H 28 7.900 7.342 0.558 1
1 267 . 11 1 1 A 28 28 GLU HA H 28 4.070 3.993 0.077 1
1 272 . 11 1 1 A 28 28 GLU C C 28 179.450 179.178 0.272 1
1 273 . 11 1 1 A 28 28 GLU CA C 28 59.450 58.547 0.903 1
1 274 . 11 1 1 A 28 28 GLU CB C 28 29.610 29.776 -0.166 1
1 276 . 11 1 1 A 28 28 GLU N N 28 118.340 119.190 -0.850 1
1 277 . 11 1 1 A 29 29 HIS H H 29 8.940 7.958 0.982 1
1 278 . 11 1 1 A 29 29 HIS HA H 29 4.160 4.405 -0.245 1
1 283 . 11 1 1 A 29 29 HIS C C 29 177.750 177.760 -0.010 1
1 284 . 11 1 1 A 29 29 HIS CA C 29 61.260 58.662 2.598 1
1 285 . 11 1 1 A 29 29 HIS CB C 29 29.870 29.896 -0.026 1
1 287 . 11 1 1 A 29 29 HIS N N 29 120.440 118.490 1.950 1
1 288 . 11 1 1 A 30 30 ILE H H 30 8.580 8.784 -0.204 1
1 289 . 11 1 1 A 30 30 ILE HA H 30 3.160 3.575 -0.415 1
1 299 . 11 1 1 A 30 30 ILE C C 30 177.230 177.722 -0.492 1
1 300 . 11 1 1 A 30 30 ILE CA C 30 66.460 65.053 1.407 1
1 301 . 11 1 1 A 30 30 ILE CB C 30 38.630 37.551 1.079 1
1 305 . 11 1 1 A 30 30 ILE N N 30 121.010 119.952 1.058 1
1 306 . 11 1 1 A 31 31 LYS H H 31 7.020 8.125 -1.105 1
1 307 . 11 1 1 A 31 31 LYS HA H 31 4.170 4.033 0.137 1
1 316 . 11 1 1 A 31 31 LYS C C 31 180.570 178.974 1.596 1
1 317 . 11 1 1 A 31 31 LYS CA C 31 58.920 59.692 -0.772 1
1 318 . 11 1 1 A 31 31 LYS CB C 31 32.490 32.574 -0.084 1
1 322 . 11 1 1 A 31 31 LYS N N 31 117.400 119.166 -1.766 1
1 323 . 11 1 1 A 32 32 LEU H H 32 8.400 8.362 0.038 1
1 324 . 11 1 1 A 32 32 LEU HA H 32 3.990 4.023 -0.033 1
1 334 . 11 1 1 A 32 32 LEU C C 32 178.230 178.638 -0.408 1
1 335 . 11 1 1 A 32 32 LEU CA C 32 57.700 57.748 -0.048 1
1 336 . 11 1 1 A 32 32 LEU CB C 32 42.540 41.638 0.902 1
1 340 . 11 1 1 A 32 32 LEU N N 32 121.180 119.213 1.967 1
1 341 . 11 1 1 A 33 33 HIS H H 33 7.620 8.181 -0.561 1
1 342 . 11 1 1 A 33 33 HIS HA H 33 4.600 4.648 -0.048 1
1 347 . 11 1 1 A 33 33 HIS C C 33 177.090 174.051 3.039 1
1 348 . 11 1 1 A 33 33 HIS CA C 33 55.840 55.604 0.236 1
1 349 . 11 1 1 A 33 33 HIS CB C 33 29.330 29.845 -0.515 1
1 351 . 11 1 1 A 33 33 HIS N N 33 112.220 115.979 -3.759 1
1 352 . 11 1 1 A 34 34 ASN H H 34 8.030 8.107 -0.077 1
1 353 . 11 1 1 A 34 34 ASN HA H 34 4.890 4.345 0.545 1
1 358 . 11 1 1 A 34 34 ASN C C 34 175.910 175.500 0.410 1
1 359 . 11 1 1 A 34 34 ASN CA C 34 54.530 54.410 0.120 1
1 360 . 11 1 1 A 34 34 ASN CB C 34 37.380 36.481 0.899 1
1 361 . 11 1 1 A 34 34 ASN N N 34 117.600 114.583 3.017 1
1 363 . 11 1 1 A 35 35 MET H H 35 8.330 8.428 -0.098 1
1 364 . 11 1 1 A 35 35 MET HA H 35 4.940 4.817 0.123 1
1 372 . 11 1 1 A 35 35 MET C C 35 176.880 176.725 0.155 1
1 373 . 11 1 1 A 35 35 MET CA C 35 55.600 54.388 1.212 1
1 374 . 11 1 1 A 35 35 MET CB C 35 33.790 33.246 0.544 1
1 377 . 11 1 1 A 35 35 MET N N 35 116.190 116.216 -0.026 1
1 378 . 11 1 1 A 36 36 GLU H H 36 9.730 8.167 1.563 1
1 379 . 11 1 1 A 36 36 GLU HA H 36 3.850 4.139 -0.289 1
1 384 . 11 1 1 A 36 36 GLU C C 36 178.290 179.207 -0.917 1
1 385 . 11 1 1 A 36 36 GLU CA C 36 61.280 59.596 1.684 1
1 386 . 11 1 1 A 36 36 GLU CB C 36 29.270 29.105 0.165 1
1 388 . 11 1 1 A 36 36 GLU N N 36 121.630 120.888 0.742 1
1 389 . 11 1 1 A 37 37 ASP H H 37 8.850 8.137 0.713 1
1 390 . 11 1 1 A 37 37 ASP HA H 37 4.470 4.428 0.042 1
1 393 . 11 1 1 A 37 37 ASP C C 37 177.190 178.962 -1.772 1
1 394 . 11 1 1 A 37 37 ASP CA C 37 56.140 57.423 -1.283 1
1 395 . 11 1 1 A 37 37 ASP CB C 37 40.050 41.076 -1.026 1
1 396 . 11 1 1 A 37 37 ASP N N 37 114.390 119.892 -5.502 1
1 397 . 11 1 1 A 38 38 LEU H H 38 7.880 7.827 0.053 1
1 398 . 11 1 1 A 38 38 LEU HA H 38 4.290 4.050 0.240 1
1 408 . 11 1 1 A 38 38 LEU C C 38 175.090 177.571 -2.481 1
1 409 . 11 1 1 A 38 38 LEU CA C 38 54.670 57.742 -3.072 1
1 410 . 11 1 1 A 38 38 LEU CB C 38 42.940 41.952 0.988 1
1 414 . 11 1 1 A 38 38 LEU N N 38 116.550 119.269 -2.719 1
1 415 . 11 1 1 A 39 39 PHE H H 39 7.500 7.882 -0.382 1
1 416 . 11 1 1 A 39 39 PHE HA H 39 4.970 4.625 0.345 1
1 424 . 11 1 1 A 39 39 PHE C C 39 175.380 175.561 -0.181 1
1 425 . 11 1 1 A 39 39 PHE CA C 39 57.580 58.586 -1.006 1
1 426 . 11 1 1 A 39 39 PHE CB C 39 44.990 39.547 5.443 1
1 432 . 11 1 1 A 39 39 PHE N N 39 115.370 116.865 -1.495 1
1 433 . 11 1 1 A 40 40 GLY H H 40 8.680 8.445 0.235 1
1 434 . 11 1 1 A 40 40 GLY HA2 H 40 3.370 3.998 -0.628 1
1 435 . 11 1 1 A 40 40 GLY HA3 H 40 4.550 4.074 0.476 1
1 436 . 11 1 1 A 40 40 GLY C C 40 173.090 173.749 -0.659 1
1 437 . 11 1 1 A 40 40 GLY CA C 40 44.180 46.331 -2.151 1
1 438 . 11 1 1 A 40 40 GLY N N 40 110.930 111.725 -0.795 1
1 439 . 11 1 1 A 41 41 GLU H H 41 8.320 7.746 0.574 1
1 440 . 11 1 1 A 41 41 GLU HA H 41 4.280 4.845 -0.565 1
1 445 . 11 1 1 A 41 41 GLU C C 41 173.900 175.104 -1.204 1
1 446 . 11 1 1 A 41 41 GLU CA C 41 56.900 54.537 2.363 1
1 447 . 11 1 1 A 41 41 GLU CB C 41 32.110 34.504 -2.394 1
1 449 . 11 1 1 A 41 41 GLU N N 41 126.730 117.306 9.424 1
1 450 . 11 1 1 A 42 42 VAL H H 42 8.100 8.666 -0.566 1
1 451 . 11 1 1 A 42 42 VAL HA H 42 5.160 5.166 -0.006 1
1 459 . 11 1 1 A 42 42 VAL C C 42 176.340 175.072 1.268 1
1 460 . 11 1 1 A 42 42 VAL CA C 42 61.200 60.755 0.445 1
1 461 . 11 1 1 A 42 42 VAL CB C 42 34.770 34.895 -0.125 1
1 464 . 11 1 1 A 42 42 VAL N N 42 119.360 121.526 -2.166 1
1 465 . 11 1 1 A 43 43 MET H H 43 9.870 9.142 0.728 1
1 466 . 11 1 1 A 43 43 MET HA H 43 5.070 5.377 -0.307 1
1 474 . 11 1 1 A 43 43 MET C C 43 173.890 175.569 -1.679 1
1 475 . 11 1 1 A 43 43 MET CA C 43 54.740 54.045 0.695 1
1 476 . 11 1 1 A 43 43 MET CB C 43 37.500 35.976 1.524 1
1 479 . 11 1 1 A 43 43 MET N N 43 125.720 124.443 1.277 1
1 480 . 11 1 1 A 44 44 VAL H H 44 8.800 8.856 -0.056 1
1 481 . 11 1 1 A 44 44 VAL HA H 44 4.720 4.746 -0.026 1
1 489 . 11 1 1 A 44 44 VAL CA C 44 59.090 59.114 -0.024 1
1 490 . 11 1 1 A 44 44 VAL CB C 44 33.710 33.271 0.439 1
1 493 . 11 1 1 A 44 44 VAL N N 44 122.340 123.990 -1.650 1
1 494 . 11 1 1 A 45 45 PRO HA H 45 4.480 4.287 0.193 1
1 501 . 11 1 1 A 45 45 PRO C C 45 177.080 177.432 -0.352 1
1 502 . 11 1 1 A 45 45 PRO CA C 45 63.240 64.388 -1.148 1
1 503 . 11 1 1 A 45 45 PRO CB C 45 32.170 31.729 0.441 1
1 506 . 11 1 1 A 46 46 THR H H 46 8.200 7.622 0.578 1
1 507 . 11 1 1 A 46 46 THR HA H 46 4.290 4.384 -0.094 1
1 512 . 11 1 1 A 46 46 THR C C 46 174.600 174.156 0.444 1
1 513 . 11 1 1 A 46 46 THR CA C 46 62.100 62.886 -0.786 1
1 514 . 11 1 1 A 46 46 THR CB C 46 69.990 69.311 0.679 1
1 516 . 11 1 1 A 46 46 THR N N 46 113.410 110.139 3.271 1
1 517 . 11 1 1 A 47 47 GLU H H 47 8.380 7.708 0.672 1
1 518 . 11 1 1 A 47 47 GLU HA H 47 4.400 4.115 0.285 1
1 521 . 11 1 1 A 47 47 GLU C C 47 175.970 177.809 -1.839 1
1 522 . 11 1 1 A 47 47 GLU CA C 47 55.200 58.615 -3.415 1
1 523 . 11 1 1 A 47 47 GLU CB C 47 32.300 28.461 3.839 1
1 524 . 11 1 1 A 47 47 GLU N N 47 122.830 119.781 3.049 1
1 525 . 11 1 1 A 48 48 GLU H H 48 8.400 8.760 -0.360 1
1 526 . 11 1 1 A 48 48 GLU HA H 48 4.280 4.089 0.191 1
1 531 . 11 1 1 A 48 48 GLU C C 48 175.750 176.675 -0.925 1
1 532 . 11 1 1 A 48 48 GLU CA C 48 55.190 59.186 -3.996 1
1 533 . 11 1 1 A 48 48 GLU CB C 48 31.980 30.322 1.658 1
1 535 . 11 1 1 A 48 48 GLU N N 48 121.950 121.534 0.416 1
1 536 . 11 1 1 A 49 49 VAL H H 49 8.240 8.162 0.078 1
1 537 . 11 1 1 A 49 49 VAL HA H 49 4.170 4.448 -0.278 1
1 542 . 11 1 1 A 49 49 VAL C C 49 174.610 176.044 -1.434 1
1 543 . 11 1 1 A 49 49 VAL CA C 49 62.280 60.598 1.682 1
1 544 . 11 1 1 A 49 49 VAL CB C 49 32.930 34.581 -1.651 1
1 546 . 11 1 1 A 49 49 VAL N N 49 123.990 119.848 4.142 1
1 547 . 11 1 1 A 50 50 VAL H H 50 8.230 8.393 -0.163 1
1 548 . 11 1 1 A 50 50 VAL HA H 50 4.220 4.055 0.165 1
1 553 . 11 1 1 A 50 50 VAL C C 50 175.770 175.070 0.700 1
1 554 . 11 1 1 A 50 50 VAL CA C 50 62.170 64.765 -2.595 1
1 555 . 11 1 1 A 50 50 VAL CB C 50 33.110 32.240 0.870 1
1 557 . 11 1 1 A 50 50 VAL N N 50 123.960 126.486 -2.526 1
1 558 . 11 1 1 A 51 51 GLU H H 51 8.570 7.921 0.649 1
1 559 . 11 1 1 A 51 51 GLU HA H 51 4.380 4.792 -0.412 1
1 564 . 11 1 1 A 51 51 GLU C C 51 175.920 176.236 -0.316 1
1 565 . 11 1 1 A 51 51 GLU CA C 51 56.050 55.427 0.623 1
1 566 . 11 1 1 A 51 51 GLU CB C 51 31.080 32.409 -1.329 1
1 568 . 11 1 1 A 51 51 GLU N N 51 125.070 120.192 4.878 1
1 569 . 11 1 1 A 52 52 ILE H H 52 8.320 8.920 -0.600 1
1 570 . 11 1 1 A 52 52 ILE HA H 52 4.290 3.711 0.579 1
1 580 . 11 1 1 A 52 52 ILE C C 52 176.330 177.473 -1.143 1
1 581 . 11 1 1 A 52 52 ILE CA C 52 60.940 64.773 -3.833 1
1 582 . 11 1 1 A 52 52 ILE CB C 52 38.510 37.402 1.108 1
1 586 . 11 1 1 A 52 52 ILE N N 52 122.760 127.030 -4.270 1
1 587 . 11 1 1 A 53 53 ARG H H 53 8.500 7.744 0.756 1
1 588 . 11 1 1 A 53 53 ARG HA H 53 4.430 4.071 0.359 1
1 595 . 11 1 1 A 53 53 ARG C C 53 176.950 177.093 -0.143 1
1 596 . 11 1 1 A 53 53 ARG CA C 53 56.150 57.413 -1.263 1
1 597 . 11 1 1 A 53 53 ARG CB C 53 30.200 30.417 -0.217 1
1 600 . 11 1 1 A 53 53 ARG N N 53 125.250 119.235 6.015 1
1 601 . 11 1 1 A 54 54 GLY H H 54 8.760 8.014 0.746 1
1 602 . 11 1 1 A 54 54 GLY HA2 H 54 3.920 4.029 -0.109 1
1 603 . 11 1 1 A 54 54 GLY HA3 H 54 4.010 4.033 -0.023 1
1 604 . 11 1 1 A 54 54 GLY C C 54 175.110 174.693 0.417 1
1 605 . 11 1 1 A 54 54 GLY CA C 54 46.030 45.171 0.859 1
1 606 . 11 1 1 A 54 54 GLY N N 54 112.510 107.752 4.758 1
1 607 . 11 1 1 A 55 55 GLY H H 55 8.350 8.532 -0.182 1
1 608 . 11 1 1 A 55 55 GLY HA2 H 55 3.980 3.979 0.001 1
1 609 . 11 1 1 A 55 55 GLY HA3 H 55 3.980 3.983 -0.003 1
1 610 . 11 1 1 A 55 55 GLY C C 55 173.920 175.393 -1.473 1
1 611 . 11 1 1 A 55 55 GLY CA C 55 45.200 45.930 -0.730 1
1 612 . 11 1 1 A 55 55 GLY N N 55 107.940 108.204 -0.264 1
1 613 . 11 1 1 A 56 56 GLN H H 56 8.100 8.384 -0.284 1
1 614 . 11 1 1 A 56 56 GLN HA H 56 4.420 3.967 0.453 1
1 619 . 11 1 1 A 56 56 GLN C C 56 175.570 178.752 -3.182 1
1 620 . 11 1 1 A 56 56 GLN CA C 56 55.420 58.672 -3.252 1
1 621 . 11 1 1 A 56 56 GLN CB C 56 30.100 28.454 1.646 1
1 623 . 11 1 1 A 56 56 GLN N N 56 119.350 120.375 -1.025 1
1 624 . 11 1 1 A 57 57 ARG H H 57 8.520 7.853 0.667 1
1 625 . 11 1 1 A 57 57 ARG HA H 57 4.400 4.113 0.287 1
1 632 . 11 1 1 A 57 57 ARG C C 57 176.210 176.053 0.157 1
1 633 . 11 1 1 A 57 57 ARG CA C 57 56.440 59.063 -2.623 1
1 634 . 11 1 1 A 57 57 ARG CB C 57 30.930 30.384 0.546 1
1 637 . 11 1 1 A 57 57 ARG N N 57 122.610 118.273 4.337 1
1 638 . 11 1 1 A 58 58 ARG H H 58 8.630 7.932 0.698 1
1 639 . 11 1 1 A 58 58 ARG HA H 58 4.430 4.637 -0.207 1
1 646 . 11 1 1 A 58 58 ARG C C 58 175.950 176.184 -0.234 1
1 647 . 11 1 1 A 58 58 ARG CA C 58 55.450 54.554 0.896 1
1 648 . 11 1 1 A 58 58 ARG CB C 58 31.300 33.359 -2.059 1
1 651 . 11 1 1 A 58 58 ARG N N 58 123.320 117.600 5.720 1
1 652 . 11 1 1 A 59 59 LYS H H 59 8.560 9.059 -0.499 1
1 653 . 11 1 1 A 59 59 LYS HA H 59 4.410 3.975 0.435 1
1 662 . 11 1 1 A 59 59 LYS C C 59 176.590 176.465 0.125 1
1 663 . 11 1 1 A 59 59 LYS CA C 59 56.720 57.031 -0.311 1
1 664 . 11 1 1 A 59 59 LYS CB C 59 33.150 30.900 2.250 1
1 668 . 11 1 1 A 59 59 LYS N N 59 123.380 122.901 0.479 1
1 669 . 11 1 1 A 60 60 SER H H 60 8.450 7.845 0.605 1
1 670 . 11 1 1 A 60 60 SER HA H 60 4.480 4.129 0.351 1
1 673 . 11 1 1 A 60 60 SER C C 60 174.280 175.135 -0.855 1
1 674 . 11 1 1 A 60 60 SER CA C 60 58.140 61.914 -3.774 1
1 675 . 11 1 1 A 60 60 SER CB C 60 64.160 63.191 0.969 1
1 676 . 11 1 1 A 60 60 SER N N 60 117.320 114.962 2.358 1
1 677 . 11 1 1 A 61 61 GLU H H 61 8.550 7.749 0.801 1
1 678 . 11 1 1 A 61 61 GLU HA H 61 4.400 4.235 0.165 1
1 683 . 11 1 1 A 61 61 GLU C C 61 176.150 175.841 0.309 1
1 684 . 11 1 1 A 61 61 GLU CA C 61 56.300 56.656 -0.356 1
1 685 . 11 1 1 A 61 61 GLU CB C 61 30.790 30.333 0.457 1
1 687 . 11 1 1 A 61 61 GLU N N 61 122.810 120.901 1.909 1
1 688 . 11 1 1 A 62 62 ARG H H 62 8.310 8.629 -0.319 1
1 689 . 11 1 1 A 62 62 ARG HA H 62 4.340 4.569 -0.229 1
1 692 . 11 1 1 A 62 62 ARG C C 62 176.140 176.458 -0.318 1
1 693 . 11 1 1 A 62 62 ARG CA C 62 56.230 54.483 1.747 1
1 694 . 11 1 1 A 62 62 ARG CB C 62 30.780 32.624 -1.844 1
1 695 . 11 1 1 A 62 62 ARG N N 62 122.080 124.985 -2.905 1
1 696 . 11 1 1 A 63 63 LYS H H 63 8.470 8.276 0.194 1
1 697 . 11 1 1 A 63 63 LYS HA H 63 4.300 3.958 0.342 1
1 700 . 11 1 1 A 63 63 LYS C C 63 175.490 176.678 -1.188 1
1 701 . 11 1 1 A 63 63 LYS CA C 63 56.200 59.199 -2.999 1
1 702 . 11 1 1 A 63 63 LYS CB C 63 30.730 31.935 -1.205 1
1 703 . 11 1 1 A 63 63 LYS N N 63 123.450 124.070 -0.620 1
1 704 . 11 1 1 A 64 64 PHE H H 64 8.200 7.485 0.715 1
1 705 . 11 1 1 A 64 64 PHE HA H 64 4.450 4.898 -0.448 1
1 710 . 11 1 1 A 64 64 PHE C C 64 174.250 174.880 -0.630 1
1 711 . 11 1 1 A 64 64 PHE CA C 64 57.430 57.239 0.191 1
1 712 . 11 1 1 A 64 64 PHE CB C 64 40.330 40.797 -0.467 1
1 715 . 11 1 1 A 64 64 PHE N N 64 121.740 116.530 5.210 1
1 716 . 11 1 1 A 65 65 PHE H H 65 8.130 8.176 -0.046 1
1 717 . 11 1 1 A 65 65 PHE HA H 65 4.440 5.158 -0.718 1
1 725 . 11 1 1 A 65 65 PHE CA C 65 55.650 54.565 1.085 1
1 726 . 11 1 1 A 65 65 PHE CB C 65 38.900 39.157 -0.257 1
1 731 . 11 1 1 A 65 65 PHE N N 65 120.910 118.098 2.812 1
1 732 . 11 1 1 A 66 66 PRO C C 66 176.780 177.339 -0.559 1
1 733 . 11 1 1 A 67 67 GLY H H 67 9.970 8.981 0.989 1
1 734 . 11 1 1 A 67 67 GLY HA2 H 67 3.820 3.986 -0.166 1
1 735 . 11 1 1 A 67 67 GLY HA3 H 67 4.400 4.020 0.380 1
1 736 . 11 1 1 A 67 67 GLY C C 67 173.670 173.409 0.261 1
1 737 . 11 1 1 A 67 67 GLY CA C 67 45.900 45.281 0.619 1
1 738 . 11 1 1 A 67 67 GLY N N 67 111.550 111.327 0.223 1
1 739 . 11 1 1 A 68 68 TYR H H 68 7.650 8.236 -0.586 1
1 740 . 11 1 1 A 68 68 TYR HA H 68 5.000 5.090 -0.090 1
1 747 . 11 1 1 A 68 68 TYR C C 68 175.220 174.964 0.256 1
1 748 . 11 1 1 A 68 68 TYR CA C 68 57.940 56.896 1.044 1
1 753 . 11 1 1 A 68 68 TYR N N 68 118.800 119.060 -0.260 1
1 754 . 11 1 1 A 69 69 VAL H H 69 9.090 8.932 0.158 1
1 755 . 11 1 1 A 69 69 VAL HA H 69 4.330 4.825 -0.495 1
1 763 . 11 1 1 A 69 69 VAL C C 69 174.250 174.909 -0.659 1
1 764 . 11 1 1 A 69 69 VAL CA C 69 62.120 60.326 1.794 1
1 765 . 11 1 1 A 69 69 VAL CB C 69 35.240 35.839 -0.599 1
1 768 . 11 1 1 A 69 69 VAL N N 69 119.300 122.991 -3.691 1
1 769 . 11 1 1 A 70 70 LEU H H 70 9.190 8.958 0.232 1
1 770 . 11 1 1 A 70 70 LEU HA H 70 5.460 5.456 0.004 1
1 780 . 11 1 1 A 70 70 LEU C C 70 176.130 176.233 -0.103 1
1 781 . 11 1 1 A 70 70 LEU CA C 70 54.120 53.115 1.005 1
1 782 . 11 1 1 A 70 70 LEU CB C 70 43.330 43.011 0.319 1
1 786 . 11 1 1 A 70 70 LEU N N 70 126.710 126.959 -0.249 1
1 787 . 11 1 1 A 71 71 VAL H H 71 9.350 9.700 -0.350 1
1 788 . 11 1 1 A 71 71 VAL HA H 71 5.040 4.846 0.194 1
1 796 . 11 1 1 A 71 71 VAL C C 71 173.670 174.376 -0.706 1
1 797 . 11 1 1 A 71 71 VAL CA C 71 61.090 61.081 0.009 1
1 798 . 11 1 1 A 71 71 VAL CB C 71 35.800 35.894 -0.094 1
1 801 . 11 1 1 A 71 71 VAL N N 71 121.920 124.534 -2.614 1
1 802 . 11 1 1 A 72 72 GLN H H 72 8.390 9.087 -0.697 1
1 803 . 11 1 1 A 72 72 GLN HA H 72 4.610 4.343 0.267 1
1 810 . 11 1 1 A 72 72 GLN C C 72 175.920 174.432 1.488 1
1 811 . 11 1 1 A 72 72 GLN CA C 72 53.810 54.895 -1.085 1
1 812 . 11 1 1 A 72 72 GLN CB C 72 28.850 28.618 0.232 1
1 814 . 11 1 1 A 72 72 GLN N N 72 130.760 127.814 2.946 1
1 816 . 11 1 1 A 73 73 MET H H 73 9.750 8.838 0.912 1
1 817 . 11 1 1 A 73 73 MET HA H 73 5.060 5.154 -0.094 1
1 825 . 11 1 1 A 73 73 MET C C 73 175.500 174.134 1.366 1
1 826 . 11 1 1 A 73 73 MET CA C 73 55.520 54.745 0.775 1
1 827 . 11 1 1 A 73 73 MET CB C 73 35.350 35.503 -0.153 1
1 830 . 11 1 1 A 73 73 MET N N 73 121.070 124.521 -3.451 1
1 831 . 11 1 1 A 74 74 VAL H H 74 8.530 8.493 0.037 1
1 832 . 11 1 1 A 74 74 VAL HA H 74 3.970 4.888 -0.918 1
1 840 . 11 1 1 A 74 74 VAL C C 74 174.900 175.241 -0.341 1
1 841 . 11 1 1 A 74 74 VAL CA C 74 62.150 59.719 2.431 1
1 842 . 11 1 1 A 74 74 VAL CB C 74 32.480 33.496 -1.016 1
1 845 . 11 1 1 A 74 74 VAL N N 74 124.120 118.492 5.628 1
1 846 . 11 1 1 A 75 75 MET H H 75 8.600 8.596 0.004 1
1 847 . 11 1 1 A 75 75 MET HA H 75 4.360 4.735 -0.375 1
1 855 . 11 1 1 A 75 75 MET C C 75 173.480 175.798 -2.318 1
1 856 . 11 1 1 A 75 75 MET CA C 75 53.830 54.147 -0.317 1
1 857 . 11 1 1 A 75 75 MET CB C 75 29.960 32.315 -2.355 1
1 860 . 11 1 1 A 75 75 MET N N 75 128.250 123.058 5.192 1
1 861 . 11 1 1 A 76 76 ASN H H 76 8.410 8.690 -0.280 1
1 862 . 11 1 1 A 76 76 ASN HA H 76 4.540 5.112 -0.572 1
1 867 . 11 1 1 A 76 76 ASN C C 76 173.950 174.606 -0.656 1
1 868 . 11 1 1 A 76 76 ASN CA C 76 51.720 51.819 -0.099 1
1 869 . 11 1 1 A 76 76 ASN CB C 76 38.430 39.258 -0.828 1
1 870 . 11 1 1 A 76 76 ASN N N 76 127.500 123.009 4.491 1
1 872 . 11 1 1 A 77 77 ASP H H 77 8.470 8.614 -0.144 1
1 873 . 11 1 1 A 77 77 ASP HA H 77 4.410 4.967 -0.557 1
1 876 . 11 1 1 A 77 77 ASP C C 77 178.530 176.997 1.533 1
1 877 . 11 1 1 A 77 77 ASP CA C 77 58.730 53.073 5.657 1
1 878 . 11 1 1 A 77 77 ASP CB C 77 40.940 41.384 -0.444 1
1 879 . 11 1 1 A 77 77 ASP N N 77 117.090 118.211 -1.121 1
1 880 . 11 1 1 A 78 78 ALA H H 78 8.160 7.985 0.175 1
1 881 . 11 1 1 A 78 78 ALA HA H 78 4.350 4.724 -0.374 1
1 885 . 11 1 1 A 78 78 ALA C C 78 181.250 178.549 2.701 1
1 886 . 11 1 1 A 78 78 ALA CA C 78 55.190 52.966 2.224 1
1 887 . 11 1 1 A 78 78 ALA CB C 78 18.260 21.226 -2.966 1
1 888 . 11 1 1 A 78 78 ALA N N 78 122.500 121.920 0.580 1
1 889 . 11 1 1 A 79 79 SER H H 79 9.320 8.625 0.695 1
1 890 . 11 1 1 A 79 79 SER HA H 79 4.290 4.347 -0.057 1
1 893 . 11 1 1 A 79 79 SER C C 79 176.570 176.464 0.106 1
1 894 . 11 1 1 A 79 79 SER CA C 79 61.080 61.914 -0.834 1
1 895 . 11 1 1 A 79 79 SER CB C 79 62.200 63.102 -0.902 1
1 896 . 11 1 1 A 79 79 SER N N 79 119.280 115.084 4.196 1
1 897 . 11 1 1 A 80 80 TRP H H 80 8.900 8.084 0.816 1
1 898 . 11 1 1 A 80 80 TRP HA H 80 4.020 4.364 -0.344 1
1 907 . 11 1 1 A 80 80 TRP C C 80 178.210 178.415 -0.205 1
1 908 . 11 1 1 A 80 80 TRP CA C 80 62.490 61.409 1.081 1
1 909 . 11 1 1 A 80 80 TRP CB C 80 29.800 29.536 0.264 1
1 915 . 11 1 1 A 80 80 TRP N N 80 125.870 124.110 1.760 1
1 917 . 11 1 1 A 81 81 HIS H H 81 8.190 8.195 -0.005 1
1 918 . 11 1 1 A 81 81 HIS HA H 81 3.930 4.255 -0.325 1
1 923 . 11 1 1 A 81 81 HIS C C 81 177.740 177.821 -0.081 1
1 924 . 11 1 1 A 81 81 HIS CA C 81 61.020 59.850 1.170 1
1 925 . 11 1 1 A 81 81 HIS CB C 81 28.910 30.340 -1.430 1
1 927 . 11 1 1 A 81 81 HIS N N 81 114.080 117.670 -3.590 1
1 928 . 11 1 1 A 82 82 LEU H H 82 8.080 7.790 0.290 1
1 929 . 11 1 1 A 82 82 LEU HA H 82 3.900 3.802 0.098 1
1 939 . 11 1 1 A 82 82 LEU C C 82 180.330 178.467 1.863 1
1 940 . 11 1 1 A 82 82 LEU CA C 82 58.590 58.297 0.293 1
1 941 . 11 1 1 A 82 82 LEU CB C 82 41.350 41.472 -0.122 1
1 945 . 11 1 1 A 82 82 LEU N N 82 121.320 121.436 -0.116 1
1 946 . 11 1 1 A 83 83 VAL H H 83 8.000 8.189 -0.189 1
1 947 . 11 1 1 A 83 83 VAL HA H 83 3.210 3.487 -0.277 1
1 955 . 11 1 1 A 83 83 VAL C C 83 177.060 178.188 -1.128 1
1 956 . 11 1 1 A 83 83 VAL CA C 83 67.430 66.363 1.067 1
1 957 . 11 1 1 A 83 83 VAL CB C 83 31.680 31.515 0.165 1
1 960 . 11 1 1 A 83 83 VAL N N 83 118.850 118.763 0.087 1
1 961 . 11 1 1 A 84 84 ARG H H 84 7.540 7.611 -0.071 1
1 962 . 11 1 1 A 84 84 ARG HA H 84 3.590 3.693 -0.103 1
1 969 . 11 1 1 A 84 84 ARG C C 84 177.240 178.468 -1.228 1
1 970 . 11 1 1 A 84 84 ARG CA C 84 56.050 59.639 -3.589 1
1 971 . 11 1 1 A 84 84 ARG CB C 84 28.190 29.578 -1.388 1
1 974 . 11 1 1 A 84 84 ARG N N 84 111.460 120.740 -9.280 1
1 975 . 11 1 1 A 85 85 SER H H 85 7.530 7.900 -0.370 1
1 976 . 11 1 1 A 85 85 SER HA H 85 4.280 4.136 0.144 1
1 979 . 11 1 1 A 85 85 SER C C 85 173.930 174.609 -0.679 1
1 980 . 11 1 1 A 85 85 SER CA C 85 59.220 61.154 -1.934 1
1 981 . 11 1 1 A 85 85 SER CB C 85 63.830 62.918 0.912 1
1 982 . 11 1 1 A 85 85 SER N N 85 113.660 114.344 -0.684 1
1 983 . 11 1 1 A 86 86 VAL H H 86 7.230 7.369 -0.139 1
1 984 . 11 1 1 A 86 86 VAL HA H 86 3.480 3.796 -0.316 1
1 992 . 11 1 1 A 86 86 VAL CA C 86 61.300 61.093 0.207 1
1 993 . 11 1 1 A 86 86 VAL CB C 86 31.780 32.346 -0.566 1
1 996 . 11 1 1 A 86 86 VAL N N 86 128.120 121.807 6.313 1
1 997 . 11 1 1 A 87 87 PRO HA H 87 4.140 4.405 -0.265 1
1 1004 . 11 1 1 A 87 87 PRO C C 87 176.400 176.710 -0.310 1
1 1005 . 11 1 1 A 87 87 PRO CA C 87 64.100 63.045 1.055 1
1 1006 . 11 1 1 A 87 87 PRO CB C 87 31.710 32.414 -0.704 1
1 1009 . 11 1 1 A 88 88 ARG H H 88 8.320 8.740 -0.420 1
1 1010 . 11 1 1 A 88 88 ARG HA H 88 3.030 3.837 -0.807 1
1 1017 . 11 1 1 A 88 88 ARG C C 88 174.630 174.636 -0.006 1
1 1018 . 11 1 1 A 88 88 ARG CA C 88 57.620 57.512 0.108 1
1 1019 . 11 1 1 A 88 88 ARG CB C 88 26.960 28.051 -1.091 1
1 1022 . 11 1 1 A 88 88 ARG N N 88 111.360 116.027 -4.667 1
1 1023 . 11 1 1 A 89 89 VAL H H 89 7.390 7.910 -0.520 1
1 1024 . 11 1 1 A 89 89 VAL HA H 89 3.910 4.391 -0.481 1
1 1032 . 11 1 1 A 89 89 VAL C C 89 177.370 175.719 1.651 1
1 1033 . 11 1 1 A 89 89 VAL CA C 89 64.170 59.649 4.521 1
1 1034 . 11 1 1 A 89 89 VAL CB C 89 32.070 34.035 -1.965 1
1 1037 . 11 1 1 A 89 89 VAL N N 89 117.900 118.545 -0.645 1
1 1038 . 11 1 1 A 90 90 MET H H 90 9.290 8.286 1.004 1
1 1039 . 11 1 1 A 90 90 MET HA H 90 4.340 4.084 0.256 1
1 1047 . 11 1 1 A 90 90 MET C C 90 175.800 176.103 -0.303 1
1 1048 . 11 1 1 A 90 90 MET CA C 90 56.440 57.055 -0.615 1
1 1049 . 11 1 1 A 90 90 MET CB C 90 34.160 33.444 0.716 1
1 1052 . 11 1 1 A 90 90 MET N N 90 128.200 127.309 0.891 1
1 1053 . 11 1 1 A 91 91 GLY H H 91 7.130 7.194 -0.064 1
1 1054 . 11 1 1 A 91 91 GLY HA2 H 91 3.340 3.915 -0.575 1
1 1055 . 11 1 1 A 91 91 GLY HA3 H 91 4.410 4.011 0.399 1
1 1056 . 11 1 1 A 91 91 GLY C C 91 170.920 171.226 -0.306 1
1 1057 . 11 1 1 A 91 91 GLY CA C 91 44.440 46.065 -1.625 1
1 1058 . 11 1 1 A 91 91 GLY N N 91 104.320 103.356 0.964 1
1 1059 . 11 1 1 A 92 92 PHE H H 92 8.790 8.444 0.346 1
1 1060 . 11 1 1 A 92 92 PHE HA H 92 5.270 5.209 0.061 1
1 1068 . 11 1 1 A 92 92 PHE C C 92 176.230 175.033 1.197 1
1 1069 . 11 1 1 A 92 92 PHE CA C 92 57.480 56.755 0.725 1
1 1070 . 11 1 1 A 92 92 PHE CB C 92 42.190 43.329 -1.139 1
1 1075 . 11 1 1 A 92 92 PHE N N 92 118.770 119.346 -0.576 1
1 1076 . 11 1 1 A 93 93 ILE H H 93 8.800 8.276 0.524 1
1 1077 . 11 1 1 A 93 93 ILE HA H 93 4.310 5.084 -0.774 1
1 1087 . 11 1 1 A 93 93 ILE C C 93 176.380 176.091 0.289 1
1 1088 . 11 1 1 A 93 93 ILE CA C 93 60.480 59.798 0.682 1
1 1089 . 11 1 1 A 93 93 ILE CB C 93 38.010 40.845 -2.835 1
1 1093 . 11 1 1 A 93 93 ILE N N 93 122.300 121.717 0.583 1
1 1094 . 11 1 1 A 94 94 GLY H H 94 8.640 8.437 0.203 1
1 1095 . 11 1 1 A 94 94 GLY HA2 H 94 3.830 4.264 -0.434 1
1 1096 . 11 1 1 A 94 94 GLY HA3 H 94 4.600 4.276 0.324 1
1 1097 . 11 1 1 A 94 94 GLY C C 94 175.080 174.808 0.272 1
1 1098 . 11 1 1 A 94 94 GLY CA C 94 44.530 45.945 -1.415 1
1 1099 . 11 1 1 A 94 94 GLY N N 94 116.550 113.542 3.008 1
1 1100 . 11 1 1 A 95 95 GLY H H 95 8.900 8.765 0.135 1
1 1101 . 11 1 1 A 95 95 GLY HA2 H 95 3.970 3.846 0.124 1
1 1102 . 11 1 1 A 95 95 GLY HA3 H 95 4.370 3.853 0.517 1
1 1103 . 11 1 1 A 95 95 GLY C C 95 174.560 174.074 0.486 1
1 1104 . 11 1 1 A 95 95 GLY CA C 95 45.640 47.337 -1.697 1
1 1105 . 11 1 1 A 95 95 GLY N N 95 112.960 109.023 3.937 1
1 1106 . 11 1 1 A 96 96 THR H H 96 7.830 7.740 0.090 1
1 1107 . 11 1 1 A 96 96 THR HA H 96 4.720 4.779 -0.059 1
1 1112 . 11 1 1 A 96 96 THR C C 96 176.260 174.191 2.069 1
1 1113 . 11 1 1 A 96 96 THR CA C 96 60.360 59.818 0.542 1
1 1114 . 11 1 1 A 96 96 THR CB C 96 70.960 72.003 -1.043 1
1 1116 . 11 1 1 A 96 96 THR N N 96 113.350 109.790 3.560 1
1 1117 . 11 1 1 A 97 97 SER H H 97 8.850 8.795 0.055 1
1 1118 . 11 1 1 A 97 97 SER HA H 97 4.310 4.710 -0.400 1
1 1121 . 11 1 1 A 97 97 SER C C 97 175.570 174.662 0.908 1
1 1122 . 11 1 1 A 97 97 SER CA C 97 60.850 58.944 1.906 1
1 1123 . 11 1 1 A 97 97 SER CB C 97 63.000 63.495 -0.495 1
1 1124 . 11 1 1 A 97 97 SER N N 97 116.420 116.533 -0.113 1
1 1125 . 11 1 1 A 98 98 ASP H H 98 8.360 8.491 -0.131 1
1 1126 . 11 1 1 A 98 98 ASP HA H 98 4.310 5.129 -0.819 1
1 1129 . 11 1 1 A 98 98 ASP C C 98 175.380 175.534 -0.154 1
1 1130 . 11 1 1 A 98 98 ASP CA C 98 54.190 55.156 -0.966 1
1 1131 . 11 1 1 A 98 98 ASP CB C 98 40.740 43.358 -2.618 1
1 1132 . 11 1 1 A 98 98 ASP N N 98 116.320 120.698 -4.378 1
1 1133 . 11 1 1 A 99 99 ARG H H 99 7.450 7.525 -0.075 1
1 1134 . 11 1 1 A 99 99 ARG HA H 99 4.350 4.690 -0.340 1
1 1141 . 11 1 1 A 99 99 ARG CA C 99 52.920 53.556 -0.636 1
1 1142 . 11 1 1 A 99 99 ARG CB C 99 30.340 30.754 -0.414 1
1 1145 . 11 1 1 A 99 99 ARG N N 99 119.960 117.912 2.048 1
1 1146 . 11 1 1 A 100 100 PRO HA H 100 4.750 4.442 0.308 1
1 1153 . 11 1 1 A 100 100 PRO C C 100 175.220 177.103 -1.883 1
1 1154 . 11 1 1 A 100 100 PRO CA C 100 62.680 62.624 0.056 1
1 1155 . 11 1 1 A 100 100 PRO CB C 100 32.820 31.494 1.326 1
1 1158 . 11 1 1 A 101 101 ALA H H 101 7.210 8.334 -1.124 1
1 1159 . 11 1 1 A 101 101 ALA HA H 101 5.030 4.619 0.411 1
1 1163 . 11 1 1 A 101 101 ALA CA C 101 48.570 50.350 -1.780 1
1 1164 . 11 1 1 A 101 101 ALA CB C 101 19.660 17.372 2.288 1
1 1165 . 11 1 1 A 101 101 ALA N N 101 124.490 125.162 -0.672 1
1 1166 . 11 1 1 A 102 102 PRO HA H 102 4.440 4.232 0.208 1
1 1173 . 11 1 1 A 102 102 PRO C C 102 177.200 176.354 0.846 1
1 1174 . 11 1 1 A 102 102 PRO CA C 102 62.190 62.590 -0.400 1
1 1175 . 11 1 1 A 102 102 PRO CB C 102 32.310 32.371 -0.061 1
1 1178 . 11 1 1 A 103 103 ILE H H 103 8.550 7.799 0.751 1
1 1179 . 11 1 1 A 103 103 ILE HA H 103 4.630 4.789 -0.159 1
1 1189 . 11 1 1 A 103 103 ILE C C 103 175.460 175.543 -0.083 1
1 1190 . 11 1 1 A 103 103 ILE CA C 103 59.730 58.408 1.322 1
1 1191 . 11 1 1 A 103 103 ILE CB C 103 40.140 41.375 -1.235 1
1 1195 . 11 1 1 A 103 103 ILE N N 103 115.670 116.236 -0.566 1
1 1196 . 11 1 1 A 104 104 SER H H 104 8.730 8.723 0.007 1
1 1197 . 11 1 1 A 104 104 SER HA H 104 4.500 4.521 -0.021 1
1 1200 . 11 1 1 A 104 104 SER C C 104 174.840 175.382 -0.542 1
1 1201 . 11 1 1 A 104 104 SER CA C 104 58.010 58.163 -0.153 1
1 1202 . 11 1 1 A 104 104 SER CB C 104 65.470 64.083 1.387 1
1 1203 . 11 1 1 A 104 104 SER N N 104 119.170 120.005 -0.835 1
1 1204 . 11 1 1 A 105 105 ASP H H 105 8.830 8.994 -0.164 1
1 1205 . 11 1 1 A 105 105 ASP HA H 105 4.200 4.189 0.011 1
1 1208 . 11 1 1 A 105 105 ASP C C 105 178.520 178.374 0.146 1
1 1209 . 11 1 1 A 105 105 ASP CA C 105 57.870 57.797 0.073 1
1 1210 . 11 1 1 A 105 105 ASP CB C 105 40.040 40.152 -0.112 1
1 1211 . 11 1 1 A 105 105 ASP N N 105 121.640 125.090 -3.450 1
1 1212 . 11 1 1 A 106 106 LYS H H 106 8.130 8.064 0.066 1
1 1213 . 11 1 1 A 106 106 LYS HA H 106 4.100 3.898 0.202 1
1 1222 . 11 1 1 A 106 106 LYS C C 106 179.400 178.747 0.653 1
1 1223 . 11 1 1 A 106 106 LYS CA C 106 58.980 59.764 -0.784 1
1 1224 . 11 1 1 A 106 106 LYS CB C 106 32.330 32.237 0.093 1
1 1228 . 11 1 1 A 106 106 LYS N N 106 118.300 120.613 -2.313 1
1 1229 . 11 1 1 A 107 107 GLU H H 107 7.670 7.873 -0.203 1
1 1230 . 11 1 1 A 107 107 GLU HA H 107 4.020 4.050 -0.030 1
1 1235 . 11 1 1 A 107 107 GLU C C 107 178.750 179.604 -0.854 1
1 1236 . 11 1 1 A 107 107 GLU CA C 107 59.210 59.176 0.034 1
1 1237 . 11 1 1 A 107 107 GLU CB C 107 29.780 29.596 0.184 1
1 1239 . 11 1 1 A 107 107 GLU N N 107 121.270 119.355 1.915 1
1 1240 . 11 1 1 A 108 108 VAL H H 108 7.790 7.861 -0.071 1
1 1241 . 11 1 1 A 108 108 VAL HA H 108 3.050 3.450 -0.400 1
1 1249 . 11 1 1 A 108 108 VAL C C 108 177.550 177.353 0.197 1
1 1250 . 11 1 1 A 108 108 VAL CA C 108 67.080 66.365 0.715 1
1 1251 . 11 1 1 A 108 108 VAL CB C 108 31.220 30.945 0.275 1
1 1254 . 11 1 1 A 108 108 VAL N N 108 120.940 121.157 -0.217 1
1 1255 . 11 1 1 A 109 109 ASP H H 109 7.840 7.957 -0.117 1
1 1256 . 11 1 1 A 109 109 ASP HA H 109 4.110 4.257 -0.147 1
1 1259 . 11 1 1 A 109 109 ASP C C 109 178.190 178.492 -0.302 1
1 1260 . 11 1 1 A 109 109 ASP CA C 109 57.470 57.037 0.433 1
1 1261 . 11 1 1 A 109 109 ASP CB C 109 40.480 40.055 0.425 1
1 1262 . 11 1 1 A 109 109 ASP N N 109 118.780 120.558 -1.778 1
1 1263 . 11 1 1 A 110 110 ALA H H 110 7.520 8.099 -0.579 1
1 1264 . 11 1 1 A 110 110 ALA HA H 110 4.110 4.056 0.054 1
1 1268 . 11 1 1 A 110 110 ALA C C 110 180.550 179.943 0.607 1
1 1269 . 11 1 1 A 110 110 ALA CA C 110 54.880 55.239 -0.359 1
1 1270 . 11 1 1 A 110 110 ALA CB C 110 18.440 18.069 0.371 1
1 1271 . 11 1 1 A 110 110 ALA N N 110 120.640 122.504 -1.864 1
1 1272 . 11 1 1 A 111 111 ILE H H 111 7.840 7.821 0.019 1
1 1273 . 11 1 1 A 111 111 ILE HA H 111 3.580 3.604 -0.024 1
1 1281 . 11 1 1 A 111 111 ILE C C 111 177.470 177.920 -0.450 1
1 1282 . 11 1 1 A 111 111 ILE CA C 111 64.620 65.179 -0.559 1
1 1283 . 11 1 1 A 111 111 ILE CB C 111 38.600 37.806 0.794 1
1 1286 . 11 1 1 A 111 111 ILE N N 111 119.840 118.891 0.949 1
1 1287 . 11 1 1 A 112 112 MET H H 112 8.100 7.936 0.164 1
1 1288 . 11 1 1 A 112 112 MET HA H 112 4.400 4.231 0.169 1
1 1296 . 11 1 1 A 112 112 MET C C 112 177.710 178.004 -0.294 1
1 1297 . 11 1 1 A 112 112 MET CA C 112 55.300 58.514 -3.214 1
1 1298 . 11 1 1 A 112 112 MET CB C 112 30.510 32.072 -1.562 1
1 1301 . 11 1 1 A 112 112 MET N N 112 115.180 121.000 -5.820 1
1 1302 . 11 1 1 A 113 113 ASN H H 113 8.070 8.591 -0.521 1
1 1303 . 11 1 1 A 113 113 ASN HA H 113 4.570 4.404 0.166 1
1 1308 . 11 1 1 A 113 113 ASN C C 113 175.530 177.577 -2.047 1
1 1309 . 11 1 1 A 113 113 ASN CA C 113 54.420 56.602 -2.182 1
1 1310 . 11 1 1 A 113 113 ASN CB C 113 38.350 39.816 -1.466 1
1 1311 . 11 1 1 A 113 113 ASN N N 113 117.190 118.144 -0.954 1
1 1313 . 11 1 1 A 114 114 ARG H H 114 8.070 7.913 0.157 1
1 1314 . 11 1 1 A 114 114 ARG HA H 114 4.280 3.954 0.326 1
1 1321 . 11 1 1 A 114 114 ARG C C 114 176.620 178.837 -2.217 1
1 1322 . 11 1 1 A 114 114 ARG CA C 114 56.910 59.282 -2.372 1
1 1323 . 11 1 1 A 114 114 ARG CB C 114 30.370 29.899 0.471 1
1 1326 . 11 1 1 A 114 114 ARG N N 114 118.360 118.894 -0.534 1
1 1327 . 11 1 1 A 115 115 LEU H H 115 8.100 8.307 -0.207 1
1 1328 . 11 1 1 A 115 115 LEU HA H 115 4.310 4.148 0.162 1
1 1338 . 11 1 1 A 115 115 LEU C C 115 177.440 178.553 -1.113 1
1 1339 . 11 1 1 A 115 115 LEU CA C 115 55.440 57.724 -2.284 1
1 1340 . 11 1 1 A 115 115 LEU CB C 115 42.250 41.356 0.894 1
1 1344 . 11 1 1 A 115 115 LEU N N 115 120.580 121.599 -1.019 1
1 1345 . 11 1 1 A 116 116 GLN H H 116 8.180 7.864 0.316 1
1 1346 . 11 1 1 A 116 116 GLN HA H 116 4.360 4.079 0.281 1
1 1353 . 11 1 1 A 116 116 GLN C C 116 175.890 179.177 -3.287 1
1 1354 . 11 1 1 A 116 116 GLN CA C 116 55.810 59.219 -3.409 1
1 1355 . 11 1 1 A 116 116 GLN CB C 116 29.500 27.979 1.521 1
1 1357 . 11 1 1 A 116 116 GLN N N 116 119.770 117.892 1.878 1
1 1358 . 11 1 1 A 117 117 GLN H H 117 8.350 8.165 0.185 1
1 1359 . 11 1 1 A 117 117 GLN HA H 117 4.380 4.097 0.283 1
1 1366 . 11 1 1 A 117 117 GLN C C 117 176.130 175.639 0.491 1
1 1367 . 11 1 1 A 117 117 GLN CA C 117 55.810 58.307 -2.497 1
1 1368 . 11 1 1 A 117 117 GLN CB C 117 29.500 28.733 0.767 1
1 1370 . 11 1 1 A 117 117 GLN N N 117 121.440 119.753 1.687 1
1 1371 . 11 1 1 A 118 118 VAL H H 118 8.240 7.669 0.571 1
1 1372 . 11 1 1 A 118 118 VAL HA H 118 4.120 4.352 -0.232 1
1 1380 . 11 1 1 A 118 118 VAL C C 118 176.650 176.201 0.449 1
1 1381 . 11 1 1 A 118 118 VAL CA C 118 62.720 60.760 1.960 1
1 1382 . 11 1 1 A 118 118 VAL CB C 118 32.730 33.052 -0.322 1
1 1385 . 11 1 1 A 118 118 VAL N N 118 121.250 118.717 2.533 1
1 1386 . 11 1 1 A 119 119 GLY H H 119 8.460 8.785 -0.325 1
1 1387 . 11 1 1 A 119 119 GLY HA2 H 119 3.990 4.039 -0.049 1
1 1388 . 11 1 1 A 119 119 GLY HA3 H 119 3.990 4.042 -0.052 1
1 1389 . 11 1 1 A 119 119 GLY C C 119 173.770 174.771 -1.001 1
1 1390 . 11 1 1 A 119 119 GLY CA C 119 45.260 45.825 -0.565 1
1 1391 . 11 1 1 A 119 119 GLY N N 119 112.300 114.417 -2.117 1
1 1392 . 11 1 1 A 120 120 ASP H H 120 8.230 9.004 -0.774 1
1 1393 . 11 1 1 A 120 120 ASP HA H 120 4.580 4.503 0.077 1
1 1396 . 11 1 1 A 120 120 ASP C C 120 175.180 176.804 -1.624 1
1 1397 . 11 1 1 A 120 120 ASP CA C 120 54.340 56.823 -2.483 1
1 1398 . 11 1 1 A 120 120 ASP CB C 120 41.390 41.054 0.336 1
1 1399 . 11 1 1 A 120 120 ASP N N 120 120.420 125.291 -4.871 1
1 1400 . 11 1 1 A 121 121 LYS H H 121 7.950 7.811 0.139 1
1 1401 . 11 1 1 A 121 121 LYS HA H 121 4.240 4.784 -0.544 1
1 1402 . 11 1 1 A 121 121 LYS CA C 121 53.620 53.317 0.303 1
1 1403 . 11 1 1 A 121 121 LYS N N 121 119.110 117.392 1.718 1
1 1404 . 11 1 1 A 122 122 PRO HA H 122 4.410 4.429 -0.019 1
1 1405 . 11 1 1 A 122 122 PRO C C 122 176.560 176.526 0.034 1
1 1406 . 11 1 1 A 122 122 PRO CA C 122 63.130 64.173 -1.043 1
1 2 . 12 1 1 A 2 2 SER H H 2 7.890 8.480 -0.590 1
1 3 . 12 1 1 A 2 2 SER HA H 2 4.270 4.080 0.190 1
1 4 . 12 1 1 A 2 2 SER C C 2 173.960 176.800 -2.840 1
1 5 . 12 1 1 A 2 2 SER CA C 2 60.800 61.449 -0.649 1
1 6 . 12 1 1 A 2 2 SER N N 2 111.940 120.654 -8.714 1
1 7 . 12 1 1 A 3 3 GLU H H 3 8.010 8.092 -0.082 1
1 8 . 12 1 1 A 3 3 GLU HA H 3 4.360 4.184 0.176 1
1 9 . 12 1 1 A 3 3 GLU C C 3 175.710 176.753 -1.043 1
1 10 . 12 1 1 A 3 3 GLU CA C 3 56.310 59.015 -2.705 1
1 11 . 12 1 1 A 3 3 GLU N N 3 121.280 120.909 0.371 1
1 12 . 12 1 1 A 4 4 ALA H H 4 8.540 7.698 0.842 1
1 13 . 12 1 1 A 4 4 ALA HA H 4 4.560 4.694 -0.134 1
1 14 . 12 1 1 A 4 4 ALA CA C 4 50.630 49.433 1.197 1
1 15 . 12 1 1 A 4 4 ALA N N 4 127.840 121.784 6.056 1
1 16 . 12 1 1 A 5 5 PRO HA H 5 4.420 4.580 -0.160 1
1 17 . 12 1 1 A 5 5 PRO C C 5 174.240 176.716 -2.476 1
1 18 . 12 1 1 A 5 5 PRO CA C 5 62.840 62.498 0.342 1
1 19 . 12 1 1 A 6 6 LYS H H 6 8.320 8.463 -0.143 1
1 20 . 12 1 1 A 6 6 LYS HA H 6 4.290 4.607 -0.317 1
1 21 . 12 1 1 A 6 6 LYS C C 6 176.100 176.146 -0.046 1
1 22 . 12 1 1 A 6 6 LYS CA C 6 55.540 55.638 -0.098 1
1 23 . 12 1 1 A 6 6 LYS N N 6 121.910 121.503 0.407 1
1 24 . 12 1 1 A 7 7 LYS H H 7 8.450 8.354 0.096 1
1 25 . 12 1 1 A 7 7 LYS HA H 7 3.940 5.027 -1.087 1
1 26 . 12 1 1 A 7 7 LYS C C 7 175.700 175.096 0.604 1
1 27 . 12 1 1 A 7 7 LYS CA C 7 56.440 54.373 2.067 1
1 28 . 12 1 1 A 7 7 LYS N N 7 122.250 121.088 1.162 1
1 29 . 12 1 1 A 8 8 ARG H H 8 8.210 8.728 -0.518 1
1 30 . 12 1 1 A 8 8 ARG HA H 8 4.670 4.849 -0.179 1
1 31 . 12 1 1 A 8 8 ARG C C 8 173.760 174.284 -0.524 1
1 32 . 12 1 1 A 8 8 ARG CA C 8 53.420 53.898 -0.478 1
1 33 . 12 1 1 A 8 8 ARG N N 8 122.560 121.805 0.755 1
1 34 . 12 1 1 A 9 9 TRP H H 9 8.610 8.482 0.128 1
1 35 . 12 1 1 A 9 9 TRP HA H 9 4.910 5.449 -0.539 1
1 44 . 12 1 1 A 9 9 TRP C C 9 174.610 175.074 -0.464 1
1 45 . 12 1 1 A 9 9 TRP CA C 9 57.630 55.261 2.369 1
1 46 . 12 1 1 A 9 9 TRP CB C 9 31.020 31.194 -0.174 1
1 52 . 12 1 1 A 9 9 TRP N N 9 120.540 119.946 0.594 1
1 54 . 12 1 1 A 10 10 TYR H H 10 9.260 8.899 0.361 1
1 55 . 12 1 1 A 10 10 TYR HA H 10 4.820 5.181 -0.361 1
1 62 . 12 1 1 A 10 10 TYR C C 10 174.340 175.252 -0.912 1
1 63 . 12 1 1 A 10 10 TYR CA C 10 57.050 56.403 0.647 1
1 64 . 12 1 1 A 10 10 TYR CB C 10 41.920 42.715 -0.795 1
1 69 . 12 1 1 A 10 10 TYR N N 10 118.990 122.079 -3.089 1
1 70 . 12 1 1 A 11 11 VAL H H 11 9.450 8.926 0.524 1
1 71 . 12 1 1 A 11 11 VAL HA H 11 4.470 4.704 -0.234 1
1 79 . 12 1 1 A 11 11 VAL C C 11 175.030 175.541 -0.511 1
1 80 . 12 1 1 A 11 11 VAL CA C 11 62.320 61.922 0.398 1
1 81 . 12 1 1 A 11 11 VAL CB C 11 32.400 32.691 -0.291 1
1 84 . 12 1 1 A 11 11 VAL N N 11 120.930 123.564 -2.634 1
1 85 . 12 1 1 A 12 12 VAL H H 12 9.320 9.509 -0.189 1
1 86 . 12 1 1 A 12 12 VAL HA H 12 3.940 4.052 -0.112 1
1 94 . 12 1 1 A 12 12 VAL C C 12 173.870 174.631 -0.761 1
1 95 . 12 1 1 A 12 12 VAL CA C 12 61.330 60.621 0.709 1
1 96 . 12 1 1 A 12 12 VAL CB C 12 33.500 34.335 -0.835 1
1 99 . 12 1 1 A 12 12 VAL N N 12 128.860 127.388 1.472 1
1 100 . 12 1 1 A 13 13 GLN H H 13 8.830 8.010 0.820 1
1 101 . 12 1 1 A 13 13 GLN HA H 13 4.710 4.927 -0.217 1
1 108 . 12 1 1 A 13 13 GLN C C 13 174.230 175.428 -1.198 1
1 109 . 12 1 1 A 13 13 GLN CA C 13 54.800 55.413 -0.613 1
1 110 . 12 1 1 A 13 13 GLN CB C 13 29.450 30.278 -0.828 1
1 111 . 12 1 1 A 13 13 GLN N N 13 126.050 126.182 -0.132 1
1 113 . 12 1 1 A 14 14 ALA H H 14 9.420 8.863 0.557 1
1 114 . 12 1 1 A 14 14 ALA HA H 14 5.150 4.578 0.572 1
1 118 . 12 1 1 A 14 14 ALA C C 14 176.400 176.236 0.164 1
1 119 . 12 1 1 A 14 14 ALA CA C 14 49.660 51.388 -1.728 1
1 120 . 12 1 1 A 14 14 ALA CB C 14 22.840 22.698 0.142 1
1 121 . 12 1 1 A 14 14 ALA N N 14 131.620 122.573 9.047 1
1 122 . 12 1 1 A 15 15 PHE H H 15 8.070 7.752 0.318 1
1 123 . 12 1 1 A 15 15 PHE HA H 15 4.410 4.656 -0.246 1
1 128 . 12 1 1 A 15 15 PHE C C 15 176.130 176.178 -0.048 1
1 129 . 12 1 1 A 15 15 PHE CA C 15 58.550 59.002 -0.452 1
1 130 . 12 1 1 A 15 15 PHE CB C 15 39.780 39.742 0.038 1
1 133 . 12 1 1 A 15 15 PHE N N 15 119.680 119.546 0.134 1
1 134 . 12 1 1 A 16 16 SER H H 16 8.370 8.875 -0.505 1
1 135 . 12 1 1 A 16 16 SER HA H 16 4.140 4.277 -0.137 1
1 138 . 12 1 1 A 16 16 SER C C 16 175.820 175.193 0.627 1
1 139 . 12 1 1 A 16 16 SER CA C 16 60.570 59.943 0.627 1
1 140 . 12 1 1 A 16 16 SER CB C 16 63.030 62.920 0.110 1
1 141 . 12 1 1 A 16 16 SER N N 16 119.700 119.008 0.692 1
1 142 . 12 1 1 A 17 17 GLY H H 17 9.130 8.828 0.302 1
1 143 . 12 1 1 A 17 17 GLY HA2 H 17 3.640 3.713 -0.073 1
1 144 . 12 1 1 A 17 17 GLY HA3 H 17 4.200 3.834 0.366 1
1 145 . 12 1 1 A 17 17 GLY C C 17 175.520 174.930 0.590 1
1 146 . 12 1 1 A 17 17 GLY CA C 17 45.260 45.330 -0.070 1
1 147 . 12 1 1 A 17 17 GLY N N 17 115.850 114.938 0.912 1
1 148 . 12 1 1 A 18 18 PHE H H 18 8.480 7.865 0.615 1
1 149 . 12 1 1 A 18 18 PHE HA H 18 4.740 4.558 0.182 1
1 154 . 12 1 1 A 18 18 PHE C C 18 175.430 176.813 -1.383 1
1 155 . 12 1 1 A 18 18 PHE CA C 18 58.240 58.766 -0.526 1
1 156 . 12 1 1 A 18 18 PHE CB C 18 39.010 39.150 -0.140 1
1 159 . 12 1 1 A 18 18 PHE N N 18 118.550 120.109 -1.559 1
1 160 . 12 1 1 A 19 19 GLU H H 19 10.690 8.299 2.391 1
1 161 . 12 1 1 A 19 19 GLU HA H 19 3.490 4.125 -0.635 1
1 166 . 12 1 1 A 19 19 GLU C C 19 177.650 179.136 -1.486 1
1 167 . 12 1 1 A 19 19 GLU CA C 19 62.280 59.008 3.272 1
1 168 . 12 1 1 A 19 19 GLU CB C 19 28.380 29.598 -1.218 1
1 170 . 12 1 1 A 19 19 GLU N N 19 123.470 119.047 4.423 1
1 171 . 12 1 1 A 20 20 GLY H H 20 8.740 8.423 0.317 1
1 172 . 12 1 1 A 20 20 GLY HA2 H 20 3.840 3.832 0.008 1
1 173 . 12 1 1 A 20 20 GLY HA3 H 20 3.940 3.838 0.102 1
1 174 . 12 1 1 A 20 20 GLY C C 20 176.860 175.480 1.380 1
1 175 . 12 1 1 A 20 20 GLY CA C 20 47.140 47.401 -0.261 1
1 176 . 12 1 1 A 20 20 GLY N N 20 105.480 108.653 -3.173 1
1 177 . 12 1 1 A 21 21 ARG H H 21 7.690 8.196 -0.506 1
1 178 . 12 1 1 A 21 21 ARG HA H 21 4.180 4.107 0.073 1
1 185 . 12 1 1 A 21 21 ARG C C 21 179.490 178.829 0.661 1
1 186 . 12 1 1 A 21 21 ARG CA C 21 58.660 59.477 -0.817 1
1 187 . 12 1 1 A 21 21 ARG CB C 21 30.100 30.019 0.081 1
1 190 . 12 1 1 A 21 21 ARG N N 21 123.120 121.906 1.214 1
1 191 . 12 1 1 A 22 22 VAL H H 22 8.980 7.979 1.001 1
1 192 . 12 1 1 A 22 22 VAL HA H 22 3.560 3.688 -0.128 1
1 200 . 12 1 1 A 22 22 VAL C C 22 177.320 178.245 -0.925 1
1 201 . 12 1 1 A 22 22 VAL CA C 22 66.960 66.238 0.722 1
1 202 . 12 1 1 A 22 22 VAL CB C 22 31.050 31.542 -0.492 1
1 205 . 12 1 1 A 22 22 VAL N N 22 122.760 119.808 2.952 1
1 206 . 12 1 1 A 23 23 ALA H H 23 8.280 8.139 0.141 1
1 207 . 12 1 1 A 23 23 ALA HA H 23 3.850 3.995 -0.145 1
1 211 . 12 1 1 A 23 23 ALA C C 23 179.340 179.820 -0.480 1
1 212 . 12 1 1 A 23 23 ALA CA C 23 56.260 55.312 0.948 1
1 213 . 12 1 1 A 23 23 ALA CB C 23 18.260 18.625 -0.365 1
1 214 . 12 1 1 A 23 23 ALA N N 23 122.120 122.122 -0.002 1
1 215 . 12 1 1 A 24 24 THR H H 24 8.020 7.980 0.040 1
1 216 . 12 1 1 A 24 24 THR HA H 24 3.920 3.839 0.081 1
1 221 . 12 1 1 A 24 24 THR C C 24 176.940 176.630 0.310 1
1 222 . 12 1 1 A 24 24 THR CA C 24 66.820 67.032 -0.212 1
1 223 . 12 1 1 A 24 24 THR CB C 24 68.930 68.587 0.343 1
1 225 . 12 1 1 A 24 24 THR N N 24 113.410 113.505 -0.095 1
1 226 . 12 1 1 A 25 25 SER H H 25 8.570 8.268 0.302 1
1 227 . 12 1 1 A 25 25 SER HA H 25 4.400 3.981 0.419 1
1 230 . 12 1 1 A 25 25 SER C C 25 177.610 176.124 1.486 1
1 231 . 12 1 1 A 25 25 SER CA C 25 61.920 62.008 -0.088 1
1 232 . 12 1 1 A 25 25 SER CB C 25 63.540 63.201 0.339 1
1 233 . 12 1 1 A 25 25 SER N N 25 118.260 117.425 0.835 1
1 234 . 12 1 1 A 26 26 LEU H H 26 9.430 9.064 0.366 1
1 235 . 12 1 1 A 26 26 LEU HA H 26 3.900 4.104 -0.204 1
1 245 . 12 1 1 A 26 26 LEU C C 26 177.710 178.536 -0.826 1
1 246 . 12 1 1 A 26 26 LEU CA C 26 58.910 58.667 0.243 1
1 247 . 12 1 1 A 26 26 LEU CB C 26 41.300 41.478 -0.178 1
1 251 . 12 1 1 A 26 26 LEU N N 26 124.120 122.593 1.527 1
1 252 . 12 1 1 A 27 27 ARG H H 27 7.790 7.842 -0.052 1
1 253 . 12 1 1 A 27 27 ARG HA H 27 3.880 3.599 0.281 1
1 260 . 12 1 1 A 27 27 ARG C C 27 179.380 178.431 0.949 1
1 261 . 12 1 1 A 27 27 ARG CA C 27 60.510 59.509 1.001 1
1 262 . 12 1 1 A 27 27 ARG CB C 27 29.670 29.790 -0.120 1
1 265 . 12 1 1 A 27 27 ARG N N 27 116.710 119.038 -2.328 1
1 266 . 12 1 1 A 28 28 GLU H H 28 7.900 8.110 -0.210 1
1 267 . 12 1 1 A 28 28 GLU HA H 28 4.070 3.865 0.205 1
1 272 . 12 1 1 A 28 28 GLU C C 28 179.450 179.154 0.296 1
1 273 . 12 1 1 A 28 28 GLU CA C 28 59.450 59.289 0.161 1
1 274 . 12 1 1 A 28 28 GLU CB C 28 29.610 29.119 0.491 1
1 276 . 12 1 1 A 28 28 GLU N N 28 118.340 119.017 -0.677 1
1 277 . 12 1 1 A 29 29 HIS H H 29 8.940 7.342 1.598 1
1 278 . 12 1 1 A 29 29 HIS HA H 29 4.160 4.463 -0.303 1
1 283 . 12 1 1 A 29 29 HIS C C 29 177.750 177.807 -0.057 1
1 284 . 12 1 1 A 29 29 HIS CA C 29 61.260 59.875 1.385 1
1 285 . 12 1 1 A 29 29 HIS CB C 29 29.870 30.500 -0.630 1
1 287 . 12 1 1 A 29 29 HIS N N 29 120.440 118.078 2.362 1
1 288 . 12 1 1 A 30 30 ILE H H 30 8.580 8.591 -0.011 1
1 289 . 12 1 1 A 30 30 ILE HA H 30 3.160 3.599 -0.439 1
1 299 . 12 1 1 A 30 30 ILE C C 30 177.230 178.173 -0.943 1
1 300 . 12 1 1 A 30 30 ILE CA C 30 66.460 65.423 1.037 1
1 301 . 12 1 1 A 30 30 ILE CB C 30 38.630 37.728 0.902 1
1 305 . 12 1 1 A 30 30 ILE N N 30 121.010 120.117 0.893 1
1 306 . 12 1 1 A 31 31 LYS H H 31 7.020 8.598 -1.578 1
1 307 . 12 1 1 A 31 31 LYS HA H 31 4.170 3.993 0.177 1
1 316 . 12 1 1 A 31 31 LYS C C 31 180.570 178.610 1.960 1
1 317 . 12 1 1 A 31 31 LYS CA C 31 58.920 59.949 -1.029 1
1 318 . 12 1 1 A 31 31 LYS CB C 31 32.490 31.882 0.608 1
1 322 . 12 1 1 A 31 31 LYS N N 31 117.400 121.237 -3.837 1
1 323 . 12 1 1 A 32 32 LEU H H 32 8.400 7.827 0.573 1
1 324 . 12 1 1 A 32 32 LEU HA H 32 3.990 3.892 0.098 1
1 334 . 12 1 1 A 32 32 LEU C C 32 178.230 178.098 0.132 1
1 335 . 12 1 1 A 32 32 LEU CA C 32 57.700 57.797 -0.097 1
1 336 . 12 1 1 A 32 32 LEU CB C 32 42.540 41.631 0.909 1
1 340 . 12 1 1 A 32 32 LEU N N 32 121.180 119.563 1.617 1
1 341 . 12 1 1 A 33 33 HIS H H 33 7.620 8.112 -0.492 1
1 342 . 12 1 1 A 33 33 HIS HA H 33 4.600 4.654 -0.054 1
1 347 . 12 1 1 A 33 33 HIS C C 33 177.090 174.450 2.640 1
1 348 . 12 1 1 A 33 33 HIS CA C 33 55.840 55.491 0.349 1
1 349 . 12 1 1 A 33 33 HIS CB C 33 29.330 30.027 -0.697 1
1 351 . 12 1 1 A 33 33 HIS N N 33 112.220 115.257 -3.037 1
1 352 . 12 1 1 A 34 34 ASN H H 34 8.030 8.094 -0.064 1
1 353 . 12 1 1 A 34 34 ASN HA H 34 4.890 4.379 0.511 1
1 358 . 12 1 1 A 34 34 ASN C C 34 175.910 175.837 0.073 1
1 359 . 12 1 1 A 34 34 ASN CA C 34 54.530 54.072 0.458 1
1 360 . 12 1 1 A 34 34 ASN CB C 34 37.380 37.156 0.224 1
1 361 . 12 1 1 A 34 34 ASN N N 34 117.600 116.771 0.829 1
1 363 . 12 1 1 A 35 35 MET H H 35 8.330 8.535 -0.205 1
1 364 . 12 1 1 A 35 35 MET HA H 35 4.940 4.811 0.129 1
1 372 . 12 1 1 A 35 35 MET C C 35 176.880 176.906 -0.026 1
1 373 . 12 1 1 A 35 35 MET CA C 35 55.600 54.443 1.157 1
1 374 . 12 1 1 A 35 35 MET CB C 35 33.790 32.709 1.081 1
1 377 . 12 1 1 A 35 35 MET N N 35 116.190 116.924 -0.734 1
1 378 . 12 1 1 A 36 36 GLU H H 36 9.730 8.200 1.530 1
1 379 . 12 1 1 A 36 36 GLU HA H 36 3.850 4.150 -0.300 1
1 384 . 12 1 1 A 36 36 GLU C C 36 178.290 178.965 -0.675 1
1 385 . 12 1 1 A 36 36 GLU CA C 36 61.280 59.663 1.617 1
1 386 . 12 1 1 A 36 36 GLU CB C 36 29.270 29.128 0.142 1
1 388 . 12 1 1 A 36 36 GLU N N 36 121.630 120.705 0.925 1
1 389 . 12 1 1 A 37 37 ASP H H 37 8.850 8.129 0.721 1
1 390 . 12 1 1 A 37 37 ASP HA H 37 4.470 4.400 0.070 1
1 393 . 12 1 1 A 37 37 ASP C C 37 177.190 178.979 -1.789 1
1 394 . 12 1 1 A 37 37 ASP CA C 37 56.140 57.365 -1.225 1
1 395 . 12 1 1 A 37 37 ASP CB C 37 40.050 40.840 -0.790 1
1 396 . 12 1 1 A 37 37 ASP N N 37 114.390 119.725 -5.335 1
1 397 . 12 1 1 A 38 38 LEU H H 38 7.880 7.743 0.137 1
1 398 . 12 1 1 A 38 38 LEU HA H 38 4.290 4.017 0.273 1
1 408 . 12 1 1 A 38 38 LEU C C 38 175.090 177.674 -2.584 1
1 409 . 12 1 1 A 38 38 LEU CA C 38 54.670 57.930 -3.260 1
1 410 . 12 1 1 A 38 38 LEU CB C 38 42.940 41.786 1.154 1
1 414 . 12 1 1 A 38 38 LEU N N 38 116.550 119.106 -2.556 1
1 415 . 12 1 1 A 39 39 PHE H H 39 7.500 7.575 -0.075 1
1 416 . 12 1 1 A 39 39 PHE HA H 39 4.970 4.511 0.459 1
1 424 . 12 1 1 A 39 39 PHE C C 39 175.380 175.566 -0.186 1
1 425 . 12 1 1 A 39 39 PHE CA C 39 57.580 58.846 -1.266 1
1 426 . 12 1 1 A 39 39 PHE CB C 39 44.990 39.655 5.335 1
1 432 . 12 1 1 A 39 39 PHE N N 39 115.370 117.349 -1.979 1
1 433 . 12 1 1 A 40 40 GLY H H 40 8.680 9.063 -0.383 1
1 434 . 12 1 1 A 40 40 GLY HA2 H 40 3.370 3.995 -0.625 1
1 435 . 12 1 1 A 40 40 GLY HA3 H 40 4.550 4.077 0.473 1
1 436 . 12 1 1 A 40 40 GLY C C 40 173.090 174.077 -0.987 1
1 437 . 12 1 1 A 40 40 GLY CA C 40 44.180 46.239 -2.059 1
1 438 . 12 1 1 A 40 40 GLY N N 40 110.930 111.372 -0.442 1
1 439 . 12 1 1 A 41 41 GLU H H 41 8.320 7.799 0.521 1
1 440 . 12 1 1 A 41 41 GLU HA H 41 4.280 4.970 -0.690 1
1 445 . 12 1 1 A 41 41 GLU C C 41 173.900 174.582 -0.682 1
1 446 . 12 1 1 A 41 41 GLU CA C 41 56.900 54.951 1.949 1
1 447 . 12 1 1 A 41 41 GLU CB C 41 32.110 33.249 -1.139 1
1 449 . 12 1 1 A 41 41 GLU N N 41 126.730 120.131 6.599 1
1 450 . 12 1 1 A 42 42 VAL H H 42 8.100 8.571 -0.471 1
1 451 . 12 1 1 A 42 42 VAL HA H 42 5.160 5.122 0.038 1
1 459 . 12 1 1 A 42 42 VAL C C 42 176.340 175.168 1.172 1
1 460 . 12 1 1 A 42 42 VAL CA C 42 61.200 60.769 0.431 1
1 461 . 12 1 1 A 42 42 VAL CB C 42 34.770 35.252 -0.482 1
1 464 . 12 1 1 A 42 42 VAL N N 42 119.360 125.204 -5.844 1
1 465 . 12 1 1 A 43 43 MET H H 43 9.870 9.478 0.392 1
1 466 . 12 1 1 A 43 43 MET HA H 43 5.070 5.222 -0.152 1
1 474 . 12 1 1 A 43 43 MET C C 43 173.890 174.829 -0.939 1
1 475 . 12 1 1 A 43 43 MET CA C 43 54.740 54.505 0.235 1
1 476 . 12 1 1 A 43 43 MET CB C 43 37.500 37.008 0.492 1
1 479 . 12 1 1 A 43 43 MET N N 43 125.720 124.563 1.157 1
1 480 . 12 1 1 A 44 44 VAL H H 44 8.800 9.055 -0.255 1
1 481 . 12 1 1 A 44 44 VAL HA H 44 4.720 4.735 -0.015 1
1 489 . 12 1 1 A 44 44 VAL CA C 44 59.090 59.147 -0.057 1
1 490 . 12 1 1 A 44 44 VAL CB C 44 33.710 33.507 0.203 1
1 493 . 12 1 1 A 44 44 VAL N N 44 122.340 123.076 -0.736 1
1 494 . 12 1 1 A 45 45 PRO HA H 45 4.480 4.564 -0.084 1
1 501 . 12 1 1 A 45 45 PRO C C 45 177.080 177.663 -0.583 1
1 502 . 12 1 1 A 45 45 PRO CA C 45 63.240 64.280 -1.040 1
1 503 . 12 1 1 A 45 45 PRO CB C 45 32.170 31.851 0.319 1
1 506 . 12 1 1 A 46 46 THR H H 46 8.200 7.878 0.322 1
1 507 . 12 1 1 A 46 46 THR HA H 46 4.290 4.540 -0.250 1
1 512 . 12 1 1 A 46 46 THR C C 46 174.600 174.332 0.268 1
1 513 . 12 1 1 A 46 46 THR CA C 46 62.100 62.400 -0.300 1
1 514 . 12 1 1 A 46 46 THR CB C 46 69.990 69.216 0.774 1
1 516 . 12 1 1 A 46 46 THR N N 46 113.410 111.149 2.261 1
1 517 . 12 1 1 A 47 47 GLU H H 47 8.380 7.878 0.502 1
1 518 . 12 1 1 A 47 47 GLU HA H 47 4.400 4.089 0.311 1
1 521 . 12 1 1 A 47 47 GLU C C 47 175.970 175.235 0.735 1
1 522 . 12 1 1 A 47 47 GLU CA C 47 55.200 58.341 -3.141 1
1 523 . 12 1 1 A 47 47 GLU CB C 47 32.300 28.224 4.076 1
1 524 . 12 1 1 A 47 47 GLU N N 47 122.830 119.913 2.917 1
1 525 . 12 1 1 A 48 48 GLU H H 48 8.400 8.616 -0.216 1
1 526 . 12 1 1 A 48 48 GLU HA H 48 4.280 4.377 -0.097 1
1 531 . 12 1 1 A 48 48 GLU C C 48 175.750 178.354 -2.604 1
1 532 . 12 1 1 A 48 48 GLU CA C 48 55.190 56.057 -0.867 1
1 533 . 12 1 1 A 48 48 GLU CB C 48 31.980 30.472 1.508 1
1 535 . 12 1 1 A 48 48 GLU N N 48 121.950 120.912 1.038 1
1 536 . 12 1 1 A 49 49 VAL H H 49 8.240 8.439 -0.199 1
1 537 . 12 1 1 A 49 49 VAL HA H 49 4.170 3.805 0.365 1
1 542 . 12 1 1 A 49 49 VAL C C 49 174.610 176.233 -1.623 1
1 543 . 12 1 1 A 49 49 VAL CA C 49 62.280 65.389 -3.109 1
1 544 . 12 1 1 A 49 49 VAL CB C 49 32.930 31.704 1.226 1
1 546 . 12 1 1 A 49 49 VAL N N 49 123.990 121.331 2.659 1
1 547 . 12 1 1 A 50 50 VAL H H 50 8.230 7.978 0.252 1
1 548 . 12 1 1 A 50 50 VAL HA H 50 4.220 4.561 -0.341 1
1 553 . 12 1 1 A 50 50 VAL C C 50 175.770 173.836 1.934 1
1 554 . 12 1 1 A 50 50 VAL CA C 50 62.170 61.118 1.052 1
1 555 . 12 1 1 A 50 50 VAL CB C 50 33.110 34.237 -1.127 1
1 557 . 12 1 1 A 50 50 VAL N N 50 123.960 118.055 5.905 1
1 558 . 12 1 1 A 51 51 GLU H H 51 8.570 8.728 -0.158 1
1 559 . 12 1 1 A 51 51 GLU HA H 51 4.380 4.868 -0.488 1
1 564 . 12 1 1 A 51 51 GLU C C 51 175.920 177.023 -1.103 1
1 565 . 12 1 1 A 51 51 GLU CA C 51 56.050 55.061 0.989 1
1 566 . 12 1 1 A 51 51 GLU CB C 51 31.080 32.201 -1.121 1
1 568 . 12 1 1 A 51 51 GLU N N 51 125.070 126.604 -1.534 1
1 569 . 12 1 1 A 52 52 ILE H H 52 8.320 8.483 -0.163 1
1 570 . 12 1 1 A 52 52 ILE HA H 52 4.290 3.718 0.572 1
1 580 . 12 1 1 A 52 52 ILE C C 52 176.330 176.810 -0.480 1
1 581 . 12 1 1 A 52 52 ILE CA C 52 60.940 65.120 -4.180 1
1 582 . 12 1 1 A 52 52 ILE CB C 52 38.510 37.912 0.598 1
1 586 . 12 1 1 A 52 52 ILE N N 52 122.760 126.437 -3.677 1
1 587 . 12 1 1 A 53 53 ARG H H 53 8.500 7.580 0.920 1
1 588 . 12 1 1 A 53 53 ARG HA H 53 4.430 4.411 0.019 1
1 595 . 12 1 1 A 53 53 ARG C C 53 176.950 177.758 -0.808 1
1 596 . 12 1 1 A 53 53 ARG CA C 53 56.150 55.482 0.668 1
1 597 . 12 1 1 A 53 53 ARG CB C 53 30.200 31.036 -0.836 1
1 600 . 12 1 1 A 53 53 ARG N N 53 125.250 121.067 4.183 1
1 601 . 12 1 1 A 54 54 GLY H H 54 8.760 8.765 -0.005 1
1 602 . 12 1 1 A 54 54 GLY HA2 H 54 3.920 3.781 0.139 1
1 603 . 12 1 1 A 54 54 GLY HA3 H 54 4.010 3.781 0.229 1
1 604 . 12 1 1 A 54 54 GLY C C 54 175.110 174.338 0.772 1
1 605 . 12 1 1 A 54 54 GLY CA C 54 46.030 46.736 -0.706 1
1 606 . 12 1 1 A 54 54 GLY N N 54 112.510 111.177 1.333 1
1 607 . 12 1 1 A 55 55 GLY H H 55 8.350 7.697 0.653 1
1 608 . 12 1 1 A 55 55 GLY HA2 H 55 3.980 4.017 -0.037 1
1 609 . 12 1 1 A 55 55 GLY HA3 H 55 3.980 4.019 -0.039 1
1 610 . 12 1 1 A 55 55 GLY C C 55 173.920 175.522 -1.602 1
1 611 . 12 1 1 A 55 55 GLY CA C 55 45.200 44.826 0.374 1
1 612 . 12 1 1 A 55 55 GLY N N 55 107.940 105.211 2.729 1
1 613 . 12 1 1 A 56 56 GLN H H 56 8.100 8.726 -0.626 1
1 614 . 12 1 1 A 56 56 GLN HA H 56 4.420 4.076 0.344 1
1 619 . 12 1 1 A 56 56 GLN C C 56 175.570 176.073 -0.503 1
1 620 . 12 1 1 A 56 56 GLN CA C 56 55.420 58.171 -2.751 1
1 621 . 12 1 1 A 56 56 GLN CB C 56 30.100 29.170 0.930 1
1 623 . 12 1 1 A 56 56 GLN N N 56 119.350 120.336 -0.986 1
1 624 . 12 1 1 A 57 57 ARG H H 57 8.520 7.701 0.819 1
1 625 . 12 1 1 A 57 57 ARG HA H 57 4.400 4.726 -0.326 1
1 632 . 12 1 1 A 57 57 ARG C C 57 176.210 176.387 -0.177 1
1 633 . 12 1 1 A 57 57 ARG CA C 57 56.440 54.565 1.875 1
1 634 . 12 1 1 A 57 57 ARG CB C 57 30.930 33.658 -2.728 1
1 637 . 12 1 1 A 57 57 ARG N N 57 122.610 117.349 5.261 1
1 638 . 12 1 1 A 58 58 ARG H H 58 8.630 8.562 0.068 1
1 639 . 12 1 1 A 58 58 ARG HA H 58 4.430 4.150 0.280 1
1 646 . 12 1 1 A 58 58 ARG C C 58 175.950 176.423 -0.473 1
1 647 . 12 1 1 A 58 58 ARG CA C 58 55.450 58.233 -2.783 1
1 648 . 12 1 1 A 58 58 ARG CB C 58 31.300 30.536 0.764 1
1 651 . 12 1 1 A 58 58 ARG N N 58 123.320 123.436 -0.116 1
1 652 . 12 1 1 A 59 59 LYS H H 59 8.560 7.684 0.876 1
1 653 . 12 1 1 A 59 59 LYS HA H 59 4.410 4.858 -0.448 1
1 662 . 12 1 1 A 59 59 LYS C C 59 176.590 174.295 2.295 1
1 663 . 12 1 1 A 59 59 LYS CA C 59 56.720 55.207 1.513 1
1 664 . 12 1 1 A 59 59 LYS CB C 59 33.150 36.218 -3.068 1
1 668 . 12 1 1 A 59 59 LYS N N 59 123.380 119.687 3.693 1
1 669 . 12 1 1 A 60 60 SER H H 60 8.450 8.785 -0.335 1
1 670 . 12 1 1 A 60 60 SER HA H 60 4.480 4.786 -0.306 1
1 673 . 12 1 1 A 60 60 SER C C 60 174.280 175.563 -1.283 1
1 674 . 12 1 1 A 60 60 SER CA C 60 58.140 56.547 1.593 1
1 675 . 12 1 1 A 60 60 SER CB C 60 64.160 64.626 -0.466 1
1 676 . 12 1 1 A 60 60 SER N N 60 117.320 120.861 -3.541 1
1 677 . 12 1 1 A 61 61 GLU H H 61 8.550 8.675 -0.125 1
1 678 . 12 1 1 A 61 61 GLU HA H 61 4.400 4.222 0.178 1
1 683 . 12 1 1 A 61 61 GLU C C 61 176.150 176.180 -0.030 1
1 684 . 12 1 1 A 61 61 GLU CA C 61 56.300 57.948 -1.648 1
1 685 . 12 1 1 A 61 61 GLU CB C 61 30.790 30.532 0.258 1
1 687 . 12 1 1 A 61 61 GLU N N 61 122.810 125.207 -2.397 1
1 688 . 12 1 1 A 62 62 ARG H H 62 8.310 7.133 1.177 1
1 689 . 12 1 1 A 62 62 ARG HA H 62 4.340 4.712 -0.372 1
1 692 . 12 1 1 A 62 62 ARG C C 62 176.140 174.342 1.798 1
1 693 . 12 1 1 A 62 62 ARG CA C 62 56.230 54.345 1.885 1
1 694 . 12 1 1 A 62 62 ARG CB C 62 30.780 33.353 -2.573 1
1 695 . 12 1 1 A 62 62 ARG N N 62 122.080 118.105 3.975 1
1 696 . 12 1 1 A 63 63 LYS H H 63 8.470 8.485 -0.015 1
1 697 . 12 1 1 A 63 63 LYS HA H 63 4.300 4.717 -0.417 1
1 700 . 12 1 1 A 63 63 LYS C C 63 175.490 175.057 0.433 1
1 701 . 12 1 1 A 63 63 LYS CA C 63 56.200 54.370 1.830 1
1 702 . 12 1 1 A 63 63 LYS CB C 63 30.730 35.531 -4.801 1
1 703 . 12 1 1 A 63 63 LYS N N 63 123.450 122.348 1.102 1
1 704 . 12 1 1 A 64 64 PHE H H 64 8.200 8.888 -0.688 1
1 705 . 12 1 1 A 64 64 PHE HA H 64 4.450 4.515 -0.065 1
1 710 . 12 1 1 A 64 64 PHE C C 64 174.250 175.535 -1.285 1
1 711 . 12 1 1 A 64 64 PHE CA C 64 57.430 56.631 0.799 1
1 712 . 12 1 1 A 64 64 PHE CB C 64 40.330 40.866 -0.536 1
1 715 . 12 1 1 A 64 64 PHE N N 64 121.740 121.315 0.425 1
1 716 . 12 1 1 A 65 65 PHE H H 65 8.130 8.064 0.066 1
1 717 . 12 1 1 A 65 65 PHE HA H 65 4.440 3.921 0.519 1
1 725 . 12 1 1 A 65 65 PHE CA C 65 55.650 58.481 -2.831 1
1 726 . 12 1 1 A 65 65 PHE CB C 65 38.900 36.618 2.282 1
1 731 . 12 1 1 A 65 65 PHE N N 65 120.910 118.230 2.680 1
1 732 . 12 1 1 A 66 66 PRO C C 66 176.780 177.953 -1.173 1
1 733 . 12 1 1 A 67 67 GLY H H 67 9.970 8.895 1.075 1
1 734 . 12 1 1 A 67 67 GLY HA2 H 67 3.820 4.048 -0.228 1
1 735 . 12 1 1 A 67 67 GLY HA3 H 67 4.400 4.089 0.311 1
1 736 . 12 1 1 A 67 67 GLY C C 67 173.670 173.913 -0.243 1
1 737 . 12 1 1 A 67 67 GLY CA C 67 45.900 45.677 0.223 1
1 738 . 12 1 1 A 67 67 GLY N N 67 111.550 112.787 -1.237 1
1 739 . 12 1 1 A 68 68 TYR H H 68 7.650 7.839 -0.189 1
1 740 . 12 1 1 A 68 68 TYR HA H 68 5.000 4.885 0.115 1
1 747 . 12 1 1 A 68 68 TYR C C 68 175.220 174.745 0.475 1
1 748 . 12 1 1 A 68 68 TYR CA C 68 57.940 57.320 0.620 1
1 753 . 12 1 1 A 68 68 TYR N N 68 118.800 119.480 -0.680 1
1 754 . 12 1 1 A 69 69 VAL H H 69 9.090 8.870 0.220 1
1 755 . 12 1 1 A 69 69 VAL HA H 69 4.330 4.819 -0.489 1
1 763 . 12 1 1 A 69 69 VAL C C 69 174.250 174.754 -0.504 1
1 764 . 12 1 1 A 69 69 VAL CA C 69 62.120 60.296 1.824 1
1 765 . 12 1 1 A 69 69 VAL CB C 69 35.240 35.850 -0.610 1
1 768 . 12 1 1 A 69 69 VAL N N 69 119.300 122.711 -3.411 1
1 769 . 12 1 1 A 70 70 LEU H H 70 9.190 8.406 0.784 1
1 770 . 12 1 1 A 70 70 LEU HA H 70 5.460 5.262 0.198 1
1 780 . 12 1 1 A 70 70 LEU C C 70 176.130 176.186 -0.056 1
1 781 . 12 1 1 A 70 70 LEU CA C 70 54.120 53.242 0.878 1
1 782 . 12 1 1 A 70 70 LEU CB C 70 43.330 43.372 -0.042 1
1 786 . 12 1 1 A 70 70 LEU N N 70 126.710 126.754 -0.044 1
1 787 . 12 1 1 A 71 71 VAL H H 71 9.350 9.148 0.202 1
1 788 . 12 1 1 A 71 71 VAL HA H 71 5.040 4.904 0.136 1
1 796 . 12 1 1 A 71 71 VAL C C 71 173.670 174.632 -0.962 1
1 797 . 12 1 1 A 71 71 VAL CA C 71 61.090 61.401 -0.311 1
1 798 . 12 1 1 A 71 71 VAL CB C 71 35.800 35.518 0.282 1
1 801 . 12 1 1 A 71 71 VAL N N 71 121.920 124.295 -2.375 1
1 802 . 12 1 1 A 72 72 GLN H H 72 8.390 8.881 -0.491 1
1 803 . 12 1 1 A 72 72 GLN HA H 72 4.610 4.330 0.280 1
1 810 . 12 1 1 A 72 72 GLN C C 72 175.920 174.548 1.372 1
1 811 . 12 1 1 A 72 72 GLN CA C 72 53.810 54.972 -1.162 1
1 812 . 12 1 1 A 72 72 GLN CB C 72 28.850 28.140 0.710 1
1 814 . 12 1 1 A 72 72 GLN N N 72 130.760 127.796 2.964 1
1 816 . 12 1 1 A 73 73 MET H H 73 9.750 8.735 1.015 1
1 817 . 12 1 1 A 73 73 MET HA H 73 5.060 5.077 -0.017 1
1 825 . 12 1 1 A 73 73 MET C C 73 175.500 174.636 0.864 1
1 826 . 12 1 1 A 73 73 MET CA C 73 55.520 54.389 1.131 1
1 827 . 12 1 1 A 73 73 MET CB C 73 35.350 35.545 -0.195 1
1 830 . 12 1 1 A 73 73 MET N N 73 121.070 125.157 -4.087 1
1 831 . 12 1 1 A 74 74 VAL H H 74 8.530 8.575 -0.045 1
1 832 . 12 1 1 A 74 74 VAL HA H 74 3.970 4.268 -0.298 1
1 840 . 12 1 1 A 74 74 VAL C C 74 174.900 175.298 -0.398 1
1 841 . 12 1 1 A 74 74 VAL CA C 74 62.150 62.207 -0.057 1
1 842 . 12 1 1 A 74 74 VAL CB C 74 32.480 32.480 0.000 1
1 845 . 12 1 1 A 74 74 VAL N N 74 124.120 123.399 0.721 1
1 846 . 12 1 1 A 75 75 MET H H 75 8.600 8.993 -0.393 1
1 847 . 12 1 1 A 75 75 MET HA H 75 4.360 4.339 0.021 1
1 855 . 12 1 1 A 75 75 MET C C 75 173.480 175.373 -1.893 1
1 856 . 12 1 1 A 75 75 MET CA C 75 53.830 55.768 -1.938 1
1 857 . 12 1 1 A 75 75 MET CB C 75 29.960 32.791 -2.831 1
1 860 . 12 1 1 A 75 75 MET N N 75 128.250 127.224 1.026 1
1 861 . 12 1 1 A 76 76 ASN H H 76 8.410 8.882 -0.472 1
1 862 . 12 1 1 A 76 76 ASN HA H 76 4.540 4.994 -0.454 1
1 867 . 12 1 1 A 76 76 ASN C C 76 173.950 174.280 -0.330 1
1 868 . 12 1 1 A 76 76 ASN CA C 76 51.720 52.259 -0.539 1
1 869 . 12 1 1 A 76 76 ASN CB C 76 38.430 39.244 -0.814 1
1 870 . 12 1 1 A 76 76 ASN N N 76 127.500 121.411 6.089 1
1 872 . 12 1 1 A 77 77 ASP H H 77 8.470 8.601 -0.131 1
1 873 . 12 1 1 A 77 77 ASP HA H 77 4.410 4.978 -0.568 1
1 876 . 12 1 1 A 77 77 ASP C C 77 178.530 176.607 1.923 1
1 877 . 12 1 1 A 77 77 ASP CA C 77 58.730 53.995 4.735 1
1 878 . 12 1 1 A 77 77 ASP CB C 77 40.940 41.438 -0.498 1
1 879 . 12 1 1 A 77 77 ASP N N 77 117.090 116.156 0.934 1
1 880 . 12 1 1 A 78 78 ALA H H 78 8.160 7.984 0.176 1
1 881 . 12 1 1 A 78 78 ALA HA H 78 4.350 4.683 -0.333 1
1 885 . 12 1 1 A 78 78 ALA C C 78 181.250 178.261 2.989 1
1 886 . 12 1 1 A 78 78 ALA CA C 78 55.190 53.527 1.663 1
1 887 . 12 1 1 A 78 78 ALA CB C 78 18.260 20.815 -2.555 1
1 888 . 12 1 1 A 78 78 ALA N N 78 122.500 123.427 -0.927 1
1 889 . 12 1 1 A 79 79 SER H H 79 9.320 9.264 0.056 1
1 890 . 12 1 1 A 79 79 SER HA H 79 4.290 4.242 0.048 1
1 893 . 12 1 1 A 79 79 SER C C 79 176.570 175.746 0.824 1
1 894 . 12 1 1 A 79 79 SER CA C 79 61.080 62.498 -1.418 1
1 895 . 12 1 1 A 79 79 SER CB C 79 62.200 63.002 -0.802 1
1 896 . 12 1 1 A 79 79 SER N N 79 119.280 115.085 4.195 1
1 897 . 12 1 1 A 80 80 TRP H H 80 8.900 7.651 1.249 1
1 898 . 12 1 1 A 80 80 TRP HA H 80 4.020 4.243 -0.223 1
1 907 . 12 1 1 A 80 80 TRP C C 80 178.210 178.557 -0.347 1
1 908 . 12 1 1 A 80 80 TRP CA C 80 62.490 61.373 1.117 1
1 909 . 12 1 1 A 80 80 TRP CB C 80 29.800 29.011 0.789 1
1 915 . 12 1 1 A 80 80 TRP N N 80 125.870 123.703 2.167 1
1 917 . 12 1 1 A 81 81 HIS H H 81 8.190 8.294 -0.104 1
1 918 . 12 1 1 A 81 81 HIS HA H 81 3.930 4.391 -0.461 1
1 923 . 12 1 1 A 81 81 HIS C C 81 177.740 177.907 -0.167 1
1 924 . 12 1 1 A 81 81 HIS CA C 81 61.020 59.834 1.186 1
1 925 . 12 1 1 A 81 81 HIS CB C 81 28.910 30.704 -1.794 1
1 927 . 12 1 1 A 81 81 HIS N N 81 114.080 117.215 -3.135 1
1 928 . 12 1 1 A 82 82 LEU H H 82 8.080 8.119 -0.039 1
1 929 . 12 1 1 A 82 82 LEU HA H 82 3.900 3.813 0.087 1
1 939 . 12 1 1 A 82 82 LEU C C 82 180.330 178.525 1.805 1
1 940 . 12 1 1 A 82 82 LEU CA C 82 58.590 58.272 0.318 1
1 941 . 12 1 1 A 82 82 LEU CB C 82 41.350 41.526 -0.176 1
1 945 . 12 1 1 A 82 82 LEU N N 82 121.320 121.422 -0.102 1
1 946 . 12 1 1 A 83 83 VAL H H 83 8.000 8.284 -0.284 1
1 947 . 12 1 1 A 83 83 VAL HA H 83 3.210 3.461 -0.251 1
1 955 . 12 1 1 A 83 83 VAL C C 83 177.060 178.224 -1.164 1
1 956 . 12 1 1 A 83 83 VAL CA C 83 67.430 66.689 0.741 1
1 957 . 12 1 1 A 83 83 VAL CB C 83 31.680 31.281 0.399 1
1 960 . 12 1 1 A 83 83 VAL N N 83 118.850 118.706 0.144 1
1 961 . 12 1 1 A 84 84 ARG H H 84 7.540 7.579 -0.039 1
1 962 . 12 1 1 A 84 84 ARG HA H 84 3.590 3.722 -0.132 1
1 969 . 12 1 1 A 84 84 ARG C C 84 177.240 178.622 -1.382 1
1 970 . 12 1 1 A 84 84 ARG CA C 84 56.050 59.679 -3.629 1
1 971 . 12 1 1 A 84 84 ARG CB C 84 28.190 29.726 -1.536 1
1 974 . 12 1 1 A 84 84 ARG N N 84 111.460 120.422 -8.962 1
1 975 . 12 1 1 A 85 85 SER H H 85 7.530 7.636 -0.106 1
1 976 . 12 1 1 A 85 85 SER HA H 85 4.280 4.112 0.168 1
1 979 . 12 1 1 A 85 85 SER C C 85 173.930 175.117 -1.187 1
1 980 . 12 1 1 A 85 85 SER CA C 85 59.220 62.268 -3.048 1
1 981 . 12 1 1 A 85 85 SER CB C 85 63.830 62.817 1.013 1
1 982 . 12 1 1 A 85 85 SER N N 85 113.660 114.767 -1.107 1
1 983 . 12 1 1 A 86 86 VAL H H 86 7.230 7.247 -0.017 1
1 984 . 12 1 1 A 86 86 VAL HA H 86 3.480 3.640 -0.160 1
1 992 . 12 1 1 A 86 86 VAL CA C 86 61.300 61.267 0.033 1
1 993 . 12 1 1 A 86 86 VAL CB C 86 31.780 31.955 -0.175 1
1 996 . 12 1 1 A 86 86 VAL N N 86 128.120 121.992 6.128 1
1 997 . 12 1 1 A 87 87 PRO HA H 87 4.140 4.324 -0.184 1
1 1004 . 12 1 1 A 87 87 PRO C C 87 176.400 176.648 -0.248 1
1 1005 . 12 1 1 A 87 87 PRO CA C 87 64.100 63.278 0.822 1
1 1006 . 12 1 1 A 87 87 PRO CB C 87 31.710 32.299 -0.589 1
1 1009 . 12 1 1 A 88 88 ARG H H 88 8.320 8.676 -0.356 1
1 1010 . 12 1 1 A 88 88 ARG HA H 88 3.030 3.457 -0.427 1
1 1017 . 12 1 1 A 88 88 ARG C C 88 174.630 174.006 0.624 1
1 1018 . 12 1 1 A 88 88 ARG CA C 88 57.620 57.044 0.576 1
1 1019 . 12 1 1 A 88 88 ARG CB C 88 26.960 27.729 -0.769 1
1 1022 . 12 1 1 A 88 88 ARG N N 88 111.360 115.888 -4.528 1
1 1023 . 12 1 1 A 89 89 VAL H H 89 7.390 7.494 -0.104 1
1 1024 . 12 1 1 A 89 89 VAL HA H 89 3.910 4.231 -0.321 1
1 1032 . 12 1 1 A 89 89 VAL C C 89 177.370 174.976 2.394 1
1 1033 . 12 1 1 A 89 89 VAL CA C 89 64.170 59.172 4.998 1
1 1034 . 12 1 1 A 89 89 VAL CB C 89 32.070 34.606 -2.536 1
1 1037 . 12 1 1 A 89 89 VAL N N 89 117.900 117.905 -0.005 1
1 1038 . 12 1 1 A 90 90 MET H H 90 9.290 8.694 0.596 1
1 1039 . 12 1 1 A 90 90 MET HA H 90 4.340 4.357 -0.017 1
1 1047 . 12 1 1 A 90 90 MET C C 90 175.800 175.875 -0.075 1
1 1048 . 12 1 1 A 90 90 MET CA C 90 56.440 56.683 -0.243 1
1 1049 . 12 1 1 A 90 90 MET CB C 90 34.160 33.759 0.401 1
1 1052 . 12 1 1 A 90 90 MET N N 90 128.200 126.077 2.123 1
1 1053 . 12 1 1 A 91 91 GLY H H 91 7.130 7.223 -0.093 1
1 1054 . 12 1 1 A 91 91 GLY HA2 H 91 3.340 3.942 -0.602 1
1 1055 . 12 1 1 A 91 91 GLY HA3 H 91 4.410 4.056 0.354 1
1 1056 . 12 1 1 A 91 91 GLY C C 91 170.920 171.367 -0.447 1
1 1057 . 12 1 1 A 91 91 GLY CA C 91 44.440 45.863 -1.423 1
1 1058 . 12 1 1 A 91 91 GLY N N 91 104.320 103.890 0.430 1
1 1059 . 12 1 1 A 92 92 PHE H H 92 8.790 8.490 0.300 1
1 1060 . 12 1 1 A 92 92 PHE HA H 92 5.270 5.171 0.099 1
1 1068 . 12 1 1 A 92 92 PHE C C 92 176.230 175.130 1.100 1
1 1069 . 12 1 1 A 92 92 PHE CA C 92 57.480 56.901 0.579 1
1 1070 . 12 1 1 A 92 92 PHE CB C 92 42.190 43.245 -1.055 1
1 1075 . 12 1 1 A 92 92 PHE N N 92 118.770 119.968 -1.198 1
1 1076 . 12 1 1 A 93 93 ILE H H 93 8.800 8.326 0.474 1
1 1077 . 12 1 1 A 93 93 ILE HA H 93 4.310 5.222 -0.912 1
1 1087 . 12 1 1 A 93 93 ILE C C 93 176.380 175.687 0.693 1
1 1088 . 12 1 1 A 93 93 ILE CA C 93 60.480 59.863 0.617 1
1 1089 . 12 1 1 A 93 93 ILE CB C 93 38.010 41.186 -3.176 1
1 1093 . 12 1 1 A 93 93 ILE N N 93 122.300 121.485 0.815 1
1 1094 . 12 1 1 A 94 94 GLY H H 94 8.640 8.547 0.093 1
1 1095 . 12 1 1 A 94 94 GLY HA2 H 94 3.830 4.314 -0.484 1
1 1096 . 12 1 1 A 94 94 GLY HA3 H 94 4.600 4.315 0.285 1
1 1097 . 12 1 1 A 94 94 GLY C C 94 175.080 174.405 0.675 1
1 1098 . 12 1 1 A 94 94 GLY CA C 94 44.530 45.841 -1.311 1
1 1099 . 12 1 1 A 94 94 GLY N N 94 116.550 112.945 3.605 1
1 1100 . 12 1 1 A 95 95 GLY H H 95 8.900 8.817 0.083 1
1 1101 . 12 1 1 A 95 95 GLY HA2 H 95 3.970 3.909 0.061 1
1 1102 . 12 1 1 A 95 95 GLY HA3 H 95 4.370 3.920 0.450 1
1 1103 . 12 1 1 A 95 95 GLY C C 95 174.560 174.245 0.315 1
1 1104 . 12 1 1 A 95 95 GLY CA C 95 45.640 46.963 -1.323 1
1 1105 . 12 1 1 A 95 95 GLY N N 95 112.960 109.846 3.114 1
1 1106 . 12 1 1 A 96 96 THR H H 96 7.830 7.708 0.122 1
1 1107 . 12 1 1 A 96 96 THR HA H 96 4.720 4.788 -0.068 1
1 1112 . 12 1 1 A 96 96 THR C C 96 176.260 174.181 2.079 1
1 1113 . 12 1 1 A 96 96 THR CA C 96 60.360 59.619 0.741 1
1 1114 . 12 1 1 A 96 96 THR CB C 96 70.960 71.760 -0.800 1
1 1116 . 12 1 1 A 96 96 THR N N 96 113.350 110.665 2.685 1
1 1117 . 12 1 1 A 97 97 SER H H 97 8.850 8.775 0.075 1
1 1118 . 12 1 1 A 97 97 SER HA H 97 4.310 4.823 -0.513 1
1 1121 . 12 1 1 A 97 97 SER C C 97 175.570 174.677 0.893 1
1 1122 . 12 1 1 A 97 97 SER CA C 97 60.850 58.287 2.563 1
1 1123 . 12 1 1 A 97 97 SER CB C 97 63.000 63.928 -0.928 1
1 1124 . 12 1 1 A 97 97 SER N N 97 116.420 116.808 -0.388 1
1 1125 . 12 1 1 A 98 98 ASP H H 98 8.360 7.913 0.447 1
1 1126 . 12 1 1 A 98 98 ASP HA H 98 4.310 4.794 -0.484 1
1 1129 . 12 1 1 A 98 98 ASP C C 98 175.380 175.692 -0.312 1
1 1130 . 12 1 1 A 98 98 ASP CA C 98 54.190 54.993 -0.803 1
1 1131 . 12 1 1 A 98 98 ASP CB C 98 40.740 43.620 -2.880 1
1 1132 . 12 1 1 A 98 98 ASP N N 98 116.320 119.641 -3.321 1
1 1133 . 12 1 1 A 99 99 ARG H H 99 7.450 7.729 -0.279 1
1 1134 . 12 1 1 A 99 99 ARG HA H 99 4.350 4.584 -0.234 1
1 1141 . 12 1 1 A 99 99 ARG CA C 99 52.920 53.164 -0.244 1
1 1142 . 12 1 1 A 99 99 ARG CB C 99 30.340 31.276 -0.936 1
1 1145 . 12 1 1 A 99 99 ARG N N 99 119.960 117.924 2.036 1
1 1146 . 12 1 1 A 100 100 PRO HA H 100 4.750 4.455 0.295 1
1 1153 . 12 1 1 A 100 100 PRO C C 100 175.220 177.205 -1.985 1
1 1154 . 12 1 1 A 100 100 PRO CA C 100 62.680 62.579 0.101 1
1 1155 . 12 1 1 A 100 100 PRO CB C 100 32.820 32.288 0.532 1
1 1158 . 12 1 1 A 101 101 ALA H H 101 7.210 8.446 -1.236 1
1 1159 . 12 1 1 A 101 101 ALA HA H 101 5.030 4.620 0.410 1
1 1163 . 12 1 1 A 101 101 ALA CA C 101 48.570 50.224 -1.654 1
1 1164 . 12 1 1 A 101 101 ALA CB C 101 19.660 17.223 2.437 1
1 1165 . 12 1 1 A 101 101 ALA N N 101 124.490 124.378 0.112 1
1 1166 . 12 1 1 A 102 102 PRO HA H 102 4.440 4.521 -0.081 1
1 1173 . 12 1 1 A 102 102 PRO C C 102 177.200 176.495 0.705 1
1 1174 . 12 1 1 A 102 102 PRO CA C 102 62.190 62.763 -0.573 1
1 1175 . 12 1 1 A 102 102 PRO CB C 102 32.310 32.758 -0.448 1
1 1178 . 12 1 1 A 103 103 ILE H H 103 8.550 8.161 0.389 1
1 1179 . 12 1 1 A 103 103 ILE HA H 103 4.630 4.905 -0.275 1
1 1189 . 12 1 1 A 103 103 ILE C C 103 175.460 175.077 0.383 1
1 1190 . 12 1 1 A 103 103 ILE CA C 103 59.730 58.572 1.158 1
1 1191 . 12 1 1 A 103 103 ILE CB C 103 40.140 42.008 -1.868 1
1 1195 . 12 1 1 A 103 103 ILE N N 103 115.670 116.273 -0.603 1
1 1196 . 12 1 1 A 104 104 SER H H 104 8.730 8.738 -0.008 1
1 1197 . 12 1 1 A 104 104 SER HA H 104 4.500 4.822 -0.322 1
1 1200 . 12 1 1 A 104 104 SER C C 104 174.840 175.395 -0.555 1
1 1201 . 12 1 1 A 104 104 SER CA C 104 58.010 57.066 0.944 1
1 1202 . 12 1 1 A 104 104 SER CB C 104 65.470 65.593 -0.123 1
1 1203 . 12 1 1 A 104 104 SER N N 104 119.170 117.177 1.993 1
1 1204 . 12 1 1 A 105 105 ASP H H 105 8.830 9.089 -0.259 1
1 1205 . 12 1 1 A 105 105 ASP HA H 105 4.200 4.189 0.011 1
1 1208 . 12 1 1 A 105 105 ASP C C 105 178.520 178.316 0.204 1
1 1209 . 12 1 1 A 105 105 ASP CA C 105 57.870 57.624 0.246 1
1 1210 . 12 1 1 A 105 105 ASP CB C 105 40.040 40.275 -0.235 1
1 1211 . 12 1 1 A 105 105 ASP N N 105 121.640 121.475 0.165 1
1 1212 . 12 1 1 A 106 106 LYS H H 106 8.130 8.035 0.095 1
1 1213 . 12 1 1 A 106 106 LYS HA H 106 4.100 3.891 0.209 1
1 1222 . 12 1 1 A 106 106 LYS C C 106 179.400 178.117 1.283 1
1 1223 . 12 1 1 A 106 106 LYS CA C 106 58.980 59.323 -0.343 1
1 1224 . 12 1 1 A 106 106 LYS CB C 106 32.330 32.059 0.271 1
1 1228 . 12 1 1 A 106 106 LYS N N 106 118.300 121.436 -3.136 1
1 1229 . 12 1 1 A 107 107 GLU H H 107 7.670 7.600 0.070 1
1 1230 . 12 1 1 A 107 107 GLU HA H 107 4.020 4.113 -0.093 1
1 1235 . 12 1 1 A 107 107 GLU C C 107 178.750 178.986 -0.236 1
1 1236 . 12 1 1 A 107 107 GLU CA C 107 59.210 58.981 0.229 1
1 1237 . 12 1 1 A 107 107 GLU CB C 107 29.780 29.482 0.298 1
1 1239 . 12 1 1 A 107 107 GLU N N 107 121.270 118.819 2.451 1
1 1240 . 12 1 1 A 108 108 VAL H H 108 7.790 7.735 0.055 1
1 1241 . 12 1 1 A 108 108 VAL HA H 108 3.050 3.406 -0.356 1
1 1249 . 12 1 1 A 108 108 VAL C C 108 177.550 177.661 -0.111 1
1 1250 . 12 1 1 A 108 108 VAL CA C 108 67.080 66.442 0.638 1
1 1251 . 12 1 1 A 108 108 VAL CB C 108 31.220 30.958 0.262 1
1 1254 . 12 1 1 A 108 108 VAL N N 108 120.940 120.206 0.734 1
1 1255 . 12 1 1 A 109 109 ASP H H 109 7.840 7.818 0.022 1
1 1256 . 12 1 1 A 109 109 ASP HA H 109 4.110 4.249 -0.139 1
1 1259 . 12 1 1 A 109 109 ASP C C 109 178.190 178.418 -0.228 1
1 1260 . 12 1 1 A 109 109 ASP CA C 109 57.470 56.920 0.550 1
1 1261 . 12 1 1 A 109 109 ASP CB C 109 40.480 40.054 0.426 1
1 1262 . 12 1 1 A 109 109 ASP N N 109 118.780 121.089 -2.309 1
1 1263 . 12 1 1 A 110 110 ALA H H 110 7.520 7.630 -0.110 1
1 1264 . 12 1 1 A 110 110 ALA HA H 110 4.110 4.435 -0.325 1
1 1268 . 12 1 1 A 110 110 ALA C C 110 180.550 179.793 0.757 1
1 1269 . 12 1 1 A 110 110 ALA CA C 110 54.880 54.944 -0.064 1
1 1270 . 12 1 1 A 110 110 ALA CB C 110 18.440 18.377 0.063 1
1 1271 . 12 1 1 A 110 110 ALA N N 110 120.640 123.065 -2.425 1
1 1272 . 12 1 1 A 111 111 ILE H H 111 7.840 7.658 0.182 1
1 1273 . 12 1 1 A 111 111 ILE HA H 111 3.580 3.604 -0.024 1
1 1281 . 12 1 1 A 111 111 ILE C C 111 177.470 177.953 -0.483 1
1 1282 . 12 1 1 A 111 111 ILE CA C 111 64.620 64.908 -0.288 1
1 1283 . 12 1 1 A 111 111 ILE CB C 111 38.600 37.645 0.955 1
1 1286 . 12 1 1 A 111 111 ILE N N 111 119.840 119.259 0.581 1
1 1287 . 12 1 1 A 112 112 MET H H 112 8.100 7.691 0.409 1
1 1288 . 12 1 1 A 112 112 MET HA H 112 4.400 4.104 0.296 1
1 1296 . 12 1 1 A 112 112 MET C C 112 177.710 178.862 -1.152 1
1 1297 . 12 1 1 A 112 112 MET CA C 112 55.300 58.777 -3.477 1
1 1298 . 12 1 1 A 112 112 MET CB C 112 30.510 32.928 -2.418 1
1 1301 . 12 1 1 A 112 112 MET N N 112 115.180 118.241 -3.061 1
1 1302 . 12 1 1 A 113 113 ASN H H 113 8.070 7.953 0.117 1
1 1303 . 12 1 1 A 113 113 ASN HA H 113 4.570 4.372 0.198 1
1 1308 . 12 1 1 A 113 113 ASN C C 113 175.530 178.292 -2.762 1
1 1309 . 12 1 1 A 113 113 ASN CA C 113 54.420 56.419 -1.999 1
1 1310 . 12 1 1 A 113 113 ASN CB C 113 38.350 37.975 0.375 1
1 1311 . 12 1 1 A 113 113 ASN N N 113 117.190 117.223 -0.033 1
1 1313 . 12 1 1 A 114 114 ARG H H 114 8.070 7.668 0.402 1
1 1314 . 12 1 1 A 114 114 ARG HA H 114 4.280 3.940 0.340 1
1 1321 . 12 1 1 A 114 114 ARG C C 114 176.620 178.388 -1.768 1
1 1322 . 12 1 1 A 114 114 ARG CA C 114 56.910 59.206 -2.296 1
1 1323 . 12 1 1 A 114 114 ARG CB C 114 30.370 30.104 0.266 1
1 1326 . 12 1 1 A 114 114 ARG N N 114 118.360 119.864 -1.504 1
1 1327 . 12 1 1 A 115 115 LEU H H 115 8.100 8.251 -0.151 1
1 1328 . 12 1 1 A 115 115 LEU HA H 115 4.310 3.278 1.032 1
1 1338 . 12 1 1 A 115 115 LEU C C 115 177.440 177.886 -0.446 1
1 1339 . 12 1 1 A 115 115 LEU CA C 115 55.440 57.915 -2.475 1
1 1340 . 12 1 1 A 115 115 LEU CB C 115 42.250 41.708 0.542 1
1 1344 . 12 1 1 A 115 115 LEU N N 115 120.580 121.462 -0.882 1
1 1345 . 12 1 1 A 116 116 GLN H H 116 8.180 7.241 0.939 1
1 1346 . 12 1 1 A 116 116 GLN HA H 116 4.360 3.981 0.379 1
1 1353 . 12 1 1 A 116 116 GLN C C 116 175.890 176.369 -0.479 1
1 1354 . 12 1 1 A 116 116 GLN CA C 116 55.810 58.963 -3.153 1
1 1355 . 12 1 1 A 116 116 GLN CB C 116 29.500 28.400 1.100 1
1 1357 . 12 1 1 A 116 116 GLN N N 116 119.770 117.891 1.879 1
1 1358 . 12 1 1 A 117 117 GLN H H 117 8.350 8.214 0.136 1
1 1359 . 12 1 1 A 117 117 GLN HA H 117 4.380 4.329 0.051 1
1 1366 . 12 1 1 A 117 117 GLN C C 117 176.130 176.849 -0.719 1
1 1367 . 12 1 1 A 117 117 GLN CA C 117 55.810 55.644 0.166 1
1 1368 . 12 1 1 A 117 117 GLN CB C 117 29.500 30.694 -1.194 1
1 1370 . 12 1 1 A 117 117 GLN N N 117 121.440 119.165 2.275 1
1 1371 . 12 1 1 A 118 118 VAL H H 118 8.240 8.720 -0.480 1
1 1372 . 12 1 1 A 118 118 VAL HA H 118 4.120 3.687 0.433 1
1 1380 . 12 1 1 A 118 118 VAL C C 118 176.650 176.736 -0.086 1
1 1381 . 12 1 1 A 118 118 VAL CA C 118 62.720 64.903 -2.183 1
1 1382 . 12 1 1 A 118 118 VAL CB C 118 32.730 32.190 0.540 1
1 1385 . 12 1 1 A 118 118 VAL N N 118 121.250 124.983 -3.733 1
1 1386 . 12 1 1 A 119 119 GLY H H 119 8.460 8.080 0.380 1
1 1387 . 12 1 1 A 119 119 GLY HA2 H 119 3.990 3.991 -0.001 1
1 1388 . 12 1 1 A 119 119 GLY HA3 H 119 3.990 4.049 -0.059 1
1 1389 . 12 1 1 A 119 119 GLY C C 119 173.770 174.553 -0.783 1
1 1390 . 12 1 1 A 119 119 GLY CA C 119 45.260 46.191 -0.931 1
1 1391 . 12 1 1 A 119 119 GLY N N 119 112.300 109.864 2.436 1
1 1392 . 12 1 1 A 120 120 ASP H H 120 8.230 8.191 0.039 1
1 1393 . 12 1 1 A 120 120 ASP HA H 120 4.580 4.734 -0.154 1
1 1396 . 12 1 1 A 120 120 ASP C C 120 175.180 175.335 -0.155 1
1 1397 . 12 1 1 A 120 120 ASP CA C 120 54.340 53.849 0.491 1
1 1398 . 12 1 1 A 120 120 ASP CB C 120 41.390 41.987 -0.597 1
1 1399 . 12 1 1 A 120 120 ASP N N 120 120.420 121.004 -0.584 1
1 1400 . 12 1 1 A 121 121 LYS H H 121 7.950 8.247 -0.297 1
1 1401 . 12 1 1 A 121 121 LYS HA H 121 4.240 5.051 -0.811 1
1 1402 . 12 1 1 A 121 121 LYS CA C 121 53.620 53.668 -0.048 1
1 1403 . 12 1 1 A 121 121 LYS N N 121 119.110 120.497 -1.387 1
1 1404 . 12 1 1 A 122 122 PRO HA H 122 4.410 4.539 -0.129 1
1 1405 . 12 1 1 A 122 122 PRO C C 122 176.560 176.893 -0.333 1
1 1406 . 12 1 1 A 122 122 PRO CA C 122 63.130 64.414 -1.284 1
1 2 . 13 1 1 A 2 2 SER H H 2 7.890 8.077 -0.187 1
1 3 . 13 1 1 A 2 2 SER HA H 2 4.270 4.205 0.065 1
1 4 . 13 1 1 A 2 2 SER C C 2 173.960 174.035 -0.075 1
1 5 . 13 1 1 A 2 2 SER CA C 2 60.800 61.307 -0.507 1
1 6 . 13 1 1 A 2 2 SER N N 2 111.940 114.585 -2.645 1
1 7 . 13 1 1 A 3 3 GLU H H 3 8.010 7.682 0.328 1
1 8 . 13 1 1 A 3 3 GLU HA H 3 4.360 4.824 -0.464 1
1 9 . 13 1 1 A 3 3 GLU C C 3 175.710 174.932 0.778 1
1 10 . 13 1 1 A 3 3 GLU CA C 3 56.310 55.633 0.677 1
1 11 . 13 1 1 A 3 3 GLU N N 3 121.280 120.189 1.091 1
1 12 . 13 1 1 A 4 4 ALA H H 4 8.540 8.753 -0.213 1
1 13 . 13 1 1 A 4 4 ALA HA H 4 4.560 5.008 -0.448 1
1 14 . 13 1 1 A 4 4 ALA CA C 4 50.630 49.793 0.837 1
1 15 . 13 1 1 A 4 4 ALA N N 4 127.840 128.257 -0.417 1
1 16 . 13 1 1 A 5 5 PRO HA H 5 4.420 4.558 -0.138 1
1 17 . 13 1 1 A 5 5 PRO C C 5 174.240 176.691 -2.451 1
1 18 . 13 1 1 A 5 5 PRO CA C 5 62.840 62.586 0.254 1
1 19 . 13 1 1 A 6 6 LYS H H 6 8.320 8.447 -0.127 1
1 20 . 13 1 1 A 6 6 LYS HA H 6 4.290 4.601 -0.311 1
1 21 . 13 1 1 A 6 6 LYS C C 6 176.100 176.282 -0.182 1
1 22 . 13 1 1 A 6 6 LYS CA C 6 55.540 55.853 -0.313 1
1 23 . 13 1 1 A 6 6 LYS N N 6 121.910 121.481 0.429 1
1 24 . 13 1 1 A 7 7 LYS H H 7 8.450 9.042 -0.592 1
1 25 . 13 1 1 A 7 7 LYS HA H 7 3.940 4.892 -0.952 1
1 26 . 13 1 1 A 7 7 LYS C C 7 175.700 174.963 0.737 1
1 27 . 13 1 1 A 7 7 LYS CA C 7 56.440 54.449 1.991 1
1 28 . 13 1 1 A 7 7 LYS N N 7 122.250 119.293 2.957 1
1 29 . 13 1 1 A 8 8 ARG H H 8 8.210 8.587 -0.377 1
1 30 . 13 1 1 A 8 8 ARG HA H 8 4.670 4.752 -0.082 1
1 31 . 13 1 1 A 8 8 ARG C C 8 173.760 174.125 -0.365 1
1 32 . 13 1 1 A 8 8 ARG CA C 8 53.420 53.809 -0.389 1
1 33 . 13 1 1 A 8 8 ARG N N 8 122.560 121.762 0.798 1
1 34 . 13 1 1 A 9 9 TRP H H 9 8.610 8.587 0.023 1
1 35 . 13 1 1 A 9 9 TRP HA H 9 4.910 5.245 -0.335 1
1 44 . 13 1 1 A 9 9 TRP C C 9 174.610 175.217 -0.607 1
1 45 . 13 1 1 A 9 9 TRP CA C 9 57.630 55.175 2.455 1
1 46 . 13 1 1 A 9 9 TRP CB C 9 31.020 31.022 -0.002 1
1 52 . 13 1 1 A 9 9 TRP N N 9 120.540 121.391 -0.851 1
1 54 . 13 1 1 A 10 10 TYR H H 10 9.260 9.251 0.009 1
1 55 . 13 1 1 A 10 10 TYR HA H 10 4.820 5.237 -0.417 1
1 62 . 13 1 1 A 10 10 TYR C C 10 174.340 175.017 -0.677 1
1 63 . 13 1 1 A 10 10 TYR CA C 10 57.050 56.293 0.757 1
1 64 . 13 1 1 A 10 10 TYR CB C 10 41.920 42.879 -0.959 1
1 69 . 13 1 1 A 10 10 TYR N N 10 118.990 121.327 -2.337 1
1 70 . 13 1 1 A 11 11 VAL H H 11 9.450 9.089 0.361 1
1 71 . 13 1 1 A 11 11 VAL HA H 11 4.470 4.896 -0.426 1
1 79 . 13 1 1 A 11 11 VAL C C 11 175.030 175.494 -0.464 1
1 80 . 13 1 1 A 11 11 VAL CA C 11 62.320 61.674 0.646 1
1 81 . 13 1 1 A 11 11 VAL CB C 11 32.400 33.296 -0.896 1
1 84 . 13 1 1 A 11 11 VAL N N 11 120.930 122.230 -1.300 1
1 85 . 13 1 1 A 12 12 VAL H H 12 9.320 10.067 -0.747 1
1 86 . 13 1 1 A 12 12 VAL HA H 12 3.940 4.349 -0.409 1
1 94 . 13 1 1 A 12 12 VAL C C 12 173.870 173.719 0.151 1
1 95 . 13 1 1 A 12 12 VAL CA C 12 61.330 60.758 0.572 1
1 96 . 13 1 1 A 12 12 VAL CB C 12 33.500 34.183 -0.683 1
1 99 . 13 1 1 A 12 12 VAL N N 12 128.860 128.056 0.804 1
1 100 . 13 1 1 A 13 13 GLN H H 13 8.830 8.944 -0.114 1
1 101 . 13 1 1 A 13 13 GLN HA H 13 4.710 5.324 -0.614 1
1 108 . 13 1 1 A 13 13 GLN C C 13 174.230 174.973 -0.743 1
1 109 . 13 1 1 A 13 13 GLN CA C 13 54.800 54.674 0.126 1
1 110 . 13 1 1 A 13 13 GLN CB C 13 29.450 29.825 -0.375 1
1 111 . 13 1 1 A 13 13 GLN N N 13 126.050 127.731 -1.681 1
1 113 . 13 1 1 A 14 14 ALA H H 14 9.420 8.551 0.869 1
1 114 . 13 1 1 A 14 14 ALA HA H 14 5.150 4.705 0.445 1
1 118 . 13 1 1 A 14 14 ALA C C 14 176.400 176.146 0.254 1
1 119 . 13 1 1 A 14 14 ALA CA C 14 49.660 51.026 -1.366 1
1 120 . 13 1 1 A 14 14 ALA CB C 14 22.840 23.511 -0.671 1
1 121 . 13 1 1 A 14 14 ALA N N 14 131.620 127.335 4.285 1
1 122 . 13 1 1 A 15 15 PHE H H 15 8.070 8.650 -0.580 1
1 123 . 13 1 1 A 15 15 PHE HA H 15 4.410 4.773 -0.363 1
1 128 . 13 1 1 A 15 15 PHE C C 15 176.130 175.869 0.261 1
1 129 . 13 1 1 A 15 15 PHE CA C 15 58.550 58.733 -0.183 1
1 130 . 13 1 1 A 15 15 PHE CB C 15 39.780 39.669 0.111 1
1 133 . 13 1 1 A 15 15 PHE N N 15 119.680 118.053 1.627 1
1 134 . 13 1 1 A 16 16 SER H H 16 8.370 8.979 -0.609 1
1 135 . 13 1 1 A 16 16 SER HA H 16 4.140 4.163 -0.023 1
1 138 . 13 1 1 A 16 16 SER C C 16 175.820 175.671 0.149 1
1 139 . 13 1 1 A 16 16 SER CA C 16 60.570 60.687 -0.117 1
1 140 . 13 1 1 A 16 16 SER CB C 16 63.030 63.023 0.007 1
1 141 . 13 1 1 A 16 16 SER N N 16 119.700 120.341 -0.641 1
1 142 . 13 1 1 A 17 17 GLY H H 17 9.130 8.821 0.309 1
1 143 . 13 1 1 A 17 17 GLY HA2 H 17 3.640 3.727 -0.087 1
1 144 . 13 1 1 A 17 17 GLY HA3 H 17 4.200 3.832 0.368 1
1 145 . 13 1 1 A 17 17 GLY C C 17 175.520 174.822 0.698 1
1 146 . 13 1 1 A 17 17 GLY CA C 17 45.260 45.206 0.054 1
1 147 . 13 1 1 A 17 17 GLY N N 17 115.850 113.550 2.300 1
1 148 . 13 1 1 A 18 18 PHE H H 18 8.480 8.075 0.405 1
1 149 . 13 1 1 A 18 18 PHE HA H 18 4.740 4.667 0.073 1
1 154 . 13 1 1 A 18 18 PHE C C 18 175.430 176.354 -0.924 1
1 155 . 13 1 1 A 18 18 PHE CA C 18 58.240 57.642 0.598 1
1 156 . 13 1 1 A 18 18 PHE CB C 18 39.010 38.806 0.204 1
1 159 . 13 1 1 A 18 18 PHE N N 18 118.550 119.797 -1.247 1
1 160 . 13 1 1 A 19 19 GLU H H 19 10.690 8.214 2.476 1
1 161 . 13 1 1 A 19 19 GLU HA H 19 3.490 4.138 -0.648 1
1 166 . 13 1 1 A 19 19 GLU C C 19 177.650 180.115 -2.465 1
1 167 . 13 1 1 A 19 19 GLU CA C 19 62.280 59.499 2.781 1
1 168 . 13 1 1 A 19 19 GLU CB C 19 28.380 29.201 -0.821 1
1 170 . 13 1 1 A 19 19 GLU N N 19 123.470 121.111 2.359 1
1 171 . 13 1 1 A 20 20 GLY H H 20 8.740 8.304 0.436 1
1 172 . 13 1 1 A 20 20 GLY HA2 H 20 3.840 3.879 -0.039 1
1 173 . 13 1 1 A 20 20 GLY HA3 H 20 3.940 3.889 0.051 1
1 174 . 13 1 1 A 20 20 GLY C C 20 176.860 175.412 1.448 1
1 175 . 13 1 1 A 20 20 GLY CA C 20 47.140 47.216 -0.076 1
1 176 . 13 1 1 A 20 20 GLY N N 20 105.480 109.356 -3.876 1
1 177 . 13 1 1 A 21 21 ARG H H 21 7.690 8.281 -0.591 1
1 178 . 13 1 1 A 21 21 ARG HA H 21 4.180 4.152 0.028 1
1 185 . 13 1 1 A 21 21 ARG C C 21 179.490 178.940 0.550 1
1 186 . 13 1 1 A 21 21 ARG CA C 21 58.660 59.355 -0.695 1
1 187 . 13 1 1 A 21 21 ARG CB C 21 30.100 29.981 0.119 1
1 190 . 13 1 1 A 21 21 ARG N N 21 123.120 121.938 1.182 1
1 191 . 13 1 1 A 22 22 VAL H H 22 8.980 8.269 0.711 1
1 192 . 13 1 1 A 22 22 VAL HA H 22 3.560 3.746 -0.186 1
1 200 . 13 1 1 A 22 22 VAL C C 22 177.320 178.355 -1.035 1
1 201 . 13 1 1 A 22 22 VAL CA C 22 66.960 66.282 0.678 1
1 202 . 13 1 1 A 22 22 VAL CB C 22 31.050 31.564 -0.514 1
1 205 . 13 1 1 A 22 22 VAL N N 22 122.760 120.063 2.697 1
1 206 . 13 1 1 A 23 23 ALA H H 23 8.280 7.951 0.329 1
1 207 . 13 1 1 A 23 23 ALA HA H 23 3.850 4.070 -0.220 1
1 211 . 13 1 1 A 23 23 ALA C C 23 179.340 179.540 -0.200 1
1 212 . 13 1 1 A 23 23 ALA CA C 23 56.260 55.215 1.045 1
1 213 . 13 1 1 A 23 23 ALA CB C 23 18.260 18.350 -0.090 1
1 214 . 13 1 1 A 23 23 ALA N N 23 122.120 121.711 0.409 1
1 215 . 13 1 1 A 24 24 THR H H 24 8.020 7.885 0.135 1
1 216 . 13 1 1 A 24 24 THR HA H 24 3.920 3.906 0.014 1
1 221 . 13 1 1 A 24 24 THR C C 24 176.940 176.641 0.299 1
1 222 . 13 1 1 A 24 24 THR CA C 24 66.820 66.888 -0.068 1
1 223 . 13 1 1 A 24 24 THR CB C 24 68.930 68.332 0.598 1
1 225 . 13 1 1 A 24 24 THR N N 24 113.410 115.422 -2.012 1
1 226 . 13 1 1 A 25 25 SER H H 25 8.570 7.725 0.845 1
1 227 . 13 1 1 A 25 25 SER HA H 25 4.400 4.008 0.392 1
1 230 . 13 1 1 A 25 25 SER C C 25 177.610 176.109 1.501 1
1 231 . 13 1 1 A 25 25 SER CA C 25 61.920 62.174 -0.254 1
1 232 . 13 1 1 A 25 25 SER CB C 25 63.540 63.062 0.478 1
1 233 . 13 1 1 A 25 25 SER N N 25 118.260 117.575 0.685 1
1 234 . 13 1 1 A 26 26 LEU H H 26 9.430 8.023 1.407 1
1 235 . 13 1 1 A 26 26 LEU HA H 26 3.900 3.911 -0.011 1
1 245 . 13 1 1 A 26 26 LEU C C 26 177.710 178.672 -0.962 1
1 246 . 13 1 1 A 26 26 LEU CA C 26 58.910 58.015 0.895 1
1 247 . 13 1 1 A 26 26 LEU CB C 26 41.300 41.334 -0.034 1
1 251 . 13 1 1 A 26 26 LEU N N 26 124.120 120.848 3.272 1
1 252 . 13 1 1 A 27 27 ARG H H 27 7.790 7.673 0.117 1
1 253 . 13 1 1 A 27 27 ARG HA H 27 3.880 3.734 0.146 1
1 260 . 13 1 1 A 27 27 ARG C C 27 179.380 178.543 0.837 1
1 261 . 13 1 1 A 27 27 ARG CA C 27 60.510 59.658 0.852 1
1 262 . 13 1 1 A 27 27 ARG CB C 27 29.670 29.797 -0.127 1
1 265 . 13 1 1 A 27 27 ARG N N 27 116.710 119.237 -2.527 1
1 266 . 13 1 1 A 28 28 GLU H H 28 7.900 7.493 0.407 1
1 267 . 13 1 1 A 28 28 GLU HA H 28 4.070 3.983 0.087 1
1 272 . 13 1 1 A 28 28 GLU C C 28 179.450 179.055 0.395 1
1 273 . 13 1 1 A 28 28 GLU CA C 28 59.450 58.472 0.978 1
1 274 . 13 1 1 A 28 28 GLU CB C 28 29.610 29.872 -0.262 1
1 276 . 13 1 1 A 28 28 GLU N N 28 118.340 119.030 -0.690 1
1 277 . 13 1 1 A 29 29 HIS H H 29 8.940 7.903 1.037 1
1 278 . 13 1 1 A 29 29 HIS HA H 29 4.160 4.389 -0.229 1
1 283 . 13 1 1 A 29 29 HIS C C 29 177.750 177.898 -0.148 1
1 284 . 13 1 1 A 29 29 HIS CA C 29 61.260 59.034 2.226 1
1 285 . 13 1 1 A 29 29 HIS CB C 29 29.870 29.795 0.075 1
1 287 . 13 1 1 A 29 29 HIS N N 29 120.440 118.463 1.977 1
1 288 . 13 1 1 A 30 30 ILE H H 30 8.580 8.666 -0.086 1
1 289 . 13 1 1 A 30 30 ILE HA H 30 3.160 3.721 -0.561 1
1 299 . 13 1 1 A 30 30 ILE C C 30 177.230 178.077 -0.847 1
1 300 . 13 1 1 A 30 30 ILE CA C 30 66.460 64.493 1.967 1
1 301 . 13 1 1 A 30 30 ILE CB C 30 38.630 37.382 1.248 1
1 305 . 13 1 1 A 30 30 ILE N N 30 121.010 119.808 1.202 1
1 306 . 13 1 1 A 31 31 LYS H H 31 7.020 8.522 -1.502 1
1 307 . 13 1 1 A 31 31 LYS HA H 31 4.170 3.961 0.209 1
1 316 . 13 1 1 A 31 31 LYS C C 31 180.570 178.791 1.779 1
1 317 . 13 1 1 A 31 31 LYS CA C 31 58.920 59.382 -0.462 1
1 318 . 13 1 1 A 31 31 LYS CB C 31 32.490 32.130 0.360 1
1 322 . 13 1 1 A 31 31 LYS N N 31 117.400 121.065 -3.665 1
1 323 . 13 1 1 A 32 32 LEU H H 32 8.400 9.026 -0.626 1
1 324 . 13 1 1 A 32 32 LEU HA H 32 3.990 3.946 0.044 1
1 334 . 13 1 1 A 32 32 LEU C C 32 178.230 178.292 -0.062 1
1 335 . 13 1 1 A 32 32 LEU CA C 32 57.700 57.765 -0.065 1
1 336 . 13 1 1 A 32 32 LEU CB C 32 42.540 41.783 0.757 1
1 340 . 13 1 1 A 32 32 LEU N N 32 121.180 119.652 1.528 1
1 341 . 13 1 1 A 33 33 HIS H H 33 7.620 7.726 -0.106 1
1 342 . 13 1 1 A 33 33 HIS HA H 33 4.600 4.651 -0.051 1
1 347 . 13 1 1 A 33 33 HIS C C 33 177.090 174.054 3.036 1
1 348 . 13 1 1 A 33 33 HIS CA C 33 55.840 55.624 0.216 1
1 349 . 13 1 1 A 33 33 HIS CB C 33 29.330 29.850 -0.520 1
1 351 . 13 1 1 A 33 33 HIS N N 33 112.220 115.948 -3.728 1
1 352 . 13 1 1 A 34 34 ASN H H 34 8.030 8.100 -0.070 1
1 353 . 13 1 1 A 34 34 ASN HA H 34 4.890 4.358 0.532 1
1 358 . 13 1 1 A 34 34 ASN C C 34 175.910 175.513 0.397 1
1 359 . 13 1 1 A 34 34 ASN CA C 34 54.530 54.405 0.125 1
1 360 . 13 1 1 A 34 34 ASN CB C 34 37.380 36.438 0.942 1
1 361 . 13 1 1 A 34 34 ASN N N 34 117.600 114.350 3.250 1
1 363 . 13 1 1 A 35 35 MET H H 35 8.330 8.833 -0.503 1
1 364 . 13 1 1 A 35 35 MET HA H 35 4.940 4.807 0.133 1
1 372 . 13 1 1 A 35 35 MET C C 35 176.880 177.016 -0.136 1
1 373 . 13 1 1 A 35 35 MET CA C 35 55.600 54.514 1.086 1
1 374 . 13 1 1 A 35 35 MET CB C 35 33.790 33.155 0.635 1
1 377 . 13 1 1 A 35 35 MET N N 35 116.190 116.146 0.044 1
1 378 . 13 1 1 A 36 36 GLU H H 36 9.730 8.223 1.507 1
1 379 . 13 1 1 A 36 36 GLU HA H 36 3.850 4.163 -0.313 1
1 384 . 13 1 1 A 36 36 GLU C C 36 178.290 178.729 -0.439 1
1 385 . 13 1 1 A 36 36 GLU CA C 36 61.280 59.536 1.744 1
1 386 . 13 1 1 A 36 36 GLU CB C 36 29.270 29.336 -0.066 1
1 388 . 13 1 1 A 36 36 GLU N N 36 121.630 120.507 1.123 1
1 389 . 13 1 1 A 37 37 ASP H H 37 8.850 8.577 0.273 1
1 390 . 13 1 1 A 37 37 ASP HA H 37 4.470 4.352 0.118 1
1 393 . 13 1 1 A 37 37 ASP C C 37 177.190 178.712 -1.522 1
1 394 . 13 1 1 A 37 37 ASP CA C 37 56.140 57.810 -1.670 1
1 395 . 13 1 1 A 37 37 ASP CB C 37 40.050 42.082 -2.032 1
1 396 . 13 1 1 A 37 37 ASP N N 37 114.390 119.575 -5.185 1
1 397 . 13 1 1 A 38 38 LEU H H 38 7.880 7.902 -0.022 1
1 398 . 13 1 1 A 38 38 LEU HA H 38 4.290 4.139 0.151 1
1 408 . 13 1 1 A 38 38 LEU C C 38 175.090 177.601 -2.511 1
1 409 . 13 1 1 A 38 38 LEU CA C 38 54.670 57.711 -3.041 1
1 410 . 13 1 1 A 38 38 LEU CB C 38 42.940 42.399 0.541 1
1 414 . 13 1 1 A 38 38 LEU N N 38 116.550 118.877 -2.327 1
1 415 . 13 1 1 A 39 39 PHE H H 39 7.500 7.929 -0.429 1
1 416 . 13 1 1 A 39 39 PHE HA H 39 4.970 4.528 0.442 1
1 424 . 13 1 1 A 39 39 PHE C C 39 175.380 175.733 -0.353 1
1 425 . 13 1 1 A 39 39 PHE CA C 39 57.580 58.377 -0.797 1
1 426 . 13 1 1 A 39 39 PHE CB C 39 44.990 39.220 5.770 1
1 432 . 13 1 1 A 39 39 PHE N N 39 115.370 117.147 -1.777 1
1 433 . 13 1 1 A 40 40 GLY H H 40 8.680 8.390 0.290 1
1 434 . 13 1 1 A 40 40 GLY HA2 H 40 3.370 3.947 -0.577 1
1 435 . 13 1 1 A 40 40 GLY HA3 H 40 4.550 4.034 0.516 1
1 436 . 13 1 1 A 40 40 GLY C C 40 173.090 173.869 -0.779 1
1 437 . 13 1 1 A 40 40 GLY CA C 40 44.180 46.431 -2.251 1
1 438 . 13 1 1 A 40 40 GLY N N 40 110.930 112.044 -1.114 1
1 439 . 13 1 1 A 41 41 GLU H H 41 8.320 7.837 0.483 1
1 440 . 13 1 1 A 41 41 GLU HA H 41 4.280 4.990 -0.710 1
1 445 . 13 1 1 A 41 41 GLU C C 41 173.900 174.638 -0.738 1
1 446 . 13 1 1 A 41 41 GLU CA C 41 56.900 55.032 1.868 1
1 447 . 13 1 1 A 41 41 GLU CB C 41 32.110 33.267 -1.157 1
1 449 . 13 1 1 A 41 41 GLU N N 41 126.730 119.930 6.800 1
1 450 . 13 1 1 A 42 42 VAL H H 42 8.100 8.810 -0.710 1
1 451 . 13 1 1 A 42 42 VAL HA H 42 5.160 4.939 0.221 1
1 459 . 13 1 1 A 42 42 VAL C C 42 176.340 175.188 1.152 1
1 460 . 13 1 1 A 42 42 VAL CA C 42 61.200 61.237 -0.037 1
1 461 . 13 1 1 A 42 42 VAL CB C 42 34.770 34.181 0.589 1
1 464 . 13 1 1 A 42 42 VAL N N 42 119.360 127.090 -7.730 1
1 465 . 13 1 1 A 43 43 MET H H 43 9.870 9.288 0.582 1
1 466 . 13 1 1 A 43 43 MET HA H 43 5.070 5.552 -0.482 1
1 474 . 13 1 1 A 43 43 MET C C 43 173.890 174.953 -1.063 1
1 475 . 13 1 1 A 43 43 MET CA C 43 54.740 54.307 0.433 1
1 476 . 13 1 1 A 43 43 MET CB C 43 37.500 37.044 0.456 1
1 479 . 13 1 1 A 43 43 MET N N 43 125.720 124.561 1.159 1
1 480 . 13 1 1 A 44 44 VAL H H 44 8.800 8.740 0.060 1
1 481 . 13 1 1 A 44 44 VAL HA H 44 4.720 4.665 0.055 1
1 489 . 13 1 1 A 44 44 VAL CA C 44 59.090 59.014 0.076 1
1 490 . 13 1 1 A 44 44 VAL CB C 44 33.710 35.968 -2.258 1
1 493 . 13 1 1 A 44 44 VAL N N 44 122.340 121.943 0.397 1
1 494 . 13 1 1 A 45 45 PRO HA H 45 4.480 4.614 -0.134 1
1 501 . 13 1 1 A 45 45 PRO C C 45 177.080 175.952 1.128 1
1 502 . 13 1 1 A 45 45 PRO CA C 45 63.240 64.197 -0.957 1
1 503 . 13 1 1 A 45 45 PRO CB C 45 32.170 31.959 0.211 1
1 506 . 13 1 1 A 46 46 THR H H 46 8.200 7.550 0.650 1
1 507 . 13 1 1 A 46 46 THR HA H 46 4.290 4.666 -0.376 1
1 512 . 13 1 1 A 46 46 THR C C 46 174.600 171.903 2.697 1
1 513 . 13 1 1 A 46 46 THR CA C 46 62.100 60.487 1.613 1
1 514 . 13 1 1 A 46 46 THR CB C 46 69.990 71.672 -1.682 1
1 516 . 13 1 1 A 46 46 THR N N 46 113.410 111.628 1.782 1
1 517 . 13 1 1 A 47 47 GLU H H 47 8.380 8.911 -0.531 1
1 518 . 13 1 1 A 47 47 GLU HA H 47 4.400 4.801 -0.401 1
1 521 . 13 1 1 A 47 47 GLU C C 47 175.970 176.225 -0.255 1
1 522 . 13 1 1 A 47 47 GLU CA C 47 55.200 54.870 0.330 1
1 523 . 13 1 1 A 47 47 GLU CB C 47 32.300 32.053 0.247 1
1 524 . 13 1 1 A 47 47 GLU N N 47 122.830 126.676 -3.846 1
1 525 . 13 1 1 A 48 48 GLU H H 48 8.400 8.875 -0.475 1
1 526 . 13 1 1 A 48 48 GLU HA H 48 4.280 3.825 0.455 1
1 531 . 13 1 1 A 48 48 GLU C C 48 175.750 175.061 0.689 1
1 532 . 13 1 1 A 48 48 GLU CA C 48 55.190 57.325 -2.135 1
1 533 . 13 1 1 A 48 48 GLU CB C 48 31.980 28.151 3.829 1
1 535 . 13 1 1 A 48 48 GLU N N 48 121.950 119.446 2.504 1
1 536 . 13 1 1 A 49 49 VAL H H 49 8.240 7.833 0.407 1
1 537 . 13 1 1 A 49 49 VAL HA H 49 4.170 4.763 -0.593 1
1 542 . 13 1 1 A 49 49 VAL C C 49 174.610 173.823 0.787 1
1 543 . 13 1 1 A 49 49 VAL CA C 49 62.280 59.949 2.331 1
1 544 . 13 1 1 A 49 49 VAL CB C 49 32.930 35.599 -2.669 1
1 546 . 13 1 1 A 49 49 VAL N N 49 123.990 119.515 4.475 1
1 547 . 13 1 1 A 50 50 VAL H H 50 8.230 8.739 -0.509 1
1 548 . 13 1 1 A 50 50 VAL HA H 50 4.220 4.587 -0.367 1
1 553 . 13 1 1 A 50 50 VAL C C 50 175.770 176.336 -0.566 1
1 554 . 13 1 1 A 50 50 VAL CA C 50 62.170 60.405 1.765 1
1 555 . 13 1 1 A 50 50 VAL CB C 50 33.110 34.915 -1.805 1
1 557 . 13 1 1 A 50 50 VAL N N 50 123.960 126.523 -2.563 1
1 558 . 13 1 1 A 51 51 GLU H H 51 8.570 8.961 -0.391 1
1 559 . 13 1 1 A 51 51 GLU HA H 51 4.380 3.813 0.567 1
1 564 . 13 1 1 A 51 51 GLU C C 51 175.920 178.542 -2.622 1
1 565 . 13 1 1 A 51 51 GLU CA C 51 56.050 59.755 -3.705 1
1 566 . 13 1 1 A 51 51 GLU CB C 51 31.080 29.631 1.449 1
1 568 . 13 1 1 A 51 51 GLU N N 51 125.070 126.769 -1.699 1
1 569 . 13 1 1 A 52 52 ILE H H 52 8.320 8.092 0.228 1
1 570 . 13 1 1 A 52 52 ILE HA H 52 4.290 3.636 0.654 1
1 580 . 13 1 1 A 52 52 ILE C C 52 176.330 177.817 -1.487 1
1 581 . 13 1 1 A 52 52 ILE CA C 52 60.940 65.075 -4.135 1
1 582 . 13 1 1 A 52 52 ILE CB C 52 38.510 37.663 0.847 1
1 586 . 13 1 1 A 52 52 ILE N N 52 122.760 119.921 2.839 1
1 587 . 13 1 1 A 53 53 ARG H H 53 8.500 8.049 0.451 1
1 588 . 13 1 1 A 53 53 ARG HA H 53 4.430 3.989 0.441 1
1 595 . 13 1 1 A 53 53 ARG C C 53 176.950 176.368 0.582 1
1 596 . 13 1 1 A 53 53 ARG CA C 53 56.150 59.395 -3.245 1
1 597 . 13 1 1 A 53 53 ARG CB C 53 30.200 30.025 0.175 1
1 600 . 13 1 1 A 53 53 ARG N N 53 125.250 120.826 4.424 1
1 601 . 13 1 1 A 54 54 GLY H H 54 8.760 7.825 0.935 1
1 602 . 13 1 1 A 54 54 GLY HA2 H 54 3.920 3.938 -0.018 1
1 603 . 13 1 1 A 54 54 GLY HA3 H 54 4.010 3.946 0.064 1
1 604 . 13 1 1 A 54 54 GLY C C 54 175.110 174.390 0.720 1
1 605 . 13 1 1 A 54 54 GLY CA C 54 46.030 46.860 -0.830 1
1 606 . 13 1 1 A 54 54 GLY N N 54 112.510 107.443 5.067 1
1 607 . 13 1 1 A 55 55 GLY H H 55 8.350 8.631 -0.281 1
1 608 . 13 1 1 A 55 55 GLY HA2 H 55 3.980 4.176 -0.196 1
1 609 . 13 1 1 A 55 55 GLY HA3 H 55 3.980 4.180 -0.200 1
1 610 . 13 1 1 A 55 55 GLY C C 55 173.920 174.386 -0.466 1
1 611 . 13 1 1 A 55 55 GLY CA C 55 45.200 45.552 -0.352 1
1 612 . 13 1 1 A 55 55 GLY N N 55 107.940 113.226 -5.286 1
1 613 . 13 1 1 A 56 56 GLN H H 56 8.100 8.551 -0.451 1
1 614 . 13 1 1 A 56 56 GLN HA H 56 4.420 3.869 0.551 1
1 619 . 13 1 1 A 56 56 GLN C C 56 175.570 177.471 -1.901 1
1 620 . 13 1 1 A 56 56 GLN CA C 56 55.420 58.393 -2.973 1
1 621 . 13 1 1 A 56 56 GLN CB C 56 30.100 28.350 1.750 1
1 623 . 13 1 1 A 56 56 GLN N N 56 119.350 125.469 -6.119 1
1 624 . 13 1 1 A 57 57 ARG H H 57 8.520 7.809 0.711 1
1 625 . 13 1 1 A 57 57 ARG HA H 57 4.400 4.146 0.254 1
1 632 . 13 1 1 A 57 57 ARG C C 57 176.210 176.601 -0.391 1
1 633 . 13 1 1 A 57 57 ARG CA C 57 56.440 58.474 -2.034 1
1 634 . 13 1 1 A 57 57 ARG CB C 57 30.930 30.613 0.317 1
1 637 . 13 1 1 A 57 57 ARG N N 57 122.610 118.958 3.652 1
1 638 . 13 1 1 A 58 58 ARG H H 58 8.630 7.710 0.920 1
1 639 . 13 1 1 A 58 58 ARG HA H 58 4.430 4.724 -0.294 1
1 646 . 13 1 1 A 58 58 ARG C C 58 175.950 176.186 -0.236 1
1 647 . 13 1 1 A 58 58 ARG CA C 58 55.450 54.366 1.084 1
1 648 . 13 1 1 A 58 58 ARG CB C 58 31.300 33.890 -2.590 1
1 651 . 13 1 1 A 58 58 ARG N N 58 123.320 116.666 6.654 1
1 652 . 13 1 1 A 59 59 LYS H H 59 8.560 8.842 -0.282 1
1 653 . 13 1 1 A 59 59 LYS HA H 59 4.410 3.931 0.479 1
1 662 . 13 1 1 A 59 59 LYS C C 59 176.590 176.490 0.100 1
1 663 . 13 1 1 A 59 59 LYS CA C 59 56.720 60.107 -3.387 1
1 664 . 13 1 1 A 59 59 LYS CB C 59 33.150 32.101 1.049 1
1 668 . 13 1 1 A 59 59 LYS N N 59 123.380 124.473 -1.093 1
1 669 . 13 1 1 A 60 60 SER H H 60 8.450 7.609 0.841 1
1 670 . 13 1 1 A 60 60 SER HA H 60 4.480 4.397 0.083 1
1 673 . 13 1 1 A 60 60 SER C C 60 174.280 173.865 0.415 1
1 674 . 13 1 1 A 60 60 SER CA C 60 58.140 58.352 -0.212 1
1 675 . 13 1 1 A 60 60 SER CB C 60 64.160 63.948 0.212 1
1 676 . 13 1 1 A 60 60 SER N N 60 117.320 111.837 5.483 1
1 677 . 13 1 1 A 61 61 GLU H H 61 8.550 8.666 -0.116 1
1 678 . 13 1 1 A 61 61 GLU HA H 61 4.400 5.264 -0.864 1
1 683 . 13 1 1 A 61 61 GLU C C 61 176.150 174.878 1.272 1
1 684 . 13 1 1 A 61 61 GLU CA C 61 56.300 54.779 1.521 1
1 685 . 13 1 1 A 61 61 GLU CB C 61 30.790 33.816 -3.026 1
1 687 . 13 1 1 A 61 61 GLU N N 61 122.810 119.385 3.425 1
1 688 . 13 1 1 A 62 62 ARG H H 62 8.310 8.728 -0.418 1
1 689 . 13 1 1 A 62 62 ARG HA H 62 4.340 5.112 -0.772 1
1 692 . 13 1 1 A 62 62 ARG C C 62 176.140 174.932 1.208 1
1 693 . 13 1 1 A 62 62 ARG CA C 62 56.230 54.333 1.897 1
1 694 . 13 1 1 A 62 62 ARG CB C 62 30.780 33.620 -2.840 1
1 695 . 13 1 1 A 62 62 ARG N N 62 122.080 123.406 -1.326 1
1 696 . 13 1 1 A 63 63 LYS H H 63 8.470 8.536 -0.066 1
1 697 . 13 1 1 A 63 63 LYS HA H 63 4.300 5.038 -0.738 1
1 700 . 13 1 1 A 63 63 LYS C C 63 175.490 174.736 0.754 1
1 701 . 13 1 1 A 63 63 LYS CA C 63 56.200 54.696 1.504 1
1 702 . 13 1 1 A 63 63 LYS CB C 63 30.730 36.524 -5.794 1
1 703 . 13 1 1 A 63 63 LYS N N 63 123.450 121.506 1.944 1
1 704 . 13 1 1 A 64 64 PHE H H 64 8.200 8.957 -0.757 1
1 705 . 13 1 1 A 64 64 PHE HA H 64 4.450 4.712 -0.262 1
1 710 . 13 1 1 A 64 64 PHE C C 64 174.250 175.464 -1.214 1
1 711 . 13 1 1 A 64 64 PHE CA C 64 57.430 56.102 1.328 1
1 712 . 13 1 1 A 64 64 PHE CB C 64 40.330 41.400 -1.070 1
1 715 . 13 1 1 A 64 64 PHE N N 64 121.740 122.048 -0.308 1
1 716 . 13 1 1 A 65 65 PHE H H 65 8.130 8.212 -0.082 1
1 717 . 13 1 1 A 65 65 PHE HA H 65 4.440 3.959 0.481 1
1 725 . 13 1 1 A 65 65 PHE CA C 65 55.650 58.366 -2.716 1
1 726 . 13 1 1 A 65 65 PHE CB C 65 38.900 36.809 2.091 1
1 731 . 13 1 1 A 65 65 PHE N N 65 120.910 117.555 3.355 1
1 732 . 13 1 1 A 66 66 PRO C C 66 176.780 177.724 -0.944 1
1 733 . 13 1 1 A 67 67 GLY H H 67 9.970 9.027 0.943 1
1 734 . 13 1 1 A 67 67 GLY HA2 H 67 3.820 4.062 -0.242 1
1 735 . 13 1 1 A 67 67 GLY HA3 H 67 4.400 4.073 0.327 1
1 736 . 13 1 1 A 67 67 GLY C C 67 173.670 173.823 -0.153 1
1 737 . 13 1 1 A 67 67 GLY CA C 67 45.900 46.052 -0.152 1
1 738 . 13 1 1 A 67 67 GLY N N 67 111.550 112.468 -0.918 1
1 739 . 13 1 1 A 68 68 TYR H H 68 7.650 8.288 -0.638 1
1 740 . 13 1 1 A 68 68 TYR HA H 68 5.000 5.078 -0.078 1
1 747 . 13 1 1 A 68 68 TYR C C 68 175.220 174.662 0.558 1
1 748 . 13 1 1 A 68 68 TYR CA C 68 57.940 56.631 1.309 1
1 753 . 13 1 1 A 68 68 TYR N N 68 118.800 118.694 0.106 1
1 754 . 13 1 1 A 69 69 VAL H H 69 9.090 9.036 0.054 1
1 755 . 13 1 1 A 69 69 VAL HA H 69 4.330 4.856 -0.526 1
1 763 . 13 1 1 A 69 69 VAL C C 69 174.250 174.975 -0.725 1
1 764 . 13 1 1 A 69 69 VAL CA C 69 62.120 60.147 1.973 1
1 765 . 13 1 1 A 69 69 VAL CB C 69 35.240 35.716 -0.476 1
1 768 . 13 1 1 A 69 69 VAL N N 69 119.300 123.233 -3.933 1
1 769 . 13 1 1 A 70 70 LEU H H 70 9.190 8.847 0.343 1
1 770 . 13 1 1 A 70 70 LEU HA H 70 5.460 5.566 -0.106 1
1 780 . 13 1 1 A 70 70 LEU C C 70 176.130 176.360 -0.230 1
1 781 . 13 1 1 A 70 70 LEU CA C 70 54.120 53.669 0.451 1
1 782 . 13 1 1 A 70 70 LEU CB C 70 43.330 44.577 -1.247 1
1 786 . 13 1 1 A 70 70 LEU N N 70 126.710 126.770 -0.060 1
1 787 . 13 1 1 A 71 71 VAL H H 71 9.350 9.765 -0.415 1
1 788 . 13 1 1 A 71 71 VAL HA H 71 5.040 4.803 0.237 1
1 796 . 13 1 1 A 71 71 VAL C C 71 173.670 174.487 -0.817 1
1 797 . 13 1 1 A 71 71 VAL CA C 71 61.090 61.137 -0.047 1
1 798 . 13 1 1 A 71 71 VAL CB C 71 35.800 35.599 0.201 1
1 801 . 13 1 1 A 71 71 VAL N N 71 121.920 124.256 -2.336 1
1 802 . 13 1 1 A 72 72 GLN H H 72 8.390 8.835 -0.445 1
1 803 . 13 1 1 A 72 72 GLN HA H 72 4.610 4.030 0.580 1
1 810 . 13 1 1 A 72 72 GLN C C 72 175.920 174.350 1.570 1
1 811 . 13 1 1 A 72 72 GLN CA C 72 53.810 54.885 -1.075 1
1 812 . 13 1 1 A 72 72 GLN CB C 72 28.850 28.323 0.527 1
1 814 . 13 1 1 A 72 72 GLN N N 72 130.760 127.640 3.120 1
1 816 . 13 1 1 A 73 73 MET H H 73 9.750 8.919 0.831 1
1 817 . 13 1 1 A 73 73 MET HA H 73 5.060 5.195 -0.135 1
1 825 . 13 1 1 A 73 73 MET C C 73 175.500 173.803 1.697 1
1 826 . 13 1 1 A 73 73 MET CA C 73 55.520 54.410 1.110 1
1 827 . 13 1 1 A 73 73 MET CB C 73 35.350 35.580 -0.230 1
1 830 . 13 1 1 A 73 73 MET N N 73 121.070 123.736 -2.666 1
1 831 . 13 1 1 A 74 74 VAL H H 74 8.530 8.486 0.044 1
1 832 . 13 1 1 A 74 74 VAL HA H 74 3.970 4.696 -0.726 1
1 840 . 13 1 1 A 74 74 VAL C C 74 174.900 175.243 -0.343 1
1 841 . 13 1 1 A 74 74 VAL CA C 74 62.150 60.180 1.970 1
1 842 . 13 1 1 A 74 74 VAL CB C 74 32.480 33.705 -1.225 1
1 845 . 13 1 1 A 74 74 VAL N N 74 124.120 121.087 3.033 1
1 846 . 13 1 1 A 75 75 MET H H 75 8.600 9.066 -0.466 1
1 847 . 13 1 1 A 75 75 MET HA H 75 4.360 4.596 -0.236 1
1 855 . 13 1 1 A 75 75 MET C C 75 173.480 175.683 -2.203 1
1 856 . 13 1 1 A 75 75 MET CA C 75 53.830 55.199 -1.369 1
1 857 . 13 1 1 A 75 75 MET CB C 75 29.960 33.003 -3.043 1
1 860 . 13 1 1 A 75 75 MET N N 75 128.250 128.293 -0.043 1
1 861 . 13 1 1 A 76 76 ASN H H 76 8.410 8.504 -0.094 1
1 862 . 13 1 1 A 76 76 ASN HA H 76 4.540 5.071 -0.531 1
1 867 . 13 1 1 A 76 76 ASN C C 76 173.950 175.486 -1.536 1
1 868 . 13 1 1 A 76 76 ASN CA C 76 51.720 51.709 0.011 1
1 869 . 13 1 1 A 76 76 ASN CB C 76 38.430 40.424 -1.994 1
1 870 . 13 1 1 A 76 76 ASN N N 76 127.500 123.951 3.549 1
1 872 . 13 1 1 A 77 77 ASP H H 77 8.470 8.973 -0.503 1
1 873 . 13 1 1 A 77 77 ASP HA H 77 4.410 4.346 0.064 1
1 876 . 13 1 1 A 77 77 ASP C C 77 178.530 178.517 0.013 1
1 877 . 13 1 1 A 77 77 ASP CA C 77 58.730 57.525 1.205 1
1 878 . 13 1 1 A 77 77 ASP CB C 77 40.940 40.551 0.389 1
1 879 . 13 1 1 A 77 77 ASP N N 77 117.090 120.493 -3.403 1
1 880 . 13 1 1 A 78 78 ALA H H 78 8.160 7.994 0.166 1
1 881 . 13 1 1 A 78 78 ALA HA H 78 4.350 4.138 0.212 1
1 885 . 13 1 1 A 78 78 ALA C C 78 181.250 180.042 1.208 1
1 886 . 13 1 1 A 78 78 ALA CA C 78 55.190 55.327 -0.137 1
1 887 . 13 1 1 A 78 78 ALA CB C 78 18.260 19.187 -0.927 1
1 888 . 13 1 1 A 78 78 ALA N N 78 122.500 123.849 -1.349 1
1 889 . 13 1 1 A 79 79 SER H H 79 9.320 8.483 0.837 1
1 890 . 13 1 1 A 79 79 SER HA H 79 4.290 4.326 -0.036 1
1 893 . 13 1 1 A 79 79 SER C C 79 176.570 176.401 0.169 1
1 894 . 13 1 1 A 79 79 SER CA C 79 61.080 62.401 -1.321 1
1 895 . 13 1 1 A 79 79 SER CB C 79 62.200 62.870 -0.670 1
1 896 . 13 1 1 A 79 79 SER N N 79 119.280 114.242 5.038 1
1 897 . 13 1 1 A 80 80 TRP H H 80 8.900 8.103 0.797 1
1 898 . 13 1 1 A 80 80 TRP HA H 80 4.020 4.358 -0.338 1
1 907 . 13 1 1 A 80 80 TRP C C 80 178.210 178.104 0.106 1
1 908 . 13 1 1 A 80 80 TRP CA C 80 62.490 61.512 0.978 1
1 909 . 13 1 1 A 80 80 TRP CB C 80 29.800 29.360 0.440 1
1 915 . 13 1 1 A 80 80 TRP N N 80 125.870 123.787 2.083 1
1 917 . 13 1 1 A 81 81 HIS H H 81 8.190 8.179 0.011 1
1 918 . 13 1 1 A 81 81 HIS HA H 81 3.930 4.040 -0.110 1
1 923 . 13 1 1 A 81 81 HIS C C 81 177.740 176.825 0.915 1
1 924 . 13 1 1 A 81 81 HIS CA C 81 61.020 59.403 1.617 1
1 925 . 13 1 1 A 81 81 HIS CB C 81 28.910 29.981 -1.071 1
1 927 . 13 1 1 A 81 81 HIS N N 81 114.080 119.396 -5.316 1
1 928 . 13 1 1 A 82 82 LEU H H 82 8.080 8.234 -0.154 1
1 929 . 13 1 1 A 82 82 LEU HA H 82 3.900 3.925 -0.025 1
1 939 . 13 1 1 A 82 82 LEU C C 82 180.330 178.488 1.842 1
1 940 . 13 1 1 A 82 82 LEU CA C 82 58.590 58.280 0.310 1
1 941 . 13 1 1 A 82 82 LEU CB C 82 41.350 41.948 -0.598 1
1 945 . 13 1 1 A 82 82 LEU N N 82 121.320 120.283 1.037 1
1 946 . 13 1 1 A 83 83 VAL H H 83 8.000 8.058 -0.058 1
1 947 . 13 1 1 A 83 83 VAL HA H 83 3.210 3.370 -0.160 1
1 955 . 13 1 1 A 83 83 VAL C C 83 177.060 177.324 -0.264 1
1 956 . 13 1 1 A 83 83 VAL CA C 83 67.430 66.639 0.791 1
1 957 . 13 1 1 A 83 83 VAL CB C 83 31.680 31.186 0.494 1
1 960 . 13 1 1 A 83 83 VAL N N 83 118.850 119.305 -0.455 1
1 961 . 13 1 1 A 84 84 ARG H H 84 7.540 7.645 -0.105 1
1 962 . 13 1 1 A 84 84 ARG HA H 84 3.590 3.810 -0.220 1
1 969 . 13 1 1 A 84 84 ARG C C 84 177.240 178.391 -1.151 1
1 970 . 13 1 1 A 84 84 ARG CA C 84 56.050 59.103 -3.053 1
1 971 . 13 1 1 A 84 84 ARG CB C 84 28.190 29.379 -1.189 1
1 974 . 13 1 1 A 84 84 ARG N N 84 111.460 119.436 -7.976 1
1 975 . 13 1 1 A 85 85 SER H H 85 7.530 7.582 -0.052 1
1 976 . 13 1 1 A 85 85 SER HA H 85 4.280 4.083 0.197 1
1 979 . 13 1 1 A 85 85 SER C C 85 173.930 174.321 -0.391 1
1 980 . 13 1 1 A 85 85 SER CA C 85 59.220 58.974 0.246 1
1 981 . 13 1 1 A 85 85 SER CB C 85 63.830 62.801 1.029 1
1 982 . 13 1 1 A 85 85 SER N N 85 113.660 112.580 1.080 1
1 983 . 13 1 1 A 86 86 VAL H H 86 7.230 7.224 0.006 1
1 984 . 13 1 1 A 86 86 VAL HA H 86 3.480 3.806 -0.326 1
1 992 . 13 1 1 A 86 86 VAL CA C 86 61.300 60.854 0.446 1
1 993 . 13 1 1 A 86 86 VAL CB C 86 31.780 32.120 -0.340 1
1 996 . 13 1 1 A 86 86 VAL N N 86 128.120 126.463 1.657 1
1 997 . 13 1 1 A 87 87 PRO HA H 87 4.140 4.372 -0.232 1
1 1004 . 13 1 1 A 87 87 PRO C C 87 176.400 177.247 -0.847 1
1 1005 . 13 1 1 A 87 87 PRO CA C 87 64.100 63.231 0.869 1
1 1006 . 13 1 1 A 87 87 PRO CB C 87 31.710 32.365 -0.655 1
1 1009 . 13 1 1 A 88 88 ARG H H 88 8.320 8.915 -0.595 1
1 1010 . 13 1 1 A 88 88 ARG HA H 88 3.030 4.174 -1.144 1
1 1017 . 13 1 1 A 88 88 ARG C C 88 174.630 175.452 -0.822 1
1 1018 . 13 1 1 A 88 88 ARG CA C 88 57.620 57.551 0.069 1
1 1019 . 13 1 1 A 88 88 ARG CB C 88 26.960 29.282 -2.322 1
1 1022 . 13 1 1 A 88 88 ARG N N 88 111.360 121.089 -9.729 1
1 1023 . 13 1 1 A 89 89 VAL H H 89 7.390 7.808 -0.418 1
1 1024 . 13 1 1 A 89 89 VAL HA H 89 3.910 4.474 -0.564 1
1 1032 . 13 1 1 A 89 89 VAL C C 89 177.370 175.630 1.740 1
1 1033 . 13 1 1 A 89 89 VAL CA C 89 64.170 59.536 4.634 1
1 1034 . 13 1 1 A 89 89 VAL CB C 89 32.070 34.252 -2.182 1
1 1037 . 13 1 1 A 89 89 VAL N N 89 117.900 118.670 -0.770 1
1 1038 . 13 1 1 A 90 90 MET H H 90 9.290 9.118 0.172 1
1 1039 . 13 1 1 A 90 90 MET HA H 90 4.340 4.180 0.160 1
1 1047 . 13 1 1 A 90 90 MET C C 90 175.800 176.066 -0.266 1
1 1048 . 13 1 1 A 90 90 MET CA C 90 56.440 56.937 -0.497 1
1 1049 . 13 1 1 A 90 90 MET CB C 90 34.160 33.211 0.949 1
1 1052 . 13 1 1 A 90 90 MET N N 90 128.200 126.748 1.452 1
1 1053 . 13 1 1 A 91 91 GLY H H 91 7.130 6.935 0.195 1
1 1054 . 13 1 1 A 91 91 GLY HA2 H 91 3.340 3.927 -0.587 1
1 1055 . 13 1 1 A 91 91 GLY HA3 H 91 4.410 4.033 0.377 1
1 1056 . 13 1 1 A 91 91 GLY C C 91 170.920 171.685 -0.765 1
1 1057 . 13 1 1 A 91 91 GLY CA C 91 44.440 45.444 -1.004 1
1 1058 . 13 1 1 A 91 91 GLY N N 91 104.320 103.798 0.522 1
1 1059 . 13 1 1 A 92 92 PHE H H 92 8.790 8.529 0.261 1
1 1060 . 13 1 1 A 92 92 PHE HA H 92 5.270 5.062 0.208 1
1 1068 . 13 1 1 A 92 92 PHE C C 92 176.230 175.176 1.054 1
1 1069 . 13 1 1 A 92 92 PHE CA C 92 57.480 57.240 0.240 1
1 1070 . 13 1 1 A 92 92 PHE CB C 92 42.190 42.183 0.007 1
1 1075 . 13 1 1 A 92 92 PHE N N 92 118.770 119.870 -1.100 1
1 1076 . 13 1 1 A 93 93 ILE H H 93 8.800 8.374 0.426 1
1 1077 . 13 1 1 A 93 93 ILE HA H 93 4.310 4.947 -0.637 1
1 1087 . 13 1 1 A 93 93 ILE C C 93 176.380 175.979 0.401 1
1 1088 . 13 1 1 A 93 93 ILE CA C 93 60.480 59.778 0.702 1
1 1089 . 13 1 1 A 93 93 ILE CB C 93 38.010 40.316 -2.306 1
1 1093 . 13 1 1 A 93 93 ILE N N 93 122.300 121.205 1.095 1
1 1094 . 13 1 1 A 94 94 GLY H H 94 8.640 8.399 0.241 1
1 1095 . 13 1 1 A 94 94 GLY HA2 H 94 3.830 4.276 -0.446 1
1 1096 . 13 1 1 A 94 94 GLY HA3 H 94 4.600 4.294 0.306 1
1 1097 . 13 1 1 A 94 94 GLY C C 94 175.080 174.444 0.636 1
1 1098 . 13 1 1 A 94 94 GLY CA C 94 44.530 46.174 -1.644 1
1 1099 . 13 1 1 A 94 94 GLY N N 94 116.550 114.060 2.490 1
1 1100 . 13 1 1 A 95 95 GLY H H 95 8.900 8.768 0.132 1
1 1101 . 13 1 1 A 95 95 GLY HA2 H 95 3.970 3.904 0.066 1
1 1102 . 13 1 1 A 95 95 GLY HA3 H 95 4.370 3.916 0.454 1
1 1103 . 13 1 1 A 95 95 GLY C C 95 174.560 174.131 0.429 1
1 1104 . 13 1 1 A 95 95 GLY CA C 95 45.640 46.957 -1.317 1
1 1105 . 13 1 1 A 95 95 GLY N N 95 112.960 110.540 2.420 1
1 1106 . 13 1 1 A 96 96 THR H H 96 7.830 7.667 0.163 1
1 1107 . 13 1 1 A 96 96 THR HA H 96 4.720 4.823 -0.103 1
1 1112 . 13 1 1 A 96 96 THR C C 96 176.260 174.298 1.962 1
1 1113 . 13 1 1 A 96 96 THR CA C 96 60.360 59.639 0.721 1
1 1114 . 13 1 1 A 96 96 THR CB C 96 70.960 71.880 -0.920 1
1 1116 . 13 1 1 A 96 96 THR N N 96 113.350 110.123 3.227 1
1 1117 . 13 1 1 A 97 97 SER H H 97 8.850 8.798 0.052 1
1 1118 . 13 1 1 A 97 97 SER HA H 97 4.310 4.627 -0.317 1
1 1121 . 13 1 1 A 97 97 SER C C 97 175.570 174.625 0.945 1
1 1122 . 13 1 1 A 97 97 SER CA C 97 60.850 59.143 1.707 1
1 1123 . 13 1 1 A 97 97 SER CB C 97 63.000 63.272 -0.272 1
1 1124 . 13 1 1 A 97 97 SER N N 97 116.420 116.210 0.210 1
1 1125 . 13 1 1 A 98 98 ASP H H 98 8.360 7.858 0.502 1
1 1126 . 13 1 1 A 98 98 ASP HA H 98 4.310 5.183 -0.873 1
1 1129 . 13 1 1 A 98 98 ASP C C 98 175.380 175.636 -0.256 1
1 1130 . 13 1 1 A 98 98 ASP CA C 98 54.190 54.121 0.069 1
1 1131 . 13 1 1 A 98 98 ASP CB C 98 40.740 42.806 -2.066 1
1 1132 . 13 1 1 A 98 98 ASP N N 98 116.320 119.650 -3.330 1
1 1133 . 13 1 1 A 99 99 ARG H H 99 7.450 7.661 -0.211 1
1 1134 . 13 1 1 A 99 99 ARG HA H 99 4.350 4.617 -0.267 1
1 1141 . 13 1 1 A 99 99 ARG CA C 99 52.920 53.265 -0.345 1
1 1142 . 13 1 1 A 99 99 ARG CB C 99 30.340 31.638 -1.298 1
1 1145 . 13 1 1 A 99 99 ARG N N 99 119.960 119.358 0.602 1
1 1146 . 13 1 1 A 100 100 PRO HA H 100 4.750 4.567 0.183 1
1 1153 . 13 1 1 A 100 100 PRO C C 100 175.220 176.882 -1.662 1
1 1154 . 13 1 1 A 100 100 PRO CA C 100 62.680 62.532 0.148 1
1 1155 . 13 1 1 A 100 100 PRO CB C 100 32.820 31.368 1.452 1
1 1158 . 13 1 1 A 101 101 ALA H H 101 7.210 8.291 -1.081 1
1 1159 . 13 1 1 A 101 101 ALA HA H 101 5.030 4.382 0.648 1
1 1163 . 13 1 1 A 101 101 ALA CA C 101 48.570 50.573 -2.003 1
1 1164 . 13 1 1 A 101 101 ALA CB C 101 19.660 17.857 1.803 1
1 1165 . 13 1 1 A 101 101 ALA N N 101 124.490 125.384 -0.894 1
1 1166 . 13 1 1 A 102 102 PRO HA H 102 4.440 4.891 -0.451 1
1 1173 . 13 1 1 A 102 102 PRO C C 102 177.200 176.570 0.630 1
1 1174 . 13 1 1 A 102 102 PRO CA C 102 62.190 62.916 -0.726 1
1 1175 . 13 1 1 A 102 102 PRO CB C 102 32.310 32.848 -0.538 1
1 1178 . 13 1 1 A 103 103 ILE H H 103 8.550 8.350 0.200 1
1 1179 . 13 1 1 A 103 103 ILE HA H 103 4.630 4.934 -0.304 1
1 1189 . 13 1 1 A 103 103 ILE C C 103 175.460 175.231 0.229 1
1 1190 . 13 1 1 A 103 103 ILE CA C 103 59.730 58.639 1.091 1
1 1191 . 13 1 1 A 103 103 ILE CB C 103 40.140 42.139 -1.999 1
1 1195 . 13 1 1 A 103 103 ILE N N 103 115.670 116.378 -0.708 1
1 1196 . 13 1 1 A 104 104 SER H H 104 8.730 8.721 0.009 1
1 1197 . 13 1 1 A 104 104 SER HA H 104 4.500 4.564 -0.064 1
1 1200 . 13 1 1 A 104 104 SER C C 104 174.840 175.142 -0.302 1
1 1201 . 13 1 1 A 104 104 SER CA C 104 58.010 58.663 -0.653 1
1 1202 . 13 1 1 A 104 104 SER CB C 104 65.470 63.643 1.827 1
1 1203 . 13 1 1 A 104 104 SER N N 104 119.170 120.018 -0.848 1
1 1204 . 13 1 1 A 105 105 ASP H H 105 8.830 9.035 -0.205 1
1 1205 . 13 1 1 A 105 105 ASP HA H 105 4.200 4.244 -0.044 1
1 1208 . 13 1 1 A 105 105 ASP C C 105 178.520 178.318 0.202 1
1 1209 . 13 1 1 A 105 105 ASP CA C 105 57.870 57.844 0.026 1
1 1210 . 13 1 1 A 105 105 ASP CB C 105 40.040 40.380 -0.340 1
1 1211 . 13 1 1 A 105 105 ASP N N 105 121.640 125.012 -3.372 1
1 1212 . 13 1 1 A 106 106 LYS H H 106 8.130 8.047 0.083 1
1 1213 . 13 1 1 A 106 106 LYS HA H 106 4.100 3.901 0.199 1
1 1222 . 13 1 1 A 106 106 LYS C C 106 179.400 178.717 0.683 1
1 1223 . 13 1 1 A 106 106 LYS CA C 106 58.980 59.221 -0.241 1
1 1224 . 13 1 1 A 106 106 LYS CB C 106 32.330 31.995 0.335 1
1 1228 . 13 1 1 A 106 106 LYS N N 106 118.300 120.886 -2.586 1
1 1229 . 13 1 1 A 107 107 GLU H H 107 7.670 8.081 -0.411 1
1 1230 . 13 1 1 A 107 107 GLU HA H 107 4.020 4.060 -0.040 1
1 1235 . 13 1 1 A 107 107 GLU C C 107 178.750 179.757 -1.007 1
1 1236 . 13 1 1 A 107 107 GLU CA C 107 59.210 59.090 0.120 1
1 1237 . 13 1 1 A 107 107 GLU CB C 107 29.780 29.690 0.090 1
1 1239 . 13 1 1 A 107 107 GLU N N 107 121.270 119.725 1.545 1
1 1240 . 13 1 1 A 108 108 VAL H H 108 7.790 7.646 0.144 1
1 1241 . 13 1 1 A 108 108 VAL HA H 108 3.050 3.390 -0.340 1
1 1249 . 13 1 1 A 108 108 VAL C C 108 177.550 177.536 0.014 1
1 1250 . 13 1 1 A 108 108 VAL CA C 108 67.080 66.207 0.873 1
1 1251 . 13 1 1 A 108 108 VAL CB C 108 31.220 30.870 0.350 1
1 1254 . 13 1 1 A 108 108 VAL N N 108 120.940 121.261 -0.321 1
1 1255 . 13 1 1 A 109 109 ASP H H 109 7.840 7.764 0.076 1
1 1256 . 13 1 1 A 109 109 ASP HA H 109 4.110 4.217 -0.107 1
1 1259 . 13 1 1 A 109 109 ASP C C 109 178.190 178.464 -0.274 1
1 1260 . 13 1 1 A 109 109 ASP CA C 109 57.470 57.080 0.390 1
1 1261 . 13 1 1 A 109 109 ASP CB C 109 40.480 39.864 0.616 1
1 1262 . 13 1 1 A 109 109 ASP N N 109 118.780 121.034 -2.254 1
1 1263 . 13 1 1 A 110 110 ALA H H 110 7.520 7.574 -0.054 1
1 1264 . 13 1 1 A 110 110 ALA HA H 110 4.110 4.091 0.019 1
1 1268 . 13 1 1 A 110 110 ALA C C 110 180.550 179.751 0.799 1
1 1269 . 13 1 1 A 110 110 ALA CA C 110 54.880 55.078 -0.198 1
1 1270 . 13 1 1 A 110 110 ALA CB C 110 18.440 18.372 0.068 1
1 1271 . 13 1 1 A 110 110 ALA N N 110 120.640 122.553 -1.913 1
1 1272 . 13 1 1 A 111 111 ILE H H 111 7.840 7.785 0.055 1
1 1273 . 13 1 1 A 111 111 ILE HA H 111 3.580 3.611 -0.031 1
1 1281 . 13 1 1 A 111 111 ILE C C 111 177.470 178.000 -0.530 1
1 1282 . 13 1 1 A 111 111 ILE CA C 111 64.620 64.951 -0.331 1
1 1283 . 13 1 1 A 111 111 ILE CB C 111 38.600 37.346 1.254 1
1 1286 . 13 1 1 A 111 111 ILE N N 111 119.840 118.883 0.957 1
1 1287 . 13 1 1 A 112 112 MET H H 112 8.100 7.856 0.244 1
1 1288 . 13 1 1 A 112 112 MET HA H 112 4.400 4.137 0.263 1
1 1296 . 13 1 1 A 112 112 MET C C 112 177.710 179.160 -1.450 1
1 1297 . 13 1 1 A 112 112 MET CA C 112 55.300 58.895 -3.595 1
1 1298 . 13 1 1 A 112 112 MET CB C 112 30.510 32.633 -2.123 1
1 1301 . 13 1 1 A 112 112 MET N N 112 115.180 118.190 -3.010 1
1 1302 . 13 1 1 A 113 113 ASN H H 113 8.070 7.965 0.105 1
1 1303 . 13 1 1 A 113 113 ASN HA H 113 4.570 4.349 0.221 1
1 1308 . 13 1 1 A 113 113 ASN C C 113 175.530 178.363 -2.833 1
1 1309 . 13 1 1 A 113 113 ASN CA C 113 54.420 56.524 -2.104 1
1 1310 . 13 1 1 A 113 113 ASN CB C 113 38.350 37.726 0.624 1
1 1311 . 13 1 1 A 113 113 ASN N N 113 117.190 117.359 -0.169 1
1 1313 . 13 1 1 A 114 114 ARG H H 114 8.070 7.682 0.388 1
1 1314 . 13 1 1 A 114 114 ARG HA H 114 4.280 4.018 0.262 1
1 1321 . 13 1 1 A 114 114 ARG C C 114 176.620 178.542 -1.922 1
1 1322 . 13 1 1 A 114 114 ARG CA C 114 56.910 58.971 -2.061 1
1 1323 . 13 1 1 A 114 114 ARG CB C 114 30.370 29.841 0.529 1
1 1326 . 13 1 1 A 114 114 ARG N N 114 118.360 119.536 -1.176 1
1 1327 . 13 1 1 A 115 115 LEU H H 115 8.100 8.011 0.089 1
1 1328 . 13 1 1 A 115 115 LEU HA H 115 4.310 3.475 0.835 1
1 1338 . 13 1 1 A 115 115 LEU C C 115 177.440 177.813 -0.373 1
1 1339 . 13 1 1 A 115 115 LEU CA C 115 55.440 57.989 -2.549 1
1 1340 . 13 1 1 A 115 115 LEU CB C 115 42.250 41.669 0.581 1
1 1344 . 13 1 1 A 115 115 LEU N N 115 120.580 121.398 -0.818 1
1 1345 . 13 1 1 A 116 116 GLN H H 116 8.180 7.224 0.956 1
1 1346 . 13 1 1 A 116 116 GLN HA H 116 4.360 3.962 0.398 1
1 1353 . 13 1 1 A 116 116 GLN C C 116 175.890 176.239 -0.349 1
1 1354 . 13 1 1 A 116 116 GLN CA C 116 55.810 58.855 -3.045 1
1 1355 . 13 1 1 A 116 116 GLN CB C 116 29.500 28.405 1.095 1
1 1357 . 13 1 1 A 116 116 GLN N N 116 119.770 118.055 1.715 1
1 1358 . 13 1 1 A 117 117 GLN H H 117 8.350 8.165 0.185 1
1 1359 . 13 1 1 A 117 117 GLN HA H 117 4.380 4.611 -0.231 1
1 1366 . 13 1 1 A 117 117 GLN C C 117 176.130 174.896 1.234 1
1 1367 . 13 1 1 A 117 117 GLN CA C 117 55.810 55.499 0.311 1
1 1368 . 13 1 1 A 117 117 GLN CB C 117 29.500 29.938 -0.438 1
1 1370 . 13 1 1 A 117 117 GLN N N 117 121.440 119.678 1.762 1
1 1371 . 13 1 1 A 118 118 VAL H H 118 8.240 8.678 -0.438 1
1 1372 . 13 1 1 A 118 118 VAL HA H 118 4.120 4.678 -0.558 1
1 1380 . 13 1 1 A 118 118 VAL C C 118 176.650 177.288 -0.638 1
1 1381 . 13 1 1 A 118 118 VAL CA C 118 62.720 60.754 1.966 1
1 1382 . 13 1 1 A 118 118 VAL CB C 118 32.730 34.973 -2.243 1
1 1385 . 13 1 1 A 118 118 VAL N N 118 121.250 127.189 -5.939 1
1 1386 . 13 1 1 A 119 119 GLY H H 119 8.460 8.814 -0.354 1
1 1387 . 13 1 1 A 119 119 GLY HA2 H 119 3.990 3.854 0.136 1
1 1388 . 13 1 1 A 119 119 GLY HA3 H 119 3.990 3.857 0.133 1
1 1389 . 13 1 1 A 119 119 GLY C C 119 173.770 174.205 -0.435 1
1 1390 . 13 1 1 A 119 119 GLY CA C 119 45.260 47.184 -1.924 1
1 1391 . 13 1 1 A 119 119 GLY N N 119 112.300 113.829 -1.529 1
1 1392 . 13 1 1 A 120 120 ASP H H 120 8.230 7.847 0.383 1
1 1393 . 13 1 1 A 120 120 ASP HA H 120 4.580 4.805 -0.225 1
1 1396 . 13 1 1 A 120 120 ASP C C 120 175.180 175.399 -0.219 1
1 1397 . 13 1 1 A 120 120 ASP CA C 120 54.340 53.560 0.780 1
1 1398 . 13 1 1 A 120 120 ASP CB C 120 41.390 42.599 -1.209 1
1 1399 . 13 1 1 A 120 120 ASP N N 120 120.420 120.705 -0.285 1
1 1400 . 13 1 1 A 121 121 LYS H H 121 7.950 8.366 -0.416 1
1 1401 . 13 1 1 A 121 121 LYS HA H 121 4.240 5.093 -0.853 1
1 1402 . 13 1 1 A 121 121 LYS CA C 121 53.620 53.751 -0.131 1
1 1403 . 13 1 1 A 121 121 LYS N N 121 119.110 123.088 -3.978 1
1 1404 . 13 1 1 A 122 122 PRO HA H 122 4.410 4.562 -0.152 1
1 1405 . 13 1 1 A 122 122 PRO C C 122 176.560 176.591 -0.031 1
1 1406 . 13 1 1 A 122 122 PRO CA C 122 63.130 62.770 0.360 1
1 2 . 14 1 1 A 2 2 SER H H 2 7.890 8.193 -0.303 1
1 3 . 14 1 1 A 2 2 SER HA H 2 4.270 4.205 0.065 1
1 4 . 14 1 1 A 2 2 SER C C 2 173.960 175.077 -1.117 1
1 5 . 14 1 1 A 2 2 SER CA C 2 60.800 61.293 -0.493 1
1 6 . 14 1 1 A 2 2 SER N N 2 111.940 117.031 -5.091 1
1 7 . 14 1 1 A 3 3 GLU H H 3 8.010 8.098 -0.088 1
1 8 . 14 1 1 A 3 3 GLU HA H 3 4.360 4.408 -0.048 1
1 9 . 14 1 1 A 3 3 GLU C C 3 175.710 175.938 -0.228 1
1 10 . 14 1 1 A 3 3 GLU CA C 3 56.310 57.192 -0.882 1
1 11 . 14 1 1 A 3 3 GLU N N 3 121.280 120.798 0.482 1
1 12 . 14 1 1 A 4 4 ALA H H 4 8.540 8.476 0.064 1
1 13 . 14 1 1 A 4 4 ALA HA H 4 4.560 5.019 -0.459 1
1 14 . 14 1 1 A 4 4 ALA CA C 4 50.630 49.453 1.177 1
1 15 . 14 1 1 A 4 4 ALA N N 4 127.840 124.621 3.219 1
1 16 . 14 1 1 A 5 5 PRO HA H 5 4.420 4.553 -0.133 1
1 17 . 14 1 1 A 5 5 PRO C C 5 174.240 176.834 -2.594 1
1 18 . 14 1 1 A 5 5 PRO CA C 5 62.840 62.736 0.104 1
1 19 . 14 1 1 A 6 6 LYS H H 6 8.320 8.374 -0.054 1
1 20 . 14 1 1 A 6 6 LYS HA H 6 4.290 4.554 -0.264 1
1 21 . 14 1 1 A 6 6 LYS C C 6 176.100 176.231 -0.131 1
1 22 . 14 1 1 A 6 6 LYS CA C 6 55.540 55.771 -0.231 1
1 23 . 14 1 1 A 6 6 LYS N N 6 121.910 121.980 -0.070 1
1 24 . 14 1 1 A 7 7 LYS H H 7 8.450 7.647 0.803 1
1 25 . 14 1 1 A 7 7 LYS HA H 7 3.940 4.608 -0.668 1
1 26 . 14 1 1 A 7 7 LYS C C 7 175.700 175.926 -0.226 1
1 27 . 14 1 1 A 7 7 LYS CA C 7 56.440 55.129 1.311 1
1 28 . 14 1 1 A 7 7 LYS N N 7 122.250 120.541 1.709 1
1 29 . 14 1 1 A 8 8 ARG H H 8 8.210 8.848 -0.638 1
1 30 . 14 1 1 A 8 8 ARG HA H 8 4.670 4.867 -0.197 1
1 31 . 14 1 1 A 8 8 ARG C C 8 173.760 174.764 -1.004 1
1 32 . 14 1 1 A 8 8 ARG CA C 8 53.420 53.981 -0.561 1
1 33 . 14 1 1 A 8 8 ARG N N 8 122.560 123.749 -1.189 1
1 34 . 14 1 1 A 9 9 TRP H H 9 8.610 8.799 -0.189 1
1 35 . 14 1 1 A 9 9 TRP HA H 9 4.910 5.377 -0.467 1
1 44 . 14 1 1 A 9 9 TRP C C 9 174.610 175.298 -0.688 1
1 45 . 14 1 1 A 9 9 TRP CA C 9 57.630 55.639 1.991 1
1 46 . 14 1 1 A 9 9 TRP CB C 9 31.020 30.721 0.299 1
1 52 . 14 1 1 A 9 9 TRP N N 9 120.540 121.509 -0.969 1
1 54 . 14 1 1 A 10 10 TYR H H 10 9.260 8.929 0.331 1
1 55 . 14 1 1 A 10 10 TYR HA H 10 4.820 5.300 -0.480 1
1 62 . 14 1 1 A 10 10 TYR C C 10 174.340 175.350 -1.010 1
1 63 . 14 1 1 A 10 10 TYR CA C 10 57.050 56.726 0.324 1
1 64 . 14 1 1 A 10 10 TYR CB C 10 41.920 42.532 -0.612 1
1 69 . 14 1 1 A 10 10 TYR N N 10 118.990 122.342 -3.352 1
1 70 . 14 1 1 A 11 11 VAL H H 11 9.450 8.946 0.504 1
1 71 . 14 1 1 A 11 11 VAL HA H 11 4.470 4.631 -0.161 1
1 79 . 14 1 1 A 11 11 VAL C C 11 175.030 175.527 -0.497 1
1 80 . 14 1 1 A 11 11 VAL CA C 11 62.320 61.762 0.558 1
1 81 . 14 1 1 A 11 11 VAL CB C 11 32.400 33.105 -0.705 1
1 84 . 14 1 1 A 11 11 VAL N N 11 120.930 122.256 -1.326 1
1 85 . 14 1 1 A 12 12 VAL H H 12 9.320 9.217 0.103 1
1 86 . 14 1 1 A 12 12 VAL HA H 12 3.940 3.985 -0.045 1
1 94 . 14 1 1 A 12 12 VAL C C 12 173.870 173.983 -0.113 1
1 95 . 14 1 1 A 12 12 VAL CA C 12 61.330 60.852 0.478 1
1 96 . 14 1 1 A 12 12 VAL CB C 12 33.500 34.441 -0.941 1
1 99 . 14 1 1 A 12 12 VAL N N 12 128.860 126.722 2.138 1
1 100 . 14 1 1 A 13 13 GLN H H 13 8.830 9.252 -0.422 1
1 101 . 14 1 1 A 13 13 GLN HA H 13 4.710 4.551 0.159 1
1 108 . 14 1 1 A 13 13 GLN C C 13 174.230 174.918 -0.688 1
1 109 . 14 1 1 A 13 13 GLN CA C 13 54.800 55.306 -0.506 1
1 110 . 14 1 1 A 13 13 GLN CB C 13 29.450 29.540 -0.090 1
1 111 . 14 1 1 A 13 13 GLN N N 13 126.050 128.386 -2.336 1
1 113 . 14 1 1 A 14 14 ALA H H 14 9.420 9.222 0.198 1
1 114 . 14 1 1 A 14 14 ALA HA H 14 5.150 4.422 0.728 1
1 118 . 14 1 1 A 14 14 ALA C C 14 176.400 175.338 1.062 1
1 119 . 14 1 1 A 14 14 ALA CA C 14 49.660 50.799 -1.139 1
1 120 . 14 1 1 A 14 14 ALA CB C 14 22.840 20.547 2.293 1
1 121 . 14 1 1 A 14 14 ALA N N 14 131.620 126.983 4.637 1
1 122 . 14 1 1 A 15 15 PHE H H 15 8.070 8.694 -0.624 1
1 123 . 14 1 1 A 15 15 PHE HA H 15 4.410 5.121 -0.711 1
1 128 . 14 1 1 A 15 15 PHE C C 15 176.130 175.404 0.726 1
1 129 . 14 1 1 A 15 15 PHE CA C 15 58.550 56.358 2.192 1
1 130 . 14 1 1 A 15 15 PHE CB C 15 39.780 41.956 -2.176 1
1 133 . 14 1 1 A 15 15 PHE N N 15 119.680 115.817 3.863 1
1 134 . 14 1 1 A 16 16 SER H H 16 8.370 8.939 -0.569 1
1 135 . 14 1 1 A 16 16 SER HA H 16 4.140 4.316 -0.176 1
1 138 . 14 1 1 A 16 16 SER C C 16 175.820 175.263 0.557 1
1 139 . 14 1 1 A 16 16 SER CA C 16 60.570 60.054 0.516 1
1 140 . 14 1 1 A 16 16 SER CB C 16 63.030 62.841 0.189 1
1 141 . 14 1 1 A 16 16 SER N N 16 119.700 119.530 0.170 1
1 142 . 14 1 1 A 17 17 GLY H H 17 9.130 8.888 0.242 1
1 143 . 14 1 1 A 17 17 GLY HA2 H 17 3.640 3.764 -0.124 1
1 144 . 14 1 1 A 17 17 GLY HA3 H 17 4.200 3.884 0.316 1
1 145 . 14 1 1 A 17 17 GLY C C 17 175.520 174.996 0.524 1
1 146 . 14 1 1 A 17 17 GLY CA C 17 45.260 45.269 -0.009 1
1 147 . 14 1 1 A 17 17 GLY N N 17 115.850 115.229 0.621 1
1 148 . 14 1 1 A 18 18 PHE H H 18 8.480 8.138 0.342 1
1 149 . 14 1 1 A 18 18 PHE HA H 18 4.740 4.597 0.143 1
1 154 . 14 1 1 A 18 18 PHE C C 18 175.430 176.459 -1.029 1
1 155 . 14 1 1 A 18 18 PHE CA C 18 58.240 58.538 -0.298 1
1 156 . 14 1 1 A 18 18 PHE CB C 18 39.010 39.130 -0.120 1
1 159 . 14 1 1 A 18 18 PHE N N 18 118.550 119.785 -1.235 1
1 160 . 14 1 1 A 19 19 GLU H H 19 10.690 8.407 2.283 1
1 161 . 14 1 1 A 19 19 GLU HA H 19 3.490 4.130 -0.640 1
1 166 . 14 1 1 A 19 19 GLU C C 19 177.650 180.046 -2.396 1
1 167 . 14 1 1 A 19 19 GLU CA C 19 62.280 59.472 2.808 1
1 168 . 14 1 1 A 19 19 GLU CB C 19 28.380 29.157 -0.777 1
1 170 . 14 1 1 A 19 19 GLU N N 19 123.470 120.601 2.869 1
1 171 . 14 1 1 A 20 20 GLY H H 20 8.740 8.404 0.336 1
1 172 . 14 1 1 A 20 20 GLY HA2 H 20 3.840 3.864 -0.024 1
1 173 . 14 1 1 A 20 20 GLY HA3 H 20 3.940 3.871 0.069 1
1 174 . 14 1 1 A 20 20 GLY C C 20 176.860 175.524 1.336 1
1 175 . 14 1 1 A 20 20 GLY CA C 20 47.140 47.474 -0.334 1
1 176 . 14 1 1 A 20 20 GLY N N 20 105.480 109.538 -4.058 1
1 177 . 14 1 1 A 21 21 ARG H H 21 7.690 8.223 -0.533 1
1 178 . 14 1 1 A 21 21 ARG HA H 21 4.180 4.107 0.073 1
1 185 . 14 1 1 A 21 21 ARG C C 21 179.490 178.838 0.652 1
1 186 . 14 1 1 A 21 21 ARG CA C 21 58.660 59.510 -0.850 1
1 187 . 14 1 1 A 21 21 ARG CB C 21 30.100 29.947 0.153 1
1 190 . 14 1 1 A 21 21 ARG N N 21 123.120 121.962 1.158 1
1 191 . 14 1 1 A 22 22 VAL H H 22 8.980 8.582 0.398 1
1 192 . 14 1 1 A 22 22 VAL HA H 22 3.560 3.744 -0.184 1
1 200 . 14 1 1 A 22 22 VAL C C 22 177.320 178.353 -1.033 1
1 201 . 14 1 1 A 22 22 VAL CA C 22 66.960 66.306 0.654 1
1 202 . 14 1 1 A 22 22 VAL CB C 22 31.050 31.605 -0.555 1
1 205 . 14 1 1 A 22 22 VAL N N 22 122.760 119.918 2.842 1
1 206 . 14 1 1 A 23 23 ALA H H 23 8.280 8.144 0.136 1
1 207 . 14 1 1 A 23 23 ALA HA H 23 3.850 4.026 -0.176 1
1 211 . 14 1 1 A 23 23 ALA C C 23 179.340 179.789 -0.449 1
1 212 . 14 1 1 A 23 23 ALA CA C 23 56.260 55.241 1.019 1
1 213 . 14 1 1 A 23 23 ALA CB C 23 18.260 18.272 -0.012 1
1 214 . 14 1 1 A 23 23 ALA N N 23 122.120 121.695 0.425 1
1 215 . 14 1 1 A 24 24 THR H H 24 8.020 7.846 0.174 1
1 216 . 14 1 1 A 24 24 THR HA H 24 3.920 3.892 0.028 1
1 221 . 14 1 1 A 24 24 THR C C 24 176.940 175.849 1.091 1
1 222 . 14 1 1 A 24 24 THR CA C 24 66.820 66.564 0.256 1
1 223 . 14 1 1 A 24 24 THR CB C 24 68.930 68.355 0.575 1
1 225 . 14 1 1 A 24 24 THR N N 24 113.410 115.398 -1.988 1
1 226 . 14 1 1 A 25 25 SER H H 25 8.570 8.446 0.124 1
1 227 . 14 1 1 A 25 25 SER HA H 25 4.400 3.997 0.403 1
1 230 . 14 1 1 A 25 25 SER C C 25 177.610 177.332 0.278 1
1 231 . 14 1 1 A 25 25 SER CA C 25 61.920 61.727 0.193 1
1 232 . 14 1 1 A 25 25 SER CB C 25 63.540 63.249 0.291 1
1 233 . 14 1 1 A 25 25 SER N N 25 118.260 115.456 2.804 1
1 234 . 14 1 1 A 26 26 LEU H H 26 9.430 8.438 0.992 1
1 235 . 14 1 1 A 26 26 LEU HA H 26 3.900 4.153 -0.253 1
1 245 . 14 1 1 A 26 26 LEU C C 26 177.710 178.571 -0.861 1
1 246 . 14 1 1 A 26 26 LEU CA C 26 58.910 58.073 0.837 1
1 247 . 14 1 1 A 26 26 LEU CB C 26 41.300 41.526 -0.226 1
1 251 . 14 1 1 A 26 26 LEU N N 26 124.120 122.174 1.946 1
1 252 . 14 1 1 A 27 27 ARG H H 27 7.790 7.895 -0.105 1
1 253 . 14 1 1 A 27 27 ARG HA H 27 3.880 3.738 0.142 1
1 260 . 14 1 1 A 27 27 ARG C C 27 179.380 178.355 1.025 1
1 261 . 14 1 1 A 27 27 ARG CA C 27 60.510 59.347 1.163 1
1 262 . 14 1 1 A 27 27 ARG CB C 27 29.670 29.769 -0.099 1
1 265 . 14 1 1 A 27 27 ARG N N 27 116.710 118.997 -2.287 1
1 266 . 14 1 1 A 28 28 GLU H H 28 7.900 7.994 -0.094 1
1 267 . 14 1 1 A 28 28 GLU HA H 28 4.070 3.933 0.137 1
1 272 . 14 1 1 A 28 28 GLU C C 28 179.450 179.120 0.330 1
1 273 . 14 1 1 A 28 28 GLU CA C 28 59.450 59.363 0.087 1
1 274 . 14 1 1 A 28 28 GLU CB C 28 29.610 29.298 0.312 1
1 276 . 14 1 1 A 28 28 GLU N N 28 118.340 119.738 -1.398 1
1 277 . 14 1 1 A 29 29 HIS H H 29 8.940 7.513 1.427 1
1 278 . 14 1 1 A 29 29 HIS HA H 29 4.160 4.481 -0.321 1
1 283 . 14 1 1 A 29 29 HIS C C 29 177.750 177.892 -0.142 1
1 284 . 14 1 1 A 29 29 HIS CA C 29 61.260 59.900 1.360 1
1 285 . 14 1 1 A 29 29 HIS CB C 29 29.870 29.949 -0.079 1
1 287 . 14 1 1 A 29 29 HIS N N 29 120.440 118.383 2.057 1
1 288 . 14 1 1 A 30 30 ILE H H 30 8.580 8.251 0.329 1
1 289 . 14 1 1 A 30 30 ILE HA H 30 3.160 3.630 -0.470 1
1 299 . 14 1 1 A 30 30 ILE C C 30 177.230 177.815 -0.585 1
1 300 . 14 1 1 A 30 30 ILE CA C 30 66.460 65.179 1.281 1
1 301 . 14 1 1 A 30 30 ILE CB C 30 38.630 37.484 1.146 1
1 305 . 14 1 1 A 30 30 ILE N N 30 121.010 120.202 0.808 1
1 306 . 14 1 1 A 31 31 LYS H H 31 7.020 8.109 -1.089 1
1 307 . 14 1 1 A 31 31 LYS HA H 31 4.170 4.006 0.164 1
1 316 . 14 1 1 A 31 31 LYS C C 31 180.570 179.069 1.501 1
1 317 . 14 1 1 A 31 31 LYS CA C 31 58.920 59.987 -1.067 1
1 318 . 14 1 1 A 31 31 LYS CB C 31 32.490 32.590 -0.100 1
1 322 . 14 1 1 A 31 31 LYS N N 31 117.400 119.055 -1.655 1
1 323 . 14 1 1 A 32 32 LEU H H 32 8.400 7.965 0.435 1
1 324 . 14 1 1 A 32 32 LEU HA H 32 3.990 3.963 0.027 1
1 334 . 14 1 1 A 32 32 LEU C C 32 178.230 178.209 0.021 1
1 335 . 14 1 1 A 32 32 LEU CA C 32 57.700 57.810 -0.110 1
1 336 . 14 1 1 A 32 32 LEU CB C 32 42.540 41.886 0.654 1
1 340 . 14 1 1 A 32 32 LEU N N 32 121.180 119.414 1.766 1
1 341 . 14 1 1 A 33 33 HIS H H 33 7.620 8.080 -0.460 1
1 342 . 14 1 1 A 33 33 HIS HA H 33 4.600 4.657 -0.057 1
1 347 . 14 1 1 A 33 33 HIS C C 33 177.090 174.059 3.031 1
1 348 . 14 1 1 A 33 33 HIS CA C 33 55.840 55.609 0.231 1
1 349 . 14 1 1 A 33 33 HIS CB C 33 29.330 29.998 -0.668 1
1 351 . 14 1 1 A 33 33 HIS N N 33 112.220 115.874 -3.654 1
1 352 . 14 1 1 A 34 34 ASN H H 34 8.030 8.031 -0.001 1
1 353 . 14 1 1 A 34 34 ASN HA H 34 4.890 4.374 0.516 1
1 358 . 14 1 1 A 34 34 ASN C C 34 175.910 175.557 0.353 1
1 359 . 14 1 1 A 34 34 ASN CA C 34 54.530 54.434 0.096 1
1 360 . 14 1 1 A 34 34 ASN CB C 34 37.380 36.715 0.665 1
1 361 . 14 1 1 A 34 34 ASN N N 34 117.600 114.434 3.166 1
1 363 . 14 1 1 A 35 35 MET H H 35 8.330 8.625 -0.295 1
1 364 . 14 1 1 A 35 35 MET HA H 35 4.940 4.774 0.166 1
1 372 . 14 1 1 A 35 35 MET C C 35 176.880 176.871 0.009 1
1 373 . 14 1 1 A 35 35 MET CA C 35 55.600 54.668 0.932 1
1 374 . 14 1 1 A 35 35 MET CB C 35 33.790 32.355 1.435 1
1 377 . 14 1 1 A 35 35 MET N N 35 116.190 116.229 -0.039 1
1 378 . 14 1 1 A 36 36 GLU H H 36 9.730 8.111 1.619 1
1 379 . 14 1 1 A 36 36 GLU HA H 36 3.850 4.146 -0.296 1
1 384 . 14 1 1 A 36 36 GLU C C 36 178.290 179.313 -1.023 1
1 385 . 14 1 1 A 36 36 GLU CA C 36 61.280 59.853 1.427 1
1 386 . 14 1 1 A 36 36 GLU CB C 36 29.270 29.206 0.064 1
1 388 . 14 1 1 A 36 36 GLU N N 36 121.630 120.509 1.121 1
1 389 . 14 1 1 A 37 37 ASP H H 37 8.850 8.028 0.822 1
1 390 . 14 1 1 A 37 37 ASP HA H 37 4.470 4.473 -0.003 1
1 393 . 14 1 1 A 37 37 ASP C C 37 177.190 178.938 -1.748 1
1 394 . 14 1 1 A 37 37 ASP CA C 37 56.140 57.235 -1.095 1
1 395 . 14 1 1 A 37 37 ASP CB C 37 40.050 40.782 -0.732 1
1 396 . 14 1 1 A 37 37 ASP N N 37 114.390 120.336 -5.946 1
1 397 . 14 1 1 A 38 38 LEU H H 38 7.880 7.686 0.194 1
1 398 . 14 1 1 A 38 38 LEU HA H 38 4.290 3.970 0.320 1
1 408 . 14 1 1 A 38 38 LEU C C 38 175.090 177.511 -2.421 1
1 409 . 14 1 1 A 38 38 LEU CA C 38 54.670 57.906 -3.236 1
1 410 . 14 1 1 A 38 38 LEU CB C 38 42.940 42.030 0.910 1
1 414 . 14 1 1 A 38 38 LEU N N 38 116.550 119.251 -2.701 1
1 415 . 14 1 1 A 39 39 PHE H H 39 7.500 7.623 -0.123 1
1 416 . 14 1 1 A 39 39 PHE HA H 39 4.970 4.653 0.317 1
1 424 . 14 1 1 A 39 39 PHE C C 39 175.380 175.698 -0.318 1
1 425 . 14 1 1 A 39 39 PHE CA C 39 57.580 58.075 -0.495 1
1 426 . 14 1 1 A 39 39 PHE CB C 39 44.990 39.640 5.350 1
1 432 . 14 1 1 A 39 39 PHE N N 39 115.370 116.564 -1.194 1
1 433 . 14 1 1 A 40 40 GLY H H 40 8.680 8.600 0.080 1
1 434 . 14 1 1 A 40 40 GLY HA2 H 40 3.370 4.059 -0.689 1
1 435 . 14 1 1 A 40 40 GLY HA3 H 40 4.550 4.131 0.419 1
1 436 . 14 1 1 A 40 40 GLY C C 40 173.090 173.749 -0.659 1
1 437 . 14 1 1 A 40 40 GLY CA C 40 44.180 46.136 -1.956 1
1 438 . 14 1 1 A 40 40 GLY N N 40 110.930 111.205 -0.275 1
1 439 . 14 1 1 A 41 41 GLU H H 41 8.320 7.702 0.618 1
1 440 . 14 1 1 A 41 41 GLU HA H 41 4.280 4.855 -0.575 1
1 445 . 14 1 1 A 41 41 GLU C C 41 173.900 175.253 -1.353 1
1 446 . 14 1 1 A 41 41 GLU CA C 41 56.900 54.528 2.372 1
1 447 . 14 1 1 A 41 41 GLU CB C 41 32.110 34.577 -2.467 1
1 449 . 14 1 1 A 41 41 GLU N N 41 126.730 117.379 9.351 1
1 450 . 14 1 1 A 42 42 VAL H H 42 8.100 8.598 -0.498 1
1 451 . 14 1 1 A 42 42 VAL HA H 42 5.160 5.109 0.051 1
1 459 . 14 1 1 A 42 42 VAL C C 42 176.340 175.266 1.074 1
1 460 . 14 1 1 A 42 42 VAL CA C 42 61.200 60.630 0.570 1
1 461 . 14 1 1 A 42 42 VAL CB C 42 34.770 35.257 -0.487 1
1 464 . 14 1 1 A 42 42 VAL N N 42 119.360 121.462 -2.102 1
1 465 . 14 1 1 A 43 43 MET H H 43 9.870 9.134 0.736 1
1 466 . 14 1 1 A 43 43 MET HA H 43 5.070 5.386 -0.316 1
1 474 . 14 1 1 A 43 43 MET C C 43 173.890 175.127 -1.237 1
1 475 . 14 1 1 A 43 43 MET CA C 43 54.740 54.144 0.596 1
1 476 . 14 1 1 A 43 43 MET CB C 43 37.500 36.583 0.917 1
1 479 . 14 1 1 A 43 43 MET N N 43 125.720 124.487 1.233 1
1 480 . 14 1 1 A 44 44 VAL H H 44 8.800 8.863 -0.063 1
1 481 . 14 1 1 A 44 44 VAL HA H 44 4.720 4.661 0.059 1
1 489 . 14 1 1 A 44 44 VAL CA C 44 59.090 59.167 -0.077 1
1 490 . 14 1 1 A 44 44 VAL CB C 44 33.710 34.028 -0.318 1
1 493 . 14 1 1 A 44 44 VAL N N 44 122.340 122.644 -0.304 1
1 494 . 14 1 1 A 45 45 PRO HA H 45 4.480 4.129 0.351 1
1 501 . 14 1 1 A 45 45 PRO C C 45 177.080 175.966 1.114 1
1 502 . 14 1 1 A 45 45 PRO CA C 45 63.240 63.436 -0.196 1
1 503 . 14 1 1 A 45 45 PRO CB C 45 32.170 30.360 1.810 1
1 506 . 14 1 1 A 46 46 THR H H 46 8.200 7.696 0.504 1
1 507 . 14 1 1 A 46 46 THR HA H 46 4.290 4.244 0.046 1
1 512 . 14 1 1 A 46 46 THR C C 46 174.600 175.569 -0.969 1
1 513 . 14 1 1 A 46 46 THR CA C 46 62.100 60.700 1.400 1
1 514 . 14 1 1 A 46 46 THR CB C 46 69.990 70.154 -0.164 1
1 516 . 14 1 1 A 46 46 THR N N 46 113.410 111.217 2.193 1
1 517 . 14 1 1 A 47 47 GLU H H 47 8.380 8.648 -0.268 1
1 518 . 14 1 1 A 47 47 GLU HA H 47 4.400 4.152 0.248 1
1 521 . 14 1 1 A 47 47 GLU C C 47 175.970 176.865 -0.895 1
1 522 . 14 1 1 A 47 47 GLU CA C 47 55.200 58.864 -3.664 1
1 523 . 14 1 1 A 47 47 GLU CB C 47 32.300 30.465 1.835 1
1 524 . 14 1 1 A 47 47 GLU N N 47 122.830 123.543 -0.713 1
1 525 . 14 1 1 A 48 48 GLU H H 48 8.400 7.891 0.509 1
1 526 . 14 1 1 A 48 48 GLU HA H 48 4.280 4.708 -0.428 1
1 531 . 14 1 1 A 48 48 GLU C C 48 175.750 176.684 -0.934 1
1 532 . 14 1 1 A 48 48 GLU CA C 48 55.190 54.889 0.301 1
1 533 . 14 1 1 A 48 48 GLU CB C 48 31.980 33.670 -1.690 1
1 535 . 14 1 1 A 48 48 GLU N N 48 121.950 116.962 4.988 1
1 536 . 14 1 1 A 49 49 VAL H H 49 8.240 8.338 -0.098 1
1 537 . 14 1 1 A 49 49 VAL HA H 49 4.170 3.806 0.364 1
1 542 . 14 1 1 A 49 49 VAL C C 49 174.610 176.295 -1.685 1
1 543 . 14 1 1 A 49 49 VAL CA C 49 62.280 65.154 -2.874 1
1 544 . 14 1 1 A 49 49 VAL CB C 49 32.930 31.695 1.235 1
1 546 . 14 1 1 A 49 49 VAL N N 49 123.990 121.731 2.259 1
1 547 . 14 1 1 A 50 50 VAL H H 50 8.230 7.927 0.303 1
1 548 . 14 1 1 A 50 50 VAL HA H 50 4.220 4.365 -0.145 1
1 553 . 14 1 1 A 50 50 VAL C C 50 175.770 175.321 0.449 1
1 554 . 14 1 1 A 50 50 VAL CA C 50 62.170 61.158 1.012 1
1 555 . 14 1 1 A 50 50 VAL CB C 50 33.110 33.695 -0.585 1
1 557 . 14 1 1 A 50 50 VAL N N 50 123.960 118.351 5.609 1
1 558 . 14 1 1 A 51 51 GLU H H 51 8.570 8.814 -0.244 1
1 559 . 14 1 1 A 51 51 GLU HA H 51 4.380 4.628 -0.248 1
1 564 . 14 1 1 A 51 51 GLU C C 51 175.920 175.256 0.664 1
1 565 . 14 1 1 A 51 51 GLU CA C 51 56.050 56.392 -0.342 1
1 566 . 14 1 1 A 51 51 GLU CB C 51 31.080 30.831 0.249 1
1 568 . 14 1 1 A 51 51 GLU N N 51 125.070 126.725 -1.655 1
1 569 . 14 1 1 A 52 52 ILE H H 52 8.320 8.625 -0.305 1
1 570 . 14 1 1 A 52 52 ILE HA H 52 4.290 4.496 -0.206 1
1 580 . 14 1 1 A 52 52 ILE C C 52 176.330 176.037 0.293 1
1 581 . 14 1 1 A 52 52 ILE CA C 52 60.940 60.522 0.418 1
1 582 . 14 1 1 A 52 52 ILE CB C 52 38.510 40.306 -1.796 1
1 586 . 14 1 1 A 52 52 ILE N N 52 122.760 126.865 -4.105 1
1 587 . 14 1 1 A 53 53 ARG H H 53 8.500 8.734 -0.234 1
1 588 . 14 1 1 A 53 53 ARG HA H 53 4.430 4.003 0.427 1
1 595 . 14 1 1 A 53 53 ARG C C 53 176.950 178.489 -1.539 1
1 596 . 14 1 1 A 53 53 ARG CA C 53 56.150 59.132 -2.982 1
1 597 . 14 1 1 A 53 53 ARG CB C 53 30.200 29.994 0.206 1
1 600 . 14 1 1 A 53 53 ARG N N 53 125.250 128.848 -3.598 1
1 601 . 14 1 1 A 54 54 GLY H H 54 8.760 8.030 0.730 1
1 602 . 14 1 1 A 54 54 GLY HA2 H 54 3.920 3.910 0.010 1
1 603 . 14 1 1 A 54 54 GLY HA3 H 54 4.010 3.911 0.099 1
1 604 . 14 1 1 A 54 54 GLY C C 54 175.110 174.576 0.534 1
1 605 . 14 1 1 A 54 54 GLY CA C 54 46.030 44.750 1.280 1
1 606 . 14 1 1 A 54 54 GLY N N 54 112.510 109.365 3.145 1
1 607 . 14 1 1 A 55 55 GLY H H 55 8.350 8.287 0.063 1
1 608 . 14 1 1 A 55 55 GLY HA2 H 55 3.980 3.914 0.066 1
1 609 . 14 1 1 A 55 55 GLY HA3 H 55 3.980 3.915 0.065 1
1 610 . 14 1 1 A 55 55 GLY C C 55 173.920 173.299 0.621 1
1 611 . 14 1 1 A 55 55 GLY CA C 55 45.200 47.260 -2.060 1
1 612 . 14 1 1 A 55 55 GLY N N 55 107.940 108.985 -1.045 1
1 613 . 14 1 1 A 56 56 GLN H H 56 8.100 8.500 -0.400 1
1 614 . 14 1 1 A 56 56 GLN HA H 56 4.420 4.654 -0.234 1
1 619 . 14 1 1 A 56 56 GLN C C 56 175.570 177.032 -1.462 1
1 620 . 14 1 1 A 56 56 GLN CA C 56 55.420 54.323 1.097 1
1 621 . 14 1 1 A 56 56 GLN CB C 56 30.100 30.436 -0.336 1
1 623 . 14 1 1 A 56 56 GLN N N 56 119.350 123.138 -3.788 1
1 624 . 14 1 1 A 57 57 ARG H H 57 8.520 8.789 -0.269 1
1 625 . 14 1 1 A 57 57 ARG HA H 57 4.400 4.000 0.400 1
1 632 . 14 1 1 A 57 57 ARG C C 57 176.210 177.216 -1.006 1
1 633 . 14 1 1 A 57 57 ARG CA C 57 56.440 59.588 -3.148 1
1 634 . 14 1 1 A 57 57 ARG CB C 57 30.930 30.092 0.838 1
1 637 . 14 1 1 A 57 57 ARG N N 57 122.610 122.831 -0.221 1
1 638 . 14 1 1 A 58 58 ARG H H 58 8.630 7.825 0.805 1
1 639 . 14 1 1 A 58 58 ARG HA H 58 4.430 4.326 0.104 1
1 646 . 14 1 1 A 58 58 ARG C C 58 175.950 175.586 0.364 1
1 647 . 14 1 1 A 58 58 ARG CA C 58 55.450 56.991 -1.541 1
1 648 . 14 1 1 A 58 58 ARG CB C 58 31.300 30.903 0.397 1
1 651 . 14 1 1 A 58 58 ARG N N 58 123.320 118.749 4.571 1
1 652 . 14 1 1 A 59 59 LYS H H 59 8.560 8.639 -0.079 1
1 653 . 14 1 1 A 59 59 LYS HA H 59 4.410 4.917 -0.507 1
1 662 . 14 1 1 A 59 59 LYS C C 59 176.590 175.114 1.476 1
1 663 . 14 1 1 A 59 59 LYS CA C 59 56.720 55.539 1.181 1
1 664 . 14 1 1 A 59 59 LYS CB C 59 33.150 33.854 -0.704 1
1 668 . 14 1 1 A 59 59 LYS N N 59 123.380 124.117 -0.737 1
1 669 . 14 1 1 A 60 60 SER H H 60 8.450 8.987 -0.537 1
1 670 . 14 1 1 A 60 60 SER HA H 60 4.480 5.507 -1.027 1
1 673 . 14 1 1 A 60 60 SER C C 60 174.280 173.300 0.980 1
1 674 . 14 1 1 A 60 60 SER CA C 60 58.140 56.875 1.265 1
1 675 . 14 1 1 A 60 60 SER CB C 60 64.160 66.260 -2.100 1
1 676 . 14 1 1 A 60 60 SER N N 60 117.320 123.808 -6.488 1
1 677 . 14 1 1 A 61 61 GLU H H 61 8.550 9.239 -0.689 1
1 678 . 14 1 1 A 61 61 GLU HA H 61 4.400 4.999 -0.599 1
1 683 . 14 1 1 A 61 61 GLU C C 61 176.150 176.230 -0.080 1
1 684 . 14 1 1 A 61 61 GLU CA C 61 56.300 54.767 1.533 1
1 685 . 14 1 1 A 61 61 GLU CB C 61 30.790 32.852 -2.062 1
1 687 . 14 1 1 A 61 61 GLU N N 61 122.810 124.100 -1.290 1
1 688 . 14 1 1 A 62 62 ARG H H 62 8.310 8.958 -0.648 1
1 689 . 14 1 1 A 62 62 ARG HA H 62 4.340 4.708 -0.368 1
1 692 . 14 1 1 A 62 62 ARG C C 62 176.140 177.015 -0.875 1
1 693 . 14 1 1 A 62 62 ARG CA C 62 56.230 56.242 -0.012 1
1 694 . 14 1 1 A 62 62 ARG CB C 62 30.780 30.406 0.374 1
1 695 . 14 1 1 A 62 62 ARG N N 62 122.080 123.518 -1.438 1
1 696 . 14 1 1 A 63 63 LYS H H 63 8.470 7.964 0.506 1
1 697 . 14 1 1 A 63 63 LYS HA H 63 4.300 4.020 0.280 1
1 700 . 14 1 1 A 63 63 LYS C C 63 175.490 179.477 -3.987 1
1 701 . 14 1 1 A 63 63 LYS CA C 63 56.200 58.501 -2.301 1
1 702 . 14 1 1 A 63 63 LYS CB C 63 30.730 32.139 -1.409 1
1 703 . 14 1 1 A 63 63 LYS N N 63 123.450 120.087 3.363 1
1 704 . 14 1 1 A 64 64 PHE H H 64 8.200 8.029 0.171 1
1 705 . 14 1 1 A 64 64 PHE HA H 64 4.450 4.301 0.149 1
1 710 . 14 1 1 A 64 64 PHE C C 64 174.250 176.110 -1.860 1
1 711 . 14 1 1 A 64 64 PHE CA C 64 57.430 60.074 -2.644 1
1 712 . 14 1 1 A 64 64 PHE CB C 64 40.330 38.854 1.476 1
1 715 . 14 1 1 A 64 64 PHE N N 64 121.740 118.255 3.485 1
1 716 . 14 1 1 A 65 65 PHE H H 65 8.130 8.085 0.045 1
1 717 . 14 1 1 A 65 65 PHE HA H 65 4.440 5.063 -0.623 1
1 725 . 14 1 1 A 65 65 PHE CA C 65 55.650 55.111 0.539 1
1 726 . 14 1 1 A 65 65 PHE CB C 65 38.900 39.056 -0.156 1
1 731 . 14 1 1 A 65 65 PHE N N 65 120.910 116.968 3.942 1
1 732 . 14 1 1 A 66 66 PRO C C 66 176.780 177.976 -1.196 1
1 733 . 14 1 1 A 67 67 GLY H H 67 9.970 8.827 1.143 1
1 734 . 14 1 1 A 67 67 GLY HA2 H 67 3.820 4.038 -0.218 1
1 735 . 14 1 1 A 67 67 GLY HA3 H 67 4.400 4.082 0.318 1
1 736 . 14 1 1 A 67 67 GLY C C 67 173.670 174.255 -0.585 1
1 737 . 14 1 1 A 67 67 GLY CA C 67 45.900 46.288 -0.388 1
1 738 . 14 1 1 A 67 67 GLY N N 67 111.550 113.047 -1.497 1
1 739 . 14 1 1 A 68 68 TYR H H 68 7.650 8.801 -1.151 1
1 740 . 14 1 1 A 68 68 TYR HA H 68 5.000 4.871 0.129 1
1 747 . 14 1 1 A 68 68 TYR C C 68 175.220 175.195 0.025 1
1 748 . 14 1 1 A 68 68 TYR CA C 68 57.940 57.396 0.544 1
1 753 . 14 1 1 A 68 68 TYR N N 68 118.800 118.461 0.339 1
1 754 . 14 1 1 A 69 69 VAL H H 69 9.090 9.043 0.047 1
1 755 . 14 1 1 A 69 69 VAL HA H 69 4.330 4.842 -0.512 1
1 763 . 14 1 1 A 69 69 VAL C C 69 174.250 174.818 -0.568 1
1 764 . 14 1 1 A 69 69 VAL CA C 69 62.120 60.361 1.759 1
1 765 . 14 1 1 A 69 69 VAL CB C 69 35.240 35.912 -0.672 1
1 768 . 14 1 1 A 69 69 VAL N N 69 119.300 123.097 -3.797 1
1 769 . 14 1 1 A 70 70 LEU H H 70 9.190 8.872 0.318 1
1 770 . 14 1 1 A 70 70 LEU HA H 70 5.460 5.463 -0.003 1
1 780 . 14 1 1 A 70 70 LEU C C 70 176.130 176.047 0.083 1
1 781 . 14 1 1 A 70 70 LEU CA C 70 54.120 53.565 0.555 1
1 782 . 14 1 1 A 70 70 LEU CB C 70 43.330 44.216 -0.886 1
1 786 . 14 1 1 A 70 70 LEU N N 70 126.710 126.683 0.027 1
1 787 . 14 1 1 A 71 71 VAL H H 71 9.350 9.102 0.248 1
1 788 . 14 1 1 A 71 71 VAL HA H 71 5.040 4.810 0.230 1
1 796 . 14 1 1 A 71 71 VAL C C 71 173.670 174.761 -1.091 1
1 797 . 14 1 1 A 71 71 VAL CA C 71 61.090 61.334 -0.244 1
1 798 . 14 1 1 A 71 71 VAL CB C 71 35.800 35.579 0.221 1
1 801 . 14 1 1 A 71 71 VAL N N 71 121.920 123.522 -1.602 1
1 802 . 14 1 1 A 72 72 GLN H H 72 8.390 8.585 -0.195 1
1 803 . 14 1 1 A 72 72 GLN HA H 72 4.610 4.539 0.071 1
1 810 . 14 1 1 A 72 72 GLN C C 72 175.920 174.576 1.344 1
1 811 . 14 1 1 A 72 72 GLN CA C 72 53.810 55.421 -1.611 1
1 812 . 14 1 1 A 72 72 GLN CB C 72 28.850 28.364 0.486 1
1 814 . 14 1 1 A 72 72 GLN N N 72 130.760 127.789 2.971 1
1 816 . 14 1 1 A 73 73 MET H H 73 9.750 8.757 0.993 1
1 817 . 14 1 1 A 73 73 MET HA H 73 5.060 5.164 -0.104 1
1 825 . 14 1 1 A 73 73 MET C C 73 175.500 174.311 1.189 1
1 826 . 14 1 1 A 73 73 MET CA C 73 55.520 54.562 0.958 1
1 827 . 14 1 1 A 73 73 MET CB C 73 35.350 35.650 -0.300 1
1 830 . 14 1 1 A 73 73 MET N N 73 121.070 124.961 -3.891 1
1 831 . 14 1 1 A 74 74 VAL H H 74 8.530 8.277 0.253 1
1 832 . 14 1 1 A 74 74 VAL HA H 74 3.970 4.295 -0.325 1
1 840 . 14 1 1 A 74 74 VAL C C 74 174.900 175.819 -0.919 1
1 841 . 14 1 1 A 74 74 VAL CA C 74 62.150 61.617 0.533 1
1 842 . 14 1 1 A 74 74 VAL CB C 74 32.480 31.941 0.539 1
1 845 . 14 1 1 A 74 74 VAL N N 74 124.120 121.997 2.123 1
1 846 . 14 1 1 A 75 75 MET H H 75 8.600 8.420 0.180 1
1 847 . 14 1 1 A 75 75 MET HA H 75 4.360 4.348 0.012 1
1 855 . 14 1 1 A 75 75 MET C C 75 173.480 176.212 -2.732 1
1 856 . 14 1 1 A 75 75 MET CA C 75 53.830 54.621 -0.791 1
1 857 . 14 1 1 A 75 75 MET CB C 75 29.960 31.924 -1.964 1
1 860 . 14 1 1 A 75 75 MET N N 75 128.250 125.899 2.351 1
1 861 . 14 1 1 A 76 76 ASN H H 76 8.410 8.034 0.376 1
1 862 . 14 1 1 A 76 76 ASN HA H 76 4.540 4.966 -0.426 1
1 867 . 14 1 1 A 76 76 ASN C C 76 173.950 175.009 -1.059 1
1 868 . 14 1 1 A 76 76 ASN CA C 76 51.720 51.860 -0.140 1
1 869 . 14 1 1 A 76 76 ASN CB C 76 38.430 40.669 -2.239 1
1 870 . 14 1 1 A 76 76 ASN N N 76 127.500 122.534 4.966 1
1 872 . 14 1 1 A 77 77 ASP H H 77 8.470 8.718 -0.248 1
1 873 . 14 1 1 A 77 77 ASP HA H 77 4.410 4.266 0.144 1
1 876 . 14 1 1 A 77 77 ASP C C 77 178.530 177.631 0.899 1
1 877 . 14 1 1 A 77 77 ASP CA C 77 58.730 57.029 1.701 1
1 878 . 14 1 1 A 77 77 ASP CB C 77 40.940 40.495 0.445 1
1 879 . 14 1 1 A 77 77 ASP N N 77 117.090 120.041 -2.951 1
1 880 . 14 1 1 A 78 78 ALA H H 78 8.160 8.013 0.147 1
1 881 . 14 1 1 A 78 78 ALA HA H 78 4.350 4.099 0.251 1
1 885 . 14 1 1 A 78 78 ALA C C 78 181.250 179.977 1.273 1
1 886 . 14 1 1 A 78 78 ALA CA C 78 55.190 55.338 -0.148 1
1 887 . 14 1 1 A 78 78 ALA CB C 78 18.260 19.092 -0.832 1
1 888 . 14 1 1 A 78 78 ALA N N 78 122.500 121.927 0.573 1
1 889 . 14 1 1 A 79 79 SER H H 79 9.320 8.762 0.558 1
1 890 . 14 1 1 A 79 79 SER HA H 79 4.290 4.326 -0.036 1
1 893 . 14 1 1 A 79 79 SER C C 79 176.570 176.664 -0.094 1
1 894 . 14 1 1 A 79 79 SER CA C 79 61.080 61.444 -0.364 1
1 895 . 14 1 1 A 79 79 SER CB C 79 62.200 62.345 -0.145 1
1 896 . 14 1 1 A 79 79 SER N N 79 119.280 112.265 7.015 1
1 897 . 14 1 1 A 80 80 TRP H H 80 8.900 8.019 0.881 1
1 898 . 14 1 1 A 80 80 TRP HA H 80 4.020 4.241 -0.221 1
1 907 . 14 1 1 A 80 80 TRP C C 80 178.210 177.892 0.318 1
1 908 . 14 1 1 A 80 80 TRP CA C 80 62.490 61.385 1.105 1
1 909 . 14 1 1 A 80 80 TRP CB C 80 29.800 29.623 0.177 1
1 915 . 14 1 1 A 80 80 TRP N N 80 125.870 123.519 2.351 1
1 917 . 14 1 1 A 81 81 HIS H H 81 8.190 8.199 -0.009 1
1 918 . 14 1 1 A 81 81 HIS HA H 81 3.930 4.383 -0.453 1
1 923 . 14 1 1 A 81 81 HIS C C 81 177.740 176.630 1.110 1
1 924 . 14 1 1 A 81 81 HIS CA C 81 61.020 59.824 1.196 1
1 925 . 14 1 1 A 81 81 HIS CB C 81 28.910 30.053 -1.143 1
1 927 . 14 1 1 A 81 81 HIS N N 81 114.080 119.770 -5.690 1
1 928 . 14 1 1 A 82 82 LEU H H 82 8.080 8.682 -0.602 1
1 929 . 14 1 1 A 82 82 LEU HA H 82 3.900 3.740 0.160 1
1 939 . 14 1 1 A 82 82 LEU C C 82 180.330 178.473 1.857 1
1 940 . 14 1 1 A 82 82 LEU CA C 82 58.590 58.326 0.264 1
1 941 . 14 1 1 A 82 82 LEU CB C 82 41.350 41.447 -0.097 1
1 945 . 14 1 1 A 82 82 LEU N N 82 121.320 120.444 0.876 1
1 946 . 14 1 1 A 83 83 VAL H H 83 8.000 8.600 -0.600 1
1 947 . 14 1 1 A 83 83 VAL HA H 83 3.210 3.418 -0.208 1
1 955 . 14 1 1 A 83 83 VAL C C 83 177.060 178.107 -1.047 1
1 956 . 14 1 1 A 83 83 VAL CA C 83 67.430 66.796 0.634 1
1 957 . 14 1 1 A 83 83 VAL CB C 83 31.680 31.506 0.174 1
1 960 . 14 1 1 A 83 83 VAL N N 83 118.850 118.978 -0.128 1
1 961 . 14 1 1 A 84 84 ARG H H 84 7.540 7.785 -0.245 1
1 962 . 14 1 1 A 84 84 ARG HA H 84 3.590 3.698 -0.108 1
1 969 . 14 1 1 A 84 84 ARG C C 84 177.240 178.581 -1.341 1
1 970 . 14 1 1 A 84 84 ARG CA C 84 56.050 59.556 -3.506 1
1 971 . 14 1 1 A 84 84 ARG CB C 84 28.190 29.826 -1.636 1
1 974 . 14 1 1 A 84 84 ARG N N 84 111.460 120.477 -9.017 1
1 975 . 14 1 1 A 85 85 SER H H 85 7.530 7.669 -0.139 1
1 976 . 14 1 1 A 85 85 SER HA H 85 4.280 3.978 0.302 1
1 979 . 14 1 1 A 85 85 SER C C 85 173.930 175.224 -1.294 1
1 980 . 14 1 1 A 85 85 SER CA C 85 59.220 62.070 -2.850 1
1 981 . 14 1 1 A 85 85 SER CB C 85 63.830 62.558 1.272 1
1 982 . 14 1 1 A 85 85 SER N N 85 113.660 114.614 -0.954 1
1 983 . 14 1 1 A 86 86 VAL H H 86 7.230 7.383 -0.153 1
1 984 . 14 1 1 A 86 86 VAL HA H 86 3.480 3.847 -0.367 1
1 992 . 14 1 1 A 86 86 VAL CA C 86 61.300 61.246 0.054 1
1 993 . 14 1 1 A 86 86 VAL CB C 86 31.780 32.146 -0.366 1
1 996 . 14 1 1 A 86 86 VAL N N 86 128.120 121.878 6.242 1
1 997 . 14 1 1 A 87 87 PRO HA H 87 4.140 4.365 -0.225 1
1 1004 . 14 1 1 A 87 87 PRO C C 87 176.400 176.729 -0.329 1
1 1005 . 14 1 1 A 87 87 PRO CA C 87 64.100 63.145 0.955 1
1 1006 . 14 1 1 A 87 87 PRO CB C 87 31.710 32.361 -0.651 1
1 1009 . 14 1 1 A 88 88 ARG H H 88 8.320 8.750 -0.430 1
1 1010 . 14 1 1 A 88 88 ARG HA H 88 3.030 3.906 -0.876 1
1 1017 . 14 1 1 A 88 88 ARG C C 88 174.630 174.617 0.013 1
1 1018 . 14 1 1 A 88 88 ARG CA C 88 57.620 57.569 0.051 1
1 1019 . 14 1 1 A 88 88 ARG CB C 88 26.960 27.935 -0.975 1
1 1022 . 14 1 1 A 88 88 ARG N N 88 111.360 115.990 -4.630 1
1 1023 . 14 1 1 A 89 89 VAL H H 89 7.390 7.837 -0.447 1
1 1024 . 14 1 1 A 89 89 VAL HA H 89 3.910 4.454 -0.544 1
1 1032 . 14 1 1 A 89 89 VAL C C 89 177.370 175.273 2.097 1
1 1033 . 14 1 1 A 89 89 VAL CA C 89 64.170 59.398 4.772 1
1 1034 . 14 1 1 A 89 89 VAL CB C 89 32.070 34.703 -2.633 1
1 1037 . 14 1 1 A 89 89 VAL N N 89 117.900 118.470 -0.570 1
1 1038 . 14 1 1 A 90 90 MET H H 90 9.290 8.718 0.572 1
1 1039 . 14 1 1 A 90 90 MET HA H 90 4.340 4.255 0.085 1
1 1047 . 14 1 1 A 90 90 MET C C 90 175.800 175.921 -0.121 1
1 1048 . 14 1 1 A 90 90 MET CA C 90 56.440 57.033 -0.593 1
1 1049 . 14 1 1 A 90 90 MET CB C 90 34.160 33.582 0.578 1
1 1052 . 14 1 1 A 90 90 MET N N 90 128.200 126.891 1.309 1
1 1053 . 14 1 1 A 91 91 GLY H H 91 7.130 6.787 0.343 1
1 1054 . 14 1 1 A 91 91 GLY HA2 H 91 3.340 3.870 -0.530 1
1 1055 . 14 1 1 A 91 91 GLY HA3 H 91 4.410 4.007 0.403 1
1 1056 . 14 1 1 A 91 91 GLY C C 91 170.920 171.407 -0.487 1
1 1057 . 14 1 1 A 91 91 GLY CA C 91 44.440 45.817 -1.377 1
1 1058 . 14 1 1 A 91 91 GLY N N 91 104.320 103.547 0.773 1
1 1059 . 14 1 1 A 92 92 PHE H H 92 8.790 8.507 0.283 1
1 1060 . 14 1 1 A 92 92 PHE HA H 92 5.270 5.058 0.212 1
1 1068 . 14 1 1 A 92 92 PHE C C 92 176.230 175.269 0.961 1
1 1069 . 14 1 1 A 92 92 PHE CA C 92 57.480 57.211 0.269 1
1 1070 . 14 1 1 A 92 92 PHE CB C 92 42.190 42.083 0.107 1
1 1075 . 14 1 1 A 92 92 PHE N N 92 118.770 120.009 -1.239 1
1 1076 . 14 1 1 A 93 93 ILE H H 93 8.800 8.278 0.522 1
1 1077 . 14 1 1 A 93 93 ILE HA H 93 4.310 5.006 -0.696 1
1 1087 . 14 1 1 A 93 93 ILE C C 93 176.380 175.964 0.416 1
1 1088 . 14 1 1 A 93 93 ILE CA C 93 60.480 59.809 0.671 1
1 1089 . 14 1 1 A 93 93 ILE CB C 93 38.010 40.640 -2.630 1
1 1093 . 14 1 1 A 93 93 ILE N N 93 122.300 121.388 0.912 1
1 1094 . 14 1 1 A 94 94 GLY H H 94 8.640 8.429 0.211 1
1 1095 . 14 1 1 A 94 94 GLY HA2 H 94 3.830 4.300 -0.470 1
1 1096 . 14 1 1 A 94 94 GLY HA3 H 94 4.600 4.320 0.280 1
1 1097 . 14 1 1 A 94 94 GLY C C 94 175.080 174.615 0.465 1
1 1098 . 14 1 1 A 94 94 GLY CA C 94 44.530 46.271 -1.741 1
1 1099 . 14 1 1 A 94 94 GLY N N 94 116.550 113.761 2.789 1
1 1100 . 14 1 1 A 95 95 GLY H H 95 8.900 8.797 0.103 1
1 1101 . 14 1 1 A 95 95 GLY HA2 H 95 3.970 3.896 0.074 1
1 1102 . 14 1 1 A 95 95 GLY HA3 H 95 4.370 3.900 0.470 1
1 1103 . 14 1 1 A 95 95 GLY C C 95 174.560 173.930 0.630 1
1 1104 . 14 1 1 A 95 95 GLY CA C 95 45.640 47.174 -1.534 1
1 1105 . 14 1 1 A 95 95 GLY N N 95 112.960 110.483 2.477 1
1 1106 . 14 1 1 A 96 96 THR H H 96 7.830 7.822 0.008 1
1 1107 . 14 1 1 A 96 96 THR HA H 96 4.720 4.839 -0.119 1
1 1112 . 14 1 1 A 96 96 THR C C 96 176.260 174.357 1.903 1
1 1113 . 14 1 1 A 96 96 THR CA C 96 60.360 59.303 1.057 1
1 1114 . 14 1 1 A 96 96 THR CB C 96 70.960 72.031 -1.071 1
1 1116 . 14 1 1 A 96 96 THR N N 96 113.350 110.480 2.870 1
1 1117 . 14 1 1 A 97 97 SER H H 97 8.850 8.906 -0.056 1
1 1118 . 14 1 1 A 97 97 SER HA H 97 4.310 4.620 -0.310 1
1 1121 . 14 1 1 A 97 97 SER C C 97 175.570 174.126 1.444 1
1 1122 . 14 1 1 A 97 97 SER CA C 97 60.850 59.434 1.416 1
1 1123 . 14 1 1 A 97 97 SER CB C 97 63.000 63.402 -0.402 1
1 1124 . 14 1 1 A 97 97 SER N N 97 116.420 116.393 0.027 1
1 1125 . 14 1 1 A 98 98 ASP H H 98 8.360 8.083 0.277 1
1 1126 . 14 1 1 A 98 98 ASP HA H 98 4.310 5.088 -0.778 1
1 1129 . 14 1 1 A 98 98 ASP C C 98 175.380 175.832 -0.452 1
1 1130 . 14 1 1 A 98 98 ASP CA C 98 54.190 55.097 -0.907 1
1 1131 . 14 1 1 A 98 98 ASP CB C 98 40.740 43.653 -2.913 1
1 1132 . 14 1 1 A 98 98 ASP N N 98 116.320 119.565 -3.245 1
1 1133 . 14 1 1 A 99 99 ARG H H 99 7.450 7.878 -0.428 1
1 1134 . 14 1 1 A 99 99 ARG HA H 99 4.350 4.682 -0.332 1
1 1141 . 14 1 1 A 99 99 ARG CA C 99 52.920 53.091 -0.171 1
1 1142 . 14 1 1 A 99 99 ARG CB C 99 30.340 31.259 -0.919 1
1 1145 . 14 1 1 A 99 99 ARG N N 99 119.960 118.373 1.587 1
1 1146 . 14 1 1 A 100 100 PRO HA H 100 4.750 4.600 0.150 1
1 1153 . 14 1 1 A 100 100 PRO C C 100 175.220 177.253 -2.033 1
1 1154 . 14 1 1 A 100 100 PRO CA C 100 62.680 62.739 -0.059 1
1 1155 . 14 1 1 A 100 100 PRO CB C 100 32.820 32.262 0.558 1
1 1158 . 14 1 1 A 101 101 ALA H H 101 7.210 8.451 -1.241 1
1 1159 . 14 1 1 A 101 101 ALA HA H 101 5.030 4.673 0.357 1
1 1163 . 14 1 1 A 101 101 ALA CA C 101 48.570 50.174 -1.604 1
1 1164 . 14 1 1 A 101 101 ALA CB C 101 19.660 17.006 2.654 1
1 1165 . 14 1 1 A 101 101 ALA N N 101 124.490 124.765 -0.275 1
1 1166 . 14 1 1 A 102 102 PRO HA H 102 4.440 4.372 0.068 1
1 1173 . 14 1 1 A 102 102 PRO C C 102 177.200 176.465 0.735 1
1 1174 . 14 1 1 A 102 102 PRO CA C 102 62.190 62.705 -0.515 1
1 1175 . 14 1 1 A 102 102 PRO CB C 102 32.310 32.728 -0.418 1
1 1178 . 14 1 1 A 103 103 ILE H H 103 8.550 8.155 0.395 1
1 1179 . 14 1 1 A 103 103 ILE HA H 103 4.630 4.937 -0.307 1
1 1189 . 14 1 1 A 103 103 ILE C C 103 175.460 175.131 0.329 1
1 1190 . 14 1 1 A 103 103 ILE CA C 103 59.730 58.594 1.136 1
1 1191 . 14 1 1 A 103 103 ILE CB C 103 40.140 42.184 -2.044 1
1 1195 . 14 1 1 A 103 103 ILE N N 103 115.670 116.518 -0.848 1
1 1196 . 14 1 1 A 104 104 SER H H 104 8.730 8.724 0.006 1
1 1197 . 14 1 1 A 104 104 SER HA H 104 4.500 4.559 -0.059 1
1 1200 . 14 1 1 A 104 104 SER C C 104 174.840 175.327 -0.487 1
1 1201 . 14 1 1 A 104 104 SER CA C 104 58.010 58.381 -0.371 1
1 1202 . 14 1 1 A 104 104 SER CB C 104 65.470 63.981 1.489 1
1 1203 . 14 1 1 A 104 104 SER N N 104 119.170 119.973 -0.803 1
1 1204 . 14 1 1 A 105 105 ASP H H 105 8.830 9.038 -0.208 1
1 1205 . 14 1 1 A 105 105 ASP HA H 105 4.200 4.295 -0.095 1
1 1208 . 14 1 1 A 105 105 ASP C C 105 178.520 178.277 0.243 1
1 1209 . 14 1 1 A 105 105 ASP CA C 105 57.870 57.879 -0.009 1
1 1210 . 14 1 1 A 105 105 ASP CB C 105 40.040 40.304 -0.264 1
1 1211 . 14 1 1 A 105 105 ASP N N 105 121.640 125.080 -3.440 1
1 1212 . 14 1 1 A 106 106 LYS H H 106 8.130 7.943 0.187 1
1 1213 . 14 1 1 A 106 106 LYS HA H 106 4.100 3.907 0.193 1
1 1222 . 14 1 1 A 106 106 LYS C C 106 179.400 178.577 0.823 1
1 1223 . 14 1 1 A 106 106 LYS CA C 106 58.980 59.209 -0.229 1
1 1224 . 14 1 1 A 106 106 LYS CB C 106 32.330 32.062 0.268 1
1 1228 . 14 1 1 A 106 106 LYS N N 106 118.300 120.676 -2.376 1
1 1229 . 14 1 1 A 107 107 GLU H H 107 7.670 8.067 -0.397 1
1 1230 . 14 1 1 A 107 107 GLU HA H 107 4.020 4.098 -0.078 1
1 1235 . 14 1 1 A 107 107 GLU C C 107 178.750 179.730 -0.980 1
1 1236 . 14 1 1 A 107 107 GLU CA C 107 59.210 59.071 0.139 1
1 1237 . 14 1 1 A 107 107 GLU CB C 107 29.780 29.733 0.047 1
1 1239 . 14 1 1 A 107 107 GLU N N 107 121.270 119.523 1.747 1
1 1240 . 14 1 1 A 108 108 VAL H H 108 7.790 7.552 0.238 1
1 1241 . 14 1 1 A 108 108 VAL HA H 108 3.050 3.467 -0.417 1
1 1249 . 14 1 1 A 108 108 VAL C C 108 177.550 177.581 -0.031 1
1 1250 . 14 1 1 A 108 108 VAL CA C 108 67.080 66.397 0.683 1
1 1251 . 14 1 1 A 108 108 VAL CB C 108 31.220 31.069 0.151 1
1 1254 . 14 1 1 A 108 108 VAL N N 108 120.940 121.251 -0.311 1
1 1255 . 14 1 1 A 109 109 ASP H H 109 7.840 7.803 0.037 1
1 1256 . 14 1 1 A 109 109 ASP HA H 109 4.110 4.250 -0.140 1
1 1259 . 14 1 1 A 109 109 ASP C C 109 178.190 178.598 -0.408 1
1 1260 . 14 1 1 A 109 109 ASP CA C 109 57.470 57.146 0.324 1
1 1261 . 14 1 1 A 109 109 ASP CB C 109 40.480 39.940 0.540 1
1 1262 . 14 1 1 A 109 109 ASP N N 109 118.780 120.978 -2.198 1
1 1263 . 14 1 1 A 110 110 ALA H H 110 7.520 7.655 -0.135 1
1 1264 . 14 1 1 A 110 110 ALA HA H 110 4.110 4.082 0.028 1
1 1268 . 14 1 1 A 110 110 ALA C C 110 180.550 179.767 0.783 1
1 1269 . 14 1 1 A 110 110 ALA CA C 110 54.880 55.144 -0.264 1
1 1270 . 14 1 1 A 110 110 ALA CB C 110 18.440 18.334 0.106 1
1 1271 . 14 1 1 A 110 110 ALA N N 110 120.640 122.557 -1.917 1
1 1272 . 14 1 1 A 111 111 ILE H H 111 7.840 8.003 -0.163 1
1 1273 . 14 1 1 A 111 111 ILE HA H 111 3.580 3.726 -0.146 1
1 1281 . 14 1 1 A 111 111 ILE C C 111 177.470 178.258 -0.788 1
1 1282 . 14 1 1 A 111 111 ILE CA C 111 64.620 65.006 -0.386 1
1 1283 . 14 1 1 A 111 111 ILE CB C 111 38.600 37.781 0.819 1
1 1286 . 14 1 1 A 111 111 ILE N N 111 119.840 118.715 1.125 1
1 1287 . 14 1 1 A 112 112 MET H H 112 8.100 7.951 0.149 1
1 1288 . 14 1 1 A 112 112 MET HA H 112 4.400 4.136 0.264 1
1 1296 . 14 1 1 A 112 112 MET C C 112 177.710 178.926 -1.216 1
1 1297 . 14 1 1 A 112 112 MET CA C 112 55.300 58.809 -3.509 1
1 1298 . 14 1 1 A 112 112 MET CB C 112 30.510 32.483 -1.973 1
1 1301 . 14 1 1 A 112 112 MET N N 112 115.180 118.580 -3.400 1
1 1302 . 14 1 1 A 113 113 ASN H H 113 8.070 7.984 0.086 1
1 1303 . 14 1 1 A 113 113 ASN HA H 113 4.570 4.503 0.067 1
1 1308 . 14 1 1 A 113 113 ASN C C 113 175.530 178.418 -2.888 1
1 1309 . 14 1 1 A 113 113 ASN CA C 113 54.420 56.033 -1.613 1
1 1310 . 14 1 1 A 113 113 ASN CB C 113 38.350 37.748 0.602 1
1 1311 . 14 1 1 A 113 113 ASN N N 113 117.190 117.269 -0.079 1
1 1313 . 14 1 1 A 114 114 ARG H H 114 8.070 7.930 0.140 1
1 1314 . 14 1 1 A 114 114 ARG HA H 114 4.280 3.973 0.307 1
1 1321 . 14 1 1 A 114 114 ARG C C 114 176.620 178.573 -1.953 1
1 1322 . 14 1 1 A 114 114 ARG CA C 114 56.910 59.124 -2.214 1
1 1323 . 14 1 1 A 114 114 ARG CB C 114 30.370 30.007 0.363 1
1 1326 . 14 1 1 A 114 114 ARG N N 114 118.360 120.179 -1.819 1
1 1327 . 14 1 1 A 115 115 LEU H H 115 8.100 7.697 0.403 1
1 1328 . 14 1 1 A 115 115 LEU HA H 115 4.310 3.784 0.526 1
1 1338 . 14 1 1 A 115 115 LEU C C 115 177.440 178.180 -0.740 1
1 1339 . 14 1 1 A 115 115 LEU CA C 115 55.440 58.008 -2.568 1
1 1340 . 14 1 1 A 115 115 LEU CB C 115 42.250 41.633 0.617 1
1 1344 . 14 1 1 A 115 115 LEU N N 115 120.580 121.555 -0.975 1
1 1345 . 14 1 1 A 116 116 GLN H H 116 8.180 7.781 0.399 1
1 1346 . 14 1 1 A 116 116 GLN HA H 116 4.360 4.113 0.247 1
1 1353 . 14 1 1 A 116 116 GLN C C 116 175.890 176.298 -0.408 1
1 1354 . 14 1 1 A 116 116 GLN CA C 116 55.810 58.778 -2.968 1
1 1355 . 14 1 1 A 116 116 GLN CB C 116 29.500 28.935 0.565 1
1 1357 . 14 1 1 A 116 116 GLN N N 116 119.770 117.295 2.475 1
1 1358 . 14 1 1 A 117 117 GLN H H 117 8.350 7.656 0.694 1
1 1359 . 14 1 1 A 117 117 GLN HA H 117 4.380 4.299 0.081 1
1 1366 . 14 1 1 A 117 117 GLN C C 117 176.130 176.692 -0.562 1
1 1367 . 14 1 1 A 117 117 GLN CA C 117 55.810 55.830 -0.020 1
1 1368 . 14 1 1 A 117 117 GLN CB C 117 29.500 30.058 -0.558 1
1 1370 . 14 1 1 A 117 117 GLN N N 117 121.440 118.903 2.537 1
1 1371 . 14 1 1 A 118 118 VAL H H 118 8.240 8.894 -0.654 1
1 1372 . 14 1 1 A 118 118 VAL HA H 118 4.120 3.834 0.286 1
1 1380 . 14 1 1 A 118 118 VAL C C 118 176.650 176.705 -0.055 1
1 1381 . 14 1 1 A 118 118 VAL CA C 118 62.720 64.469 -1.749 1
1 1382 . 14 1 1 A 118 118 VAL CB C 118 32.730 32.214 0.516 1
1 1385 . 14 1 1 A 118 118 VAL N N 118 121.250 126.163 -4.913 1
1 1386 . 14 1 1 A 119 119 GLY H H 119 8.460 7.832 0.628 1
1 1387 . 14 1 1 A 119 119 GLY HA2 H 119 3.990 3.995 -0.005 1
1 1388 . 14 1 1 A 119 119 GLY HA3 H 119 3.990 4.027 -0.037 1
1 1389 . 14 1 1 A 119 119 GLY C C 119 173.770 174.840 -1.070 1
1 1390 . 14 1 1 A 119 119 GLY CA C 119 45.260 46.482 -1.222 1
1 1391 . 14 1 1 A 119 119 GLY N N 119 112.300 109.586 2.714 1
1 1392 . 14 1 1 A 120 120 ASP H H 120 8.230 8.355 -0.125 1
1 1393 . 14 1 1 A 120 120 ASP HA H 120 4.580 4.296 0.284 1
1 1396 . 14 1 1 A 120 120 ASP C C 120 175.180 176.486 -1.306 1
1 1397 . 14 1 1 A 120 120 ASP CA C 120 54.340 56.900 -2.560 1
1 1398 . 14 1 1 A 120 120 ASP CB C 120 41.390 40.690 0.700 1
1 1399 . 14 1 1 A 120 120 ASP N N 120 120.420 118.440 1.980 1
1 1400 . 14 1 1 A 121 121 LYS H H 121 7.950 7.997 -0.047 1
1 1401 . 14 1 1 A 121 121 LYS HA H 121 4.240 3.931 0.309 1
1 1402 . 14 1 1 A 121 121 LYS CA C 121 53.620 57.100 -3.480 1
1 1403 . 14 1 1 A 121 121 LYS N N 121 119.110 118.785 0.325 1
1 1404 . 14 1 1 A 122 122 PRO HA H 122 4.410 4.506 -0.096 1
1 1405 . 14 1 1 A 122 122 PRO C C 122 176.560 176.503 0.057 1
1 1406 . 14 1 1 A 122 122 PRO CA C 122 63.130 62.828 0.302 1
1 2 . 15 1 1 A 2 2 SER H H 2 7.890 8.495 -0.605 1
1 3 . 15 1 1 A 2 2 SER HA H 2 4.270 4.236 0.034 1
1 4 . 15 1 1 A 2 2 SER C C 2 173.960 175.147 -1.187 1
1 5 . 15 1 1 A 2 2 SER CA C 2 60.800 61.062 -0.262 1
1 6 . 15 1 1 A 2 2 SER N N 2 111.940 115.370 -3.430 1
1 7 . 15 1 1 A 3 3 GLU H H 3 8.010 7.662 0.348 1
1 8 . 15 1 1 A 3 3 GLU HA H 3 4.360 4.388 -0.028 1
1 9 . 15 1 1 A 3 3 GLU C C 3 175.710 176.382 -0.672 1
1 10 . 15 1 1 A 3 3 GLU CA C 3 56.310 55.931 0.379 1
1 11 . 15 1 1 A 3 3 GLU N N 3 121.280 121.802 -0.522 1
1 12 . 15 1 1 A 4 4 ALA H H 4 8.540 8.809 -0.269 1
1 13 . 15 1 1 A 4 4 ALA HA H 4 4.560 4.001 0.559 1
1 14 . 15 1 1 A 4 4 ALA CA C 4 50.630 52.829 -2.199 1
1 15 . 15 1 1 A 4 4 ALA N N 4 127.840 122.394 5.446 1
1 16 . 15 1 1 A 5 5 PRO HA H 5 4.420 4.461 -0.041 1
1 17 . 15 1 1 A 5 5 PRO C C 5 174.240 176.280 -2.040 1
1 18 . 15 1 1 A 5 5 PRO CA C 5 62.840 64.154 -1.314 1
1 19 . 15 1 1 A 6 6 LYS H H 6 8.320 7.878 0.442 1
1 20 . 15 1 1 A 6 6 LYS HA H 6 4.290 4.527 -0.237 1
1 21 . 15 1 1 A 6 6 LYS C C 6 176.100 176.133 -0.033 1
1 22 . 15 1 1 A 6 6 LYS CA C 6 55.540 54.987 0.553 1
1 23 . 15 1 1 A 6 6 LYS N N 6 121.910 119.141 2.769 1
1 24 . 15 1 1 A 7 7 LYS H H 7 8.450 8.566 -0.116 1
1 25 . 15 1 1 A 7 7 LYS HA H 7 3.940 4.424 -0.484 1
1 26 . 15 1 1 A 7 7 LYS C C 7 175.700 176.148 -0.448 1
1 27 . 15 1 1 A 7 7 LYS CA C 7 56.440 56.153 0.287 1
1 28 . 15 1 1 A 7 7 LYS N N 7 122.250 121.787 0.463 1
1 29 . 15 1 1 A 8 8 ARG H H 8 8.210 8.621 -0.411 1
1 30 . 15 1 1 A 8 8 ARG HA H 8 4.670 4.809 -0.139 1
1 31 . 15 1 1 A 8 8 ARG C C 8 173.760 174.698 -0.938 1
1 32 . 15 1 1 A 8 8 ARG CA C 8 53.420 53.814 -0.394 1
1 33 . 15 1 1 A 8 8 ARG N N 8 122.560 122.525 0.035 1
1 34 . 15 1 1 A 9 9 TRP H H 9 8.610 8.653 -0.043 1
1 35 . 15 1 1 A 9 9 TRP HA H 9 4.910 5.217 -0.307 1
1 44 . 15 1 1 A 9 9 TRP C C 9 174.610 175.223 -0.613 1
1 45 . 15 1 1 A 9 9 TRP CA C 9 57.630 55.712 1.918 1
1 46 . 15 1 1 A 9 9 TRP CB C 9 31.020 30.742 0.278 1
1 52 . 15 1 1 A 9 9 TRP N N 9 120.540 121.239 -0.699 1
1 54 . 15 1 1 A 10 10 TYR H H 10 9.260 8.644 0.616 1
1 55 . 15 1 1 A 10 10 TYR HA H 10 4.820 5.253 -0.433 1
1 62 . 15 1 1 A 10 10 TYR C C 10 174.340 174.786 -0.446 1
1 63 . 15 1 1 A 10 10 TYR CA C 10 57.050 56.584 0.466 1
1 64 . 15 1 1 A 10 10 TYR CB C 10 41.920 43.558 -1.638 1
1 69 . 15 1 1 A 10 10 TYR N N 10 118.990 120.723 -1.733 1
1 70 . 15 1 1 A 11 11 VAL H H 11 9.450 8.942 0.508 1
1 71 . 15 1 1 A 11 11 VAL HA H 11 4.470 4.523 -0.053 1
1 79 . 15 1 1 A 11 11 VAL C C 11 175.030 175.289 -0.259 1
1 80 . 15 1 1 A 11 11 VAL CA C 11 62.320 61.681 0.639 1
1 81 . 15 1 1 A 11 11 VAL CB C 11 32.400 33.288 -0.888 1
1 84 . 15 1 1 A 11 11 VAL N N 11 120.930 121.801 -0.871 1
1 85 . 15 1 1 A 12 12 VAL H H 12 9.320 9.354 -0.034 1
1 86 . 15 1 1 A 12 12 VAL HA H 12 3.940 4.006 -0.066 1
1 94 . 15 1 1 A 12 12 VAL C C 12 173.870 173.856 0.014 1
1 95 . 15 1 1 A 12 12 VAL CA C 12 61.330 60.957 0.373 1
1 96 . 15 1 1 A 12 12 VAL CB C 12 33.500 34.328 -0.828 1
1 99 . 15 1 1 A 12 12 VAL N N 12 128.860 127.513 1.347 1
1 100 . 15 1 1 A 13 13 GLN H H 13 8.830 9.355 -0.525 1
1 101 . 15 1 1 A 13 13 GLN HA H 13 4.710 5.174 -0.464 1
1 108 . 15 1 1 A 13 13 GLN C C 13 174.230 175.178 -0.948 1
1 109 . 15 1 1 A 13 13 GLN CA C 13 54.800 55.199 -0.399 1
1 110 . 15 1 1 A 13 13 GLN CB C 13 29.450 29.663 -0.213 1
1 111 . 15 1 1 A 13 13 GLN N N 13 126.050 127.954 -1.904 1
1 113 . 15 1 1 A 14 14 ALA H H 14 9.420 8.320 1.100 1
1 114 . 15 1 1 A 14 14 ALA HA H 14 5.150 4.900 0.250 1
1 118 . 15 1 1 A 14 14 ALA C C 14 176.400 176.265 0.135 1
1 119 . 15 1 1 A 14 14 ALA CA C 14 49.660 50.728 -1.068 1
1 120 . 15 1 1 A 14 14 ALA CB C 14 22.840 23.332 -0.492 1
1 121 . 15 1 1 A 14 14 ALA N N 14 131.620 127.399 4.221 1
1 122 . 15 1 1 A 15 15 PHE H H 15 8.070 8.635 -0.565 1
1 123 . 15 1 1 A 15 15 PHE HA H 15 4.410 4.681 -0.271 1
1 128 . 15 1 1 A 15 15 PHE C C 15 176.130 176.023 0.107 1
1 129 . 15 1 1 A 15 15 PHE CA C 15 58.550 58.938 -0.388 1
1 130 . 15 1 1 A 15 15 PHE CB C 15 39.780 39.602 0.178 1
1 133 . 15 1 1 A 15 15 PHE N N 15 119.680 119.566 0.114 1
1 134 . 15 1 1 A 16 16 SER H H 16 8.370 8.721 -0.351 1
1 135 . 15 1 1 A 16 16 SER HA H 16 4.140 4.161 -0.021 1
1 138 . 15 1 1 A 16 16 SER C C 16 175.820 175.061 0.759 1
1 139 . 15 1 1 A 16 16 SER CA C 16 60.570 59.678 0.892 1
1 140 . 15 1 1 A 16 16 SER CB C 16 63.030 63.024 0.006 1
1 141 . 15 1 1 A 16 16 SER N N 16 119.700 117.430 2.270 1
1 142 . 15 1 1 A 17 17 GLY H H 17 9.130 8.747 0.383 1
1 143 . 15 1 1 A 17 17 GLY HA2 H 17 3.640 3.646 -0.006 1
1 144 . 15 1 1 A 17 17 GLY HA3 H 17 4.200 3.890 0.310 1
1 145 . 15 1 1 A 17 17 GLY C C 17 175.520 175.006 0.514 1
1 146 . 15 1 1 A 17 17 GLY CA C 17 45.260 45.417 -0.157 1
1 147 . 15 1 1 A 17 17 GLY N N 17 115.850 115.019 0.831 1
1 148 . 15 1 1 A 18 18 PHE H H 18 8.480 7.790 0.690 1
1 149 . 15 1 1 A 18 18 PHE HA H 18 4.740 4.623 0.117 1
1 154 . 15 1 1 A 18 18 PHE C C 18 175.430 176.447 -1.017 1
1 155 . 15 1 1 A 18 18 PHE CA C 18 58.240 58.190 0.050 1
1 156 . 15 1 1 A 18 18 PHE CB C 18 39.010 38.619 0.391 1
1 159 . 15 1 1 A 18 18 PHE N N 18 118.550 119.779 -1.229 1
1 160 . 15 1 1 A 19 19 GLU H H 19 10.690 8.523 2.167 1
1 161 . 15 1 1 A 19 19 GLU HA H 19 3.490 4.220 -0.730 1
1 166 . 15 1 1 A 19 19 GLU C C 19 177.650 179.082 -1.432 1
1 167 . 15 1 1 A 19 19 GLU CA C 19 62.280 59.056 3.224 1
1 168 . 15 1 1 A 19 19 GLU CB C 19 28.380 29.433 -1.053 1
1 170 . 15 1 1 A 19 19 GLU N N 19 123.470 119.683 3.787 1
1 171 . 15 1 1 A 20 20 GLY H H 20 8.740 8.358 0.382 1
1 172 . 15 1 1 A 20 20 GLY HA2 H 20 3.840 3.803 0.037 1
1 173 . 15 1 1 A 20 20 GLY HA3 H 20 3.940 3.806 0.134 1
1 174 . 15 1 1 A 20 20 GLY C C 20 176.860 175.733 1.127 1
1 175 . 15 1 1 A 20 20 GLY CA C 20 47.140 47.346 -0.206 1
1 176 . 15 1 1 A 20 20 GLY N N 20 105.480 109.011 -3.531 1
1 177 . 15 1 1 A 21 21 ARG H H 21 7.690 8.315 -0.625 1
1 178 . 15 1 1 A 21 21 ARG HA H 21 4.180 4.105 0.075 1
1 185 . 15 1 1 A 21 21 ARG C C 21 179.490 178.487 1.003 1
1 186 . 15 1 1 A 21 21 ARG CA C 21 58.660 59.068 -0.408 1
1 187 . 15 1 1 A 21 21 ARG CB C 21 30.100 29.767 0.333 1
1 190 . 15 1 1 A 21 21 ARG N N 21 123.120 122.097 1.023 1
1 191 . 15 1 1 A 22 22 VAL H H 22 8.980 9.257 -0.277 1
1 192 . 15 1 1 A 22 22 VAL HA H 22 3.560 3.649 -0.089 1
1 200 . 15 1 1 A 22 22 VAL C C 22 177.320 178.133 -0.813 1
1 201 . 15 1 1 A 22 22 VAL CA C 22 66.960 66.632 0.328 1
1 202 . 15 1 1 A 22 22 VAL CB C 22 31.050 31.654 -0.604 1
1 205 . 15 1 1 A 22 22 VAL N N 22 122.760 120.180 2.580 1
1 206 . 15 1 1 A 23 23 ALA H H 23 8.280 8.032 0.248 1
1 207 . 15 1 1 A 23 23 ALA HA H 23 3.850 4.009 -0.159 1
1 211 . 15 1 1 A 23 23 ALA C C 23 179.340 179.635 -0.295 1
1 212 . 15 1 1 A 23 23 ALA CA C 23 56.260 55.263 0.997 1
1 213 . 15 1 1 A 23 23 ALA CB C 23 18.260 18.068 0.192 1
1 214 . 15 1 1 A 23 23 ALA N N 23 122.120 121.503 0.617 1
1 215 . 15 1 1 A 24 24 THR H H 24 8.020 7.748 0.272 1
1 216 . 15 1 1 A 24 24 THR HA H 24 3.920 3.994 -0.074 1
1 221 . 15 1 1 A 24 24 THR C C 24 176.940 176.612 0.328 1
1 222 . 15 1 1 A 24 24 THR CA C 24 66.820 66.693 0.127 1
1 223 . 15 1 1 A 24 24 THR CB C 24 68.930 68.337 0.593 1
1 225 . 15 1 1 A 24 24 THR N N 24 113.410 115.351 -1.941 1
1 226 . 15 1 1 A 25 25 SER H H 25 8.570 8.117 0.453 1
1 227 . 15 1 1 A 25 25 SER HA H 25 4.400 4.081 0.319 1
1 230 . 15 1 1 A 25 25 SER C C 25 177.610 176.141 1.469 1
1 231 . 15 1 1 A 25 25 SER CA C 25 61.920 62.180 -0.260 1
1 232 . 15 1 1 A 25 25 SER CB C 25 63.540 63.151 0.389 1
1 233 . 15 1 1 A 25 25 SER N N 25 118.260 117.752 0.508 1
1 234 . 15 1 1 A 26 26 LEU H H 26 9.430 8.291 1.139 1
1 235 . 15 1 1 A 26 26 LEU HA H 26 3.900 4.082 -0.182 1
1 245 . 15 1 1 A 26 26 LEU C C 26 177.710 178.736 -1.026 1
1 246 . 15 1 1 A 26 26 LEU CA C 26 58.910 58.144 0.766 1
1 247 . 15 1 1 A 26 26 LEU CB C 26 41.300 41.777 -0.477 1
1 251 . 15 1 1 A 26 26 LEU N N 26 124.120 121.037 3.083 1
1 252 . 15 1 1 A 27 27 ARG H H 27 7.790 7.831 -0.041 1
1 253 . 15 1 1 A 27 27 ARG HA H 27 3.880 3.871 0.009 1
1 260 . 15 1 1 A 27 27 ARG C C 27 179.380 178.752 0.628 1
1 261 . 15 1 1 A 27 27 ARG CA C 27 60.510 59.549 0.961 1
1 262 . 15 1 1 A 27 27 ARG CB C 27 29.670 29.709 -0.039 1
1 265 . 15 1 1 A 27 27 ARG N N 27 116.710 119.139 -2.429 1
1 266 . 15 1 1 A 28 28 GLU H H 28 7.900 8.355 -0.455 1
1 267 . 15 1 1 A 28 28 GLU HA H 28 4.070 3.928 0.142 1
1 272 . 15 1 1 A 28 28 GLU C C 28 179.450 178.723 0.727 1
1 273 . 15 1 1 A 28 28 GLU CA C 28 59.450 59.022 0.428 1
1 274 . 15 1 1 A 28 28 GLU CB C 28 29.610 29.171 0.439 1
1 276 . 15 1 1 A 28 28 GLU N N 28 118.340 118.266 0.074 1
1 277 . 15 1 1 A 29 29 HIS H H 29 8.940 7.945 0.995 1
1 278 . 15 1 1 A 29 29 HIS HA H 29 4.160 4.529 -0.369 1
1 283 . 15 1 1 A 29 29 HIS C C 29 177.750 177.848 -0.098 1
1 284 . 15 1 1 A 29 29 HIS CA C 29 61.260 59.261 1.999 1
1 285 . 15 1 1 A 29 29 HIS CB C 29 29.870 29.850 0.020 1
1 287 . 15 1 1 A 29 29 HIS N N 29 120.440 118.313 2.127 1
1 288 . 15 1 1 A 30 30 ILE H H 30 8.580 8.108 0.472 1
1 289 . 15 1 1 A 30 30 ILE HA H 30 3.160 3.492 -0.332 1
1 299 . 15 1 1 A 30 30 ILE C C 30 177.230 178.215 -0.985 1
1 300 . 15 1 1 A 30 30 ILE CA C 30 66.460 64.268 2.192 1
1 301 . 15 1 1 A 30 30 ILE CB C 30 38.630 37.491 1.139 1
1 305 . 15 1 1 A 30 30 ILE N N 30 121.010 121.179 -0.169 1
1 306 . 15 1 1 A 31 31 LYS H H 31 7.020 8.136 -1.116 1
1 307 . 15 1 1 A 31 31 LYS HA H 31 4.170 4.104 0.066 1
1 316 . 15 1 1 A 31 31 LYS C C 31 180.570 178.951 1.619 1
1 317 . 15 1 1 A 31 31 LYS CA C 31 58.920 59.292 -0.372 1
1 318 . 15 1 1 A 31 31 LYS CB C 31 32.490 32.093 0.397 1
1 322 . 15 1 1 A 31 31 LYS N N 31 117.400 121.119 -3.719 1
1 323 . 15 1 1 A 32 32 LEU H H 32 8.400 7.917 0.483 1
1 324 . 15 1 1 A 32 32 LEU HA H 32 3.990 3.900 0.090 1
1 334 . 15 1 1 A 32 32 LEU C C 32 178.230 178.097 0.133 1
1 335 . 15 1 1 A 32 32 LEU CA C 32 57.700 57.838 -0.138 1
1 336 . 15 1 1 A 32 32 LEU CB C 32 42.540 41.745 0.795 1
1 340 . 15 1 1 A 32 32 LEU N N 32 121.180 119.299 1.881 1
1 341 . 15 1 1 A 33 33 HIS H H 33 7.620 7.771 -0.151 1
1 342 . 15 1 1 A 33 33 HIS HA H 33 4.600 4.645 -0.045 1
1 347 . 15 1 1 A 33 33 HIS C C 33 177.090 174.433 2.657 1
1 348 . 15 1 1 A 33 33 HIS CA C 33 55.840 55.519 0.321 1
1 349 . 15 1 1 A 33 33 HIS CB C 33 29.330 29.954 -0.624 1
1 351 . 15 1 1 A 33 33 HIS N N 33 112.220 115.395 -3.175 1
1 352 . 15 1 1 A 34 34 ASN H H 34 8.030 7.947 0.083 1
1 353 . 15 1 1 A 34 34 ASN HA H 34 4.890 4.364 0.526 1
1 358 . 15 1 1 A 34 34 ASN C C 34 175.910 175.785 0.125 1
1 359 . 15 1 1 A 34 34 ASN CA C 34 54.530 54.057 0.473 1
1 360 . 15 1 1 A 34 34 ASN CB C 34 37.380 37.121 0.259 1
1 361 . 15 1 1 A 34 34 ASN N N 34 117.600 116.802 0.798 1
1 363 . 15 1 1 A 35 35 MET H H 35 8.330 9.025 -0.695 1
1 364 . 15 1 1 A 35 35 MET HA H 35 4.940 4.876 0.064 1
1 372 . 15 1 1 A 35 35 MET C C 35 176.880 176.849 0.031 1
1 373 . 15 1 1 A 35 35 MET CA C 35 55.600 54.798 0.802 1
1 374 . 15 1 1 A 35 35 MET CB C 35 33.790 33.456 0.334 1
1 377 . 15 1 1 A 35 35 MET N N 35 116.190 116.923 -0.733 1
1 378 . 15 1 1 A 36 36 GLU H H 36 9.730 8.196 1.534 1
1 379 . 15 1 1 A 36 36 GLU HA H 36 3.850 4.112 -0.262 1
1 384 . 15 1 1 A 36 36 GLU C C 36 178.290 179.213 -0.923 1
1 385 . 15 1 1 A 36 36 GLU CA C 36 61.280 59.547 1.733 1
1 386 . 15 1 1 A 36 36 GLU CB C 36 29.270 29.380 -0.110 1
1 388 . 15 1 1 A 36 36 GLU N N 36 121.630 120.470 1.160 1
1 389 . 15 1 1 A 37 37 ASP H H 37 8.850 8.053 0.797 1
1 390 . 15 1 1 A 37 37 ASP HA H 37 4.470 4.354 0.116 1
1 393 . 15 1 1 A 37 37 ASP C C 37 177.190 179.142 -1.952 1
1 394 . 15 1 1 A 37 37 ASP CA C 37 56.140 57.319 -1.179 1
1 395 . 15 1 1 A 37 37 ASP CB C 37 40.050 40.789 -0.739 1
1 396 . 15 1 1 A 37 37 ASP N N 37 114.390 119.715 -5.325 1
1 397 . 15 1 1 A 38 38 LEU H H 38 7.880 7.737 0.143 1
1 398 . 15 1 1 A 38 38 LEU HA H 38 4.290 4.096 0.194 1
1 408 . 15 1 1 A 38 38 LEU C C 38 175.090 177.710 -2.620 1
1 409 . 15 1 1 A 38 38 LEU CA C 38 54.670 57.677 -3.007 1
1 410 . 15 1 1 A 38 38 LEU CB C 38 42.940 42.135 0.805 1
1 414 . 15 1 1 A 38 38 LEU N N 38 116.550 119.041 -2.491 1
1 415 . 15 1 1 A 39 39 PHE H H 39 7.500 7.964 -0.464 1
1 416 . 15 1 1 A 39 39 PHE HA H 39 4.970 4.907 0.063 1
1 424 . 15 1 1 A 39 39 PHE C C 39 175.380 175.937 -0.557 1
1 425 . 15 1 1 A 39 39 PHE CA C 39 57.580 58.564 -0.984 1
1 426 . 15 1 1 A 39 39 PHE CB C 39 44.990 39.593 5.397 1
1 432 . 15 1 1 A 39 39 PHE N N 39 115.370 117.170 -1.800 1
1 433 . 15 1 1 A 40 40 GLY H H 40 8.680 8.848 -0.168 1
1 434 . 15 1 1 A 40 40 GLY HA2 H 40 3.370 3.797 -0.427 1
1 435 . 15 1 1 A 40 40 GLY HA3 H 40 4.550 3.955 0.595 1
1 436 . 15 1 1 A 40 40 GLY C C 40 173.090 174.043 -0.953 1
1 437 . 15 1 1 A 40 40 GLY CA C 40 44.180 46.509 -2.329 1
1 438 . 15 1 1 A 40 40 GLY N N 40 110.930 111.232 -0.302 1
1 439 . 15 1 1 A 41 41 GLU H H 41 8.320 7.571 0.749 1
1 440 . 15 1 1 A 41 41 GLU HA H 41 4.280 4.834 -0.554 1
1 445 . 15 1 1 A 41 41 GLU C C 41 173.900 174.224 -0.324 1
1 446 . 15 1 1 A 41 41 GLU CA C 41 56.900 55.806 1.094 1
1 447 . 15 1 1 A 41 41 GLU CB C 41 32.110 33.598 -1.488 1
1 449 . 15 1 1 A 41 41 GLU N N 41 126.730 117.704 9.026 1
1 450 . 15 1 1 A 42 42 VAL H H 42 8.100 8.878 -0.778 1
1 451 . 15 1 1 A 42 42 VAL HA H 42 5.160 4.834 0.326 1
1 459 . 15 1 1 A 42 42 VAL C C 42 176.340 175.191 1.149 1
1 460 . 15 1 1 A 42 42 VAL CA C 42 61.200 61.847 -0.647 1
1 461 . 15 1 1 A 42 42 VAL CB C 42 34.770 33.426 1.344 1
1 464 . 15 1 1 A 42 42 VAL N N 42 119.360 127.214 -7.854 1
1 465 . 15 1 1 A 43 43 MET H H 43 9.870 9.576 0.294 1
1 466 . 15 1 1 A 43 43 MET HA H 43 5.070 5.525 -0.455 1
1 474 . 15 1 1 A 43 43 MET C C 43 173.890 175.062 -1.172 1
1 475 . 15 1 1 A 43 43 MET CA C 43 54.740 54.281 0.459 1
1 476 . 15 1 1 A 43 43 MET CB C 43 37.500 36.579 0.921 1
1 479 . 15 1 1 A 43 43 MET N N 43 125.720 124.731 0.989 1
1 480 . 15 1 1 A 44 44 VAL H H 44 8.800 8.786 0.014 1
1 481 . 15 1 1 A 44 44 VAL HA H 44 4.720 4.644 0.076 1
1 489 . 15 1 1 A 44 44 VAL CA C 44 59.090 59.042 0.048 1
1 490 . 15 1 1 A 44 44 VAL CB C 44 33.710 35.601 -1.891 1
1 493 . 15 1 1 A 44 44 VAL N N 44 122.340 122.402 -0.062 1
1 494 . 15 1 1 A 45 45 PRO HA H 45 4.480 4.417 0.063 1
1 501 . 15 1 1 A 45 45 PRO C C 45 177.080 177.232 -0.152 1
1 502 . 15 1 1 A 45 45 PRO CA C 45 63.240 64.064 -0.824 1
1 503 . 15 1 1 A 45 45 PRO CB C 45 32.170 31.660 0.510 1
1 506 . 15 1 1 A 46 46 THR H H 46 8.200 8.109 0.091 1
1 507 . 15 1 1 A 46 46 THR HA H 46 4.290 4.618 -0.328 1
1 512 . 15 1 1 A 46 46 THR C C 46 174.600 175.412 -0.812 1
1 513 . 15 1 1 A 46 46 THR CA C 46 62.100 61.088 1.012 1
1 514 . 15 1 1 A 46 46 THR CB C 46 69.990 68.805 1.185 1
1 516 . 15 1 1 A 46 46 THR N N 46 113.410 109.552 3.858 1
1 517 . 15 1 1 A 47 47 GLU H H 47 8.380 8.021 0.359 1
1 518 . 15 1 1 A 47 47 GLU HA H 47 4.400 3.973 0.427 1
1 521 . 15 1 1 A 47 47 GLU C C 47 175.970 176.918 -0.948 1
1 522 . 15 1 1 A 47 47 GLU CA C 47 55.200 59.521 -4.321 1
1 523 . 15 1 1 A 47 47 GLU CB C 47 32.300 29.572 2.728 1
1 524 . 15 1 1 A 47 47 GLU N N 47 122.830 121.227 1.603 1
1 525 . 15 1 1 A 48 48 GLU H H 48 8.400 7.703 0.697 1
1 526 . 15 1 1 A 48 48 GLU HA H 48 4.280 4.863 -0.583 1
1 531 . 15 1 1 A 48 48 GLU C C 48 175.750 175.289 0.461 1
1 532 . 15 1 1 A 48 48 GLU CA C 48 55.190 55.838 -0.648 1
1 533 . 15 1 1 A 48 48 GLU CB C 48 31.980 31.500 0.480 1
1 535 . 15 1 1 A 48 48 GLU N N 48 121.950 119.775 2.175 1
1 536 . 15 1 1 A 49 49 VAL H H 49 8.240 8.757 -0.517 1
1 537 . 15 1 1 A 49 49 VAL HA H 49 4.170 4.883 -0.713 1
1 542 . 15 1 1 A 49 49 VAL C C 49 174.610 174.434 0.176 1
1 543 . 15 1 1 A 49 49 VAL CA C 49 62.280 61.175 1.105 1
1 544 . 15 1 1 A 49 49 VAL CB C 49 32.930 34.691 -1.761 1
1 546 . 15 1 1 A 49 49 VAL N N 49 123.990 127.019 -3.029 1
1 547 . 15 1 1 A 50 50 VAL H H 50 8.230 8.901 -0.671 1
1 548 . 15 1 1 A 50 50 VAL HA H 50 4.220 4.952 -0.732 1
1 553 . 15 1 1 A 50 50 VAL C C 50 175.770 172.938 2.832 1
1 554 . 15 1 1 A 50 50 VAL CA C 50 62.170 59.842 2.328 1
1 555 . 15 1 1 A 50 50 VAL CB C 50 33.110 35.889 -2.779 1
1 557 . 15 1 1 A 50 50 VAL N N 50 123.960 126.518 -2.558 1
1 558 . 15 1 1 A 51 51 GLU H H 51 8.570 8.878 -0.308 1
1 559 . 15 1 1 A 51 51 GLU HA H 51 4.380 4.905 -0.525 1
1 564 . 15 1 1 A 51 51 GLU C C 51 175.920 176.690 -0.770 1
1 565 . 15 1 1 A 51 51 GLU CA C 51 56.050 54.517 1.533 1
1 566 . 15 1 1 A 51 51 GLU CB C 51 31.080 33.028 -1.948 1
1 568 . 15 1 1 A 51 51 GLU N N 51 125.070 127.481 -2.411 1
1 569 . 15 1 1 A 52 52 ILE H H 52 8.320 8.719 -0.399 1
1 570 . 15 1 1 A 52 52 ILE HA H 52 4.290 3.922 0.368 1
1 580 . 15 1 1 A 52 52 ILE C C 52 176.330 177.816 -1.486 1
1 581 . 15 1 1 A 52 52 ILE CA C 52 60.940 63.672 -2.732 1
1 582 . 15 1 1 A 52 52 ILE CB C 52 38.510 38.024 0.486 1
1 586 . 15 1 1 A 52 52 ILE N N 52 122.760 127.290 -4.530 1
1 587 . 15 1 1 A 53 53 ARG H H 53 8.500 8.167 0.333 1
1 588 . 15 1 1 A 53 53 ARG HA H 53 4.430 4.062 0.368 1
1 595 . 15 1 1 A 53 53 ARG C C 53 176.950 177.893 -0.943 1
1 596 . 15 1 1 A 53 53 ARG CA C 53 56.150 59.171 -3.021 1
1 597 . 15 1 1 A 53 53 ARG CB C 53 30.200 30.015 0.185 1
1 600 . 15 1 1 A 53 53 ARG N N 53 125.250 121.923 3.327 1
1 601 . 15 1 1 A 54 54 GLY H H 54 8.760 8.119 0.641 1
1 602 . 15 1 1 A 54 54 GLY HA2 H 54 3.920 4.094 -0.174 1
1 603 . 15 1 1 A 54 54 GLY HA3 H 54 4.010 4.094 -0.084 1
1 604 . 15 1 1 A 54 54 GLY C C 54 175.110 173.507 1.603 1
1 605 . 15 1 1 A 54 54 GLY CA C 54 46.030 44.896 1.134 1
1 606 . 15 1 1 A 54 54 GLY N N 54 112.510 108.749 3.761 1
1 607 . 15 1 1 A 55 55 GLY H H 55 8.350 8.599 -0.249 1
1 608 . 15 1 1 A 55 55 GLY HA2 H 55 3.980 3.892 0.088 1
1 609 . 15 1 1 A 55 55 GLY HA3 H 55 3.980 3.892 0.088 1
1 610 . 15 1 1 A 55 55 GLY C C 55 173.920 175.493 -1.573 1
1 611 . 15 1 1 A 55 55 GLY CA C 55 45.200 46.161 -0.961 1
1 612 . 15 1 1 A 55 55 GLY N N 55 107.940 108.806 -0.866 1
1 613 . 15 1 1 A 56 56 GLN H H 56 8.100 8.624 -0.524 1
1 614 . 15 1 1 A 56 56 GLN HA H 56 4.420 3.959 0.461 1
1 619 . 15 1 1 A 56 56 GLN C C 56 175.570 178.230 -2.660 1
1 620 . 15 1 1 A 56 56 GLN CA C 56 55.420 58.929 -3.509 1
1 621 . 15 1 1 A 56 56 GLN CB C 56 30.100 28.238 1.862 1
1 623 . 15 1 1 A 56 56 GLN N N 56 119.350 125.749 -6.399 1
1 624 . 15 1 1 A 57 57 ARG H H 57 8.520 8.003 0.517 1
1 625 . 15 1 1 A 57 57 ARG HA H 57 4.400 4.034 0.366 1
1 632 . 15 1 1 A 57 57 ARG C C 57 176.210 176.653 -0.443 1
1 633 . 15 1 1 A 57 57 ARG CA C 57 56.440 58.919 -2.479 1
1 634 . 15 1 1 A 57 57 ARG CB C 57 30.930 29.769 1.161 1
1 637 . 15 1 1 A 57 57 ARG N N 57 122.610 120.010 2.600 1
1 638 . 15 1 1 A 58 58 ARG H H 58 8.630 7.522 1.108 1
1 639 . 15 1 1 A 58 58 ARG HA H 58 4.430 4.487 -0.057 1
1 646 . 15 1 1 A 58 58 ARG C C 58 175.950 175.387 0.563 1
1 647 . 15 1 1 A 58 58 ARG CA C 58 55.450 56.082 -0.632 1
1 648 . 15 1 1 A 58 58 ARG CB C 58 31.300 31.240 0.060 1
1 651 . 15 1 1 A 58 58 ARG N N 58 123.320 118.779 4.541 1
1 652 . 15 1 1 A 59 59 LYS H H 59 8.560 8.597 -0.037 1
1 653 . 15 1 1 A 59 59 LYS HA H 59 4.410 5.382 -0.972 1
1 662 . 15 1 1 A 59 59 LYS C C 59 176.590 174.625 1.965 1
1 663 . 15 1 1 A 59 59 LYS CA C 59 56.720 55.078 1.642 1
1 664 . 15 1 1 A 59 59 LYS CB C 59 33.150 35.582 -2.432 1
1 668 . 15 1 1 A 59 59 LYS N N 59 123.380 123.320 0.060 1
1 669 . 15 1 1 A 60 60 SER H H 60 8.450 8.573 -0.123 1
1 670 . 15 1 1 A 60 60 SER HA H 60 4.480 4.963 -0.483 1
1 673 . 15 1 1 A 60 60 SER C C 60 174.280 172.627 1.653 1
1 674 . 15 1 1 A 60 60 SER CA C 60 58.140 58.164 -0.024 1
1 675 . 15 1 1 A 60 60 SER CB C 60 64.160 65.437 -1.277 1
1 676 . 15 1 1 A 60 60 SER N N 60 117.320 119.490 -2.170 1
1 677 . 15 1 1 A 61 61 GLU H H 61 8.550 9.167 -0.617 1
1 678 . 15 1 1 A 61 61 GLU HA H 61 4.400 5.209 -0.809 1
1 683 . 15 1 1 A 61 61 GLU C C 61 176.150 175.052 1.098 1
1 684 . 15 1 1 A 61 61 GLU CA C 61 56.300 54.891 1.409 1
1 685 . 15 1 1 A 61 61 GLU CB C 61 30.790 34.018 -3.228 1
1 687 . 15 1 1 A 61 61 GLU N N 61 122.810 127.286 -4.476 1
1 688 . 15 1 1 A 62 62 ARG H H 62 8.310 8.728 -0.418 1
1 689 . 15 1 1 A 62 62 ARG HA H 62 4.340 4.993 -0.653 1
1 692 . 15 1 1 A 62 62 ARG C C 62 176.140 174.290 1.850 1
1 693 . 15 1 1 A 62 62 ARG CA C 62 56.230 54.163 2.067 1
1 694 . 15 1 1 A 62 62 ARG CB C 62 30.780 33.552 -2.772 1
1 695 . 15 1 1 A 62 62 ARG N N 62 122.080 122.526 -0.446 1
1 696 . 15 1 1 A 63 63 LYS H H 63 8.470 8.097 0.373 1
1 697 . 15 1 1 A 63 63 LYS HA H 63 4.300 4.681 -0.381 1
1 700 . 15 1 1 A 63 63 LYS C C 63 175.490 174.916 0.574 1
1 701 . 15 1 1 A 63 63 LYS CA C 63 56.200 54.778 1.422 1
1 702 . 15 1 1 A 63 63 LYS CB C 63 30.730 33.619 -2.889 1
1 703 . 15 1 1 A 63 63 LYS N N 63 123.450 121.355 2.095 1
1 704 . 15 1 1 A 64 64 PHE H H 64 8.200 8.783 -0.583 1
1 705 . 15 1 1 A 64 64 PHE HA H 64 4.450 4.560 -0.110 1
1 710 . 15 1 1 A 64 64 PHE C C 64 174.250 175.016 -0.766 1
1 711 . 15 1 1 A 64 64 PHE CA C 64 57.430 56.283 1.147 1
1 712 . 15 1 1 A 64 64 PHE CB C 64 40.330 42.394 -2.064 1
1 715 . 15 1 1 A 64 64 PHE N N 64 121.740 121.940 -0.200 1
1 716 . 15 1 1 A 65 65 PHE H H 65 8.130 8.136 -0.006 1
1 717 . 15 1 1 A 65 65 PHE HA H 65 4.440 4.376 0.064 1
1 725 . 15 1 1 A 65 65 PHE CA C 65 55.650 56.510 -0.860 1
1 726 . 15 1 1 A 65 65 PHE CB C 65 38.900 39.027 -0.127 1
1 731 . 15 1 1 A 65 65 PHE N N 65 120.910 121.662 -0.752 1
1 732 . 15 1 1 A 66 66 PRO C C 66 176.780 177.460 -0.680 1
1 733 . 15 1 1 A 67 67 GLY H H 67 9.970 8.531 1.439 1
1 734 . 15 1 1 A 67 67 GLY HA2 H 67 3.820 4.035 -0.215 1
1 735 . 15 1 1 A 67 67 GLY HA3 H 67 4.400 4.054 0.346 1
1 736 . 15 1 1 A 67 67 GLY C C 67 173.670 173.858 -0.188 1
1 737 . 15 1 1 A 67 67 GLY CA C 67 45.900 46.100 -0.200 1
1 738 . 15 1 1 A 67 67 GLY N N 67 111.550 111.430 0.120 1
1 739 . 15 1 1 A 68 68 TYR H H 68 7.650 8.170 -0.520 1
1 740 . 15 1 1 A 68 68 TYR HA H 68 5.000 5.039 -0.039 1
1 747 . 15 1 1 A 68 68 TYR C C 68 175.220 174.752 0.468 1
1 748 . 15 1 1 A 68 68 TYR CA C 68 57.940 56.523 1.417 1
1 753 . 15 1 1 A 68 68 TYR N N 68 118.800 118.565 0.235 1
1 754 . 15 1 1 A 69 69 VAL H H 69 9.090 8.841 0.249 1
1 755 . 15 1 1 A 69 69 VAL HA H 69 4.330 4.833 -0.503 1
1 763 . 15 1 1 A 69 69 VAL C C 69 174.250 174.757 -0.507 1
1 764 . 15 1 1 A 69 69 VAL CA C 69 62.120 60.235 1.885 1
1 765 . 15 1 1 A 69 69 VAL CB C 69 35.240 35.895 -0.655 1
1 768 . 15 1 1 A 69 69 VAL N N 69 119.300 123.078 -3.778 1
1 769 . 15 1 1 A 70 70 LEU H H 70 9.190 8.372 0.818 1
1 770 . 15 1 1 A 70 70 LEU HA H 70 5.460 5.304 0.156 1
1 780 . 15 1 1 A 70 70 LEU C C 70 176.130 176.029 0.101 1
1 781 . 15 1 1 A 70 70 LEU CA C 70 54.120 53.411 0.709 1
1 782 . 15 1 1 A 70 70 LEU CB C 70 43.330 43.265 0.065 1
1 786 . 15 1 1 A 70 70 LEU N N 70 126.710 126.764 -0.054 1
1 787 . 15 1 1 A 71 71 VAL H H 71 9.350 9.062 0.288 1
1 788 . 15 1 1 A 71 71 VAL HA H 71 5.040 4.870 0.170 1
1 796 . 15 1 1 A 71 71 VAL C C 71 173.670 175.055 -1.385 1
1 797 . 15 1 1 A 71 71 VAL CA C 71 61.090 61.593 -0.503 1
1 798 . 15 1 1 A 71 71 VAL CB C 71 35.800 35.309 0.491 1
1 801 . 15 1 1 A 71 71 VAL N N 71 121.920 124.856 -2.936 1
1 802 . 15 1 1 A 72 72 GLN H H 72 8.390 8.537 -0.147 1
1 803 . 15 1 1 A 72 72 GLN HA H 72 4.610 4.103 0.507 1
1 810 . 15 1 1 A 72 72 GLN C C 72 175.920 174.588 1.332 1
1 811 . 15 1 1 A 72 72 GLN CA C 72 53.810 55.841 -2.031 1
1 812 . 15 1 1 A 72 72 GLN CB C 72 28.850 28.773 0.077 1
1 814 . 15 1 1 A 72 72 GLN N N 72 130.760 127.716 3.044 1
1 816 . 15 1 1 A 73 73 MET H H 73 9.750 8.689 1.061 1
1 817 . 15 1 1 A 73 73 MET HA H 73 5.060 5.174 -0.114 1
1 825 . 15 1 1 A 73 73 MET C C 73 175.500 174.863 0.637 1
1 826 . 15 1 1 A 73 73 MET CA C 73 55.520 54.576 0.944 1
1 827 . 15 1 1 A 73 73 MET CB C 73 35.350 35.466 -0.116 1
1 830 . 15 1 1 A 73 73 MET N N 73 121.070 124.759 -3.689 1
1 831 . 15 1 1 A 74 74 VAL H H 74 8.530 8.533 -0.003 1
1 832 . 15 1 1 A 74 74 VAL HA H 74 3.970 4.254 -0.284 1
1 840 . 15 1 1 A 74 74 VAL C C 74 174.900 175.414 -0.514 1
1 841 . 15 1 1 A 74 74 VAL CA C 74 62.150 62.445 -0.295 1
1 842 . 15 1 1 A 74 74 VAL CB C 74 32.480 32.234 0.246 1
1 845 . 15 1 1 A 74 74 VAL N N 74 124.120 123.144 0.976 1
1 846 . 15 1 1 A 75 75 MET H H 75 8.600 8.817 -0.217 1
1 847 . 15 1 1 A 75 75 MET HA H 75 4.360 4.482 -0.122 1
1 855 . 15 1 1 A 75 75 MET C C 75 173.480 175.413 -1.933 1
1 856 . 15 1 1 A 75 75 MET CA C 75 53.830 54.571 -0.741 1
1 857 . 15 1 1 A 75 75 MET CB C 75 29.960 32.169 -2.209 1
1 860 . 15 1 1 A 75 75 MET N N 75 128.250 126.699 1.551 1
1 861 . 15 1 1 A 76 76 ASN H H 76 8.410 8.412 -0.002 1
1 862 . 15 1 1 A 76 76 ASN HA H 76 4.540 5.102 -0.562 1
1 867 . 15 1 1 A 76 76 ASN C C 76 173.950 175.301 -1.351 1
1 868 . 15 1 1 A 76 76 ASN CA C 76 51.720 51.425 0.295 1
1 869 . 15 1 1 A 76 76 ASN CB C 76 38.430 41.356 -2.926 1
1 870 . 15 1 1 A 76 76 ASN N N 76 127.500 123.927 3.573 1
1 872 . 15 1 1 A 77 77 ASP H H 77 8.470 9.081 -0.611 1
1 873 . 15 1 1 A 77 77 ASP HA H 77 4.410 4.367 0.043 1
1 876 . 15 1 1 A 77 77 ASP C C 77 178.530 178.314 0.216 1
1 877 . 15 1 1 A 77 77 ASP CA C 77 58.730 56.956 1.774 1
1 878 . 15 1 1 A 77 77 ASP CB C 77 40.940 40.586 0.354 1
1 879 . 15 1 1 A 77 77 ASP N N 77 117.090 120.800 -3.710 1
1 880 . 15 1 1 A 78 78 ALA H H 78 8.160 8.049 0.111 1
1 881 . 15 1 1 A 78 78 ALA HA H 78 4.350 4.139 0.211 1
1 885 . 15 1 1 A 78 78 ALA C C 78 181.250 179.966 1.284 1
1 886 . 15 1 1 A 78 78 ALA CA C 78 55.190 55.376 -0.186 1
1 887 . 15 1 1 A 78 78 ALA CB C 78 18.260 19.222 -0.962 1
1 888 . 15 1 1 A 78 78 ALA N N 78 122.500 123.579 -1.079 1
1 889 . 15 1 1 A 79 79 SER H H 79 9.320 8.532 0.788 1
1 890 . 15 1 1 A 79 79 SER HA H 79 4.290 4.512 -0.222 1
1 893 . 15 1 1 A 79 79 SER C C 79 176.570 176.811 -0.241 1
1 894 . 15 1 1 A 79 79 SER CA C 79 61.080 61.459 -0.379 1
1 895 . 15 1 1 A 79 79 SER CB C 79 62.200 62.289 -0.089 1
1 896 . 15 1 1 A 79 79 SER N N 79 119.280 112.255 7.025 1
1 897 . 15 1 1 A 80 80 TRP H H 80 8.900 7.873 1.027 1
1 898 . 15 1 1 A 80 80 TRP HA H 80 4.020 4.304 -0.284 1
1 907 . 15 1 1 A 80 80 TRP C C 80 178.210 178.001 0.209 1
1 908 . 15 1 1 A 80 80 TRP CA C 80 62.490 61.431 1.059 1
1 909 . 15 1 1 A 80 80 TRP CB C 80 29.800 30.473 -0.673 1
1 915 . 15 1 1 A 80 80 TRP N N 80 125.870 124.197 1.673 1
1 917 . 15 1 1 A 81 81 HIS H H 81 8.190 8.465 -0.275 1
1 918 . 15 1 1 A 81 81 HIS HA H 81 3.930 4.247 -0.317 1
1 923 . 15 1 1 A 81 81 HIS C C 81 177.740 176.414 1.326 1
1 924 . 15 1 1 A 81 81 HIS CA C 81 61.020 59.668 1.352 1
1 925 . 15 1 1 A 81 81 HIS CB C 81 28.910 29.654 -0.744 1
1 927 . 15 1 1 A 81 81 HIS N N 81 114.080 119.856 -5.776 1
1 928 . 15 1 1 A 82 82 LEU H H 82 8.080 8.373 -0.293 1
1 929 . 15 1 1 A 82 82 LEU HA H 82 3.900 3.635 0.265 1
1 939 . 15 1 1 A 82 82 LEU C C 82 180.330 178.493 1.837 1
1 940 . 15 1 1 A 82 82 LEU CA C 82 58.590 58.214 0.376 1
1 941 . 15 1 1 A 82 82 LEU CB C 82 41.350 41.448 -0.098 1
1 945 . 15 1 1 A 82 82 LEU N N 82 121.320 120.319 1.001 1
1 946 . 15 1 1 A 83 83 VAL H H 83 8.000 8.250 -0.250 1
1 947 . 15 1 1 A 83 83 VAL HA H 83 3.210 3.382 -0.172 1
1 955 . 15 1 1 A 83 83 VAL C C 83 177.060 178.180 -1.120 1
1 956 . 15 1 1 A 83 83 VAL CA C 83 67.430 67.143 0.287 1
1 957 . 15 1 1 A 83 83 VAL CB C 83 31.680 31.447 0.233 1
1 960 . 15 1 1 A 83 83 VAL N N 83 118.850 119.499 -0.649 1
1 961 . 15 1 1 A 84 84 ARG H H 84 7.540 7.334 0.206 1
1 962 . 15 1 1 A 84 84 ARG HA H 84 3.590 3.855 -0.265 1
1 969 . 15 1 1 A 84 84 ARG C C 84 177.240 178.448 -1.208 1
1 970 . 15 1 1 A 84 84 ARG CA C 84 56.050 59.601 -3.551 1
1 971 . 15 1 1 A 84 84 ARG CB C 84 28.190 29.589 -1.399 1
1 974 . 15 1 1 A 84 84 ARG N N 84 111.460 120.312 -8.852 1
1 975 . 15 1 1 A 85 85 SER H H 85 7.530 7.724 -0.194 1
1 976 . 15 1 1 A 85 85 SER HA H 85 4.280 4.005 0.275 1
1 979 . 15 1 1 A 85 85 SER C C 85 173.930 175.119 -1.189 1
1 980 . 15 1 1 A 85 85 SER CA C 85 59.220 62.360 -3.140 1
1 981 . 15 1 1 A 85 85 SER CB C 85 63.830 62.749 1.081 1
1 982 . 15 1 1 A 85 85 SER N N 85 113.660 114.637 -0.977 1
1 983 . 15 1 1 A 86 86 VAL H H 86 7.230 6.980 0.250 1
1 984 . 15 1 1 A 86 86 VAL HA H 86 3.480 4.174 -0.694 1
1 992 . 15 1 1 A 86 86 VAL CA C 86 61.300 59.922 1.378 1
1 993 . 15 1 1 A 86 86 VAL CB C 86 31.780 32.334 -0.554 1
1 996 . 15 1 1 A 86 86 VAL N N 86 128.120 120.000 8.120 1
1 997 . 15 1 1 A 87 87 PRO HA H 87 4.140 4.489 -0.349 1
1 1004 . 15 1 1 A 87 87 PRO C C 87 176.400 176.711 -0.311 1
1 1005 . 15 1 1 A 87 87 PRO CA C 87 64.100 62.781 1.319 1
1 1006 . 15 1 1 A 87 87 PRO CB C 87 31.710 32.679 -0.969 1
1 1009 . 15 1 1 A 88 88 ARG H H 88 8.320 8.955 -0.635 1
1 1010 . 15 1 1 A 88 88 ARG HA H 88 3.030 4.301 -1.271 1
1 1017 . 15 1 1 A 88 88 ARG C C 88 174.630 174.987 -0.357 1
1 1018 . 15 1 1 A 88 88 ARG CA C 88 57.620 57.754 -0.134 1
1 1019 . 15 1 1 A 88 88 ARG CB C 88 26.960 28.432 -1.472 1
1 1022 . 15 1 1 A 88 88 ARG N N 88 111.360 116.285 -4.925 1
1 1023 . 15 1 1 A 89 89 VAL H H 89 7.390 7.782 -0.392 1
1 1024 . 15 1 1 A 89 89 VAL HA H 89 3.910 4.309 -0.399 1
1 1032 . 15 1 1 A 89 89 VAL C C 89 177.370 175.347 2.023 1
1 1033 . 15 1 1 A 89 89 VAL CA C 89 64.170 61.325 2.845 1
1 1034 . 15 1 1 A 89 89 VAL CB C 89 32.070 33.845 -1.775 1
1 1037 . 15 1 1 A 89 89 VAL N N 89 117.900 118.282 -0.382 1
1 1038 . 15 1 1 A 90 90 MET H H 90 9.290 8.909 0.381 1
1 1039 . 15 1 1 A 90 90 MET HA H 90 4.340 4.078 0.262 1
1 1047 . 15 1 1 A 90 90 MET C C 90 175.800 175.948 -0.148 1
1 1048 . 15 1 1 A 90 90 MET CA C 90 56.440 56.461 -0.021 1
1 1049 . 15 1 1 A 90 90 MET CB C 90 34.160 33.100 1.060 1
1 1052 . 15 1 1 A 90 90 MET N N 90 128.200 125.980 2.220 1
1 1053 . 15 1 1 A 91 91 GLY H H 91 7.130 6.815 0.315 1
1 1054 . 15 1 1 A 91 91 GLY HA2 H 91 3.340 3.943 -0.603 1
1 1055 . 15 1 1 A 91 91 GLY HA3 H 91 4.410 4.008 0.402 1
1 1056 . 15 1 1 A 91 91 GLY C C 91 170.920 171.871 -0.951 1
1 1057 . 15 1 1 A 91 91 GLY CA C 91 44.440 44.931 -0.491 1
1 1058 . 15 1 1 A 91 91 GLY N N 91 104.320 104.492 -0.172 1
1 1059 . 15 1 1 A 92 92 PHE H H 92 8.790 8.436 0.354 1
1 1060 . 15 1 1 A 92 92 PHE HA H 92 5.270 4.953 0.317 1
1 1068 . 15 1 1 A 92 92 PHE C C 92 176.230 175.280 0.950 1
1 1069 . 15 1 1 A 92 92 PHE CA C 92 57.480 57.567 -0.087 1
1 1070 . 15 1 1 A 92 92 PHE CB C 92 42.190 41.613 0.577 1
1 1075 . 15 1 1 A 92 92 PHE N N 92 118.770 119.555 -0.785 1
1 1076 . 15 1 1 A 93 93 ILE H H 93 8.800 8.461 0.339 1
1 1077 . 15 1 1 A 93 93 ILE HA H 93 4.310 4.892 -0.582 1
1 1087 . 15 1 1 A 93 93 ILE C C 93 176.380 175.744 0.636 1
1 1088 . 15 1 1 A 93 93 ILE CA C 93 60.480 59.851 0.629 1
1 1089 . 15 1 1 A 93 93 ILE CB C 93 38.010 39.708 -1.698 1
1 1093 . 15 1 1 A 93 93 ILE N N 93 122.300 121.187 1.113 1
1 1094 . 15 1 1 A 94 94 GLY H H 94 8.640 8.379 0.261 1
1 1095 . 15 1 1 A 94 94 GLY HA2 H 94 3.830 4.334 -0.504 1
1 1096 . 15 1 1 A 94 94 GLY HA3 H 94 4.600 4.338 0.262 1
1 1097 . 15 1 1 A 94 94 GLY C C 94 175.080 174.338 0.742 1
1 1098 . 15 1 1 A 94 94 GLY CA C 94 44.530 46.235 -1.705 1
1 1099 . 15 1 1 A 94 94 GLY N N 94 116.550 114.231 2.319 1
1 1100 . 15 1 1 A 95 95 GLY H H 95 8.900 8.717 0.183 1
1 1101 . 15 1 1 A 95 95 GLY HA2 H 95 3.970 3.922 0.048 1
1 1102 . 15 1 1 A 95 95 GLY HA3 H 95 4.370 3.931 0.439 1
1 1103 . 15 1 1 A 95 95 GLY C C 95 174.560 173.980 0.580 1
1 1104 . 15 1 1 A 95 95 GLY CA C 95 45.640 46.719 -1.079 1
1 1105 . 15 1 1 A 95 95 GLY N N 95 112.960 110.575 2.385 1
1 1106 . 15 1 1 A 96 96 THR H H 96 7.830 7.713 0.117 1
1 1107 . 15 1 1 A 96 96 THR HA H 96 4.720 4.796 -0.076 1
1 1112 . 15 1 1 A 96 96 THR C C 96 176.260 174.516 1.744 1
1 1113 . 15 1 1 A 96 96 THR CA C 96 60.360 59.397 0.963 1
1 1114 . 15 1 1 A 96 96 THR CB C 96 70.960 72.424 -1.464 1
1 1116 . 15 1 1 A 96 96 THR N N 96 113.350 110.928 2.422 1
1 1117 . 15 1 1 A 97 97 SER H H 97 8.850 8.767 0.083 1
1 1118 . 15 1 1 A 97 97 SER HA H 97 4.310 4.669 -0.359 1
1 1121 . 15 1 1 A 97 97 SER C C 97 175.570 174.649 0.921 1
1 1122 . 15 1 1 A 97 97 SER CA C 97 60.850 58.086 2.764 1
1 1123 . 15 1 1 A 97 97 SER CB C 97 63.000 63.754 -0.754 1
1 1124 . 15 1 1 A 97 97 SER N N 97 116.420 117.122 -0.702 1
1 1125 . 15 1 1 A 98 98 ASP H H 98 8.360 8.135 0.225 1
1 1126 . 15 1 1 A 98 98 ASP HA H 98 4.310 5.204 -0.894 1
1 1129 . 15 1 1 A 98 98 ASP C C 98 175.380 175.509 -0.129 1
1 1130 . 15 1 1 A 98 98 ASP CA C 98 54.190 53.314 0.876 1
1 1131 . 15 1 1 A 98 98 ASP CB C 98 40.740 42.075 -1.335 1
1 1132 . 15 1 1 A 98 98 ASP N N 98 116.320 118.092 -1.772 1
1 1133 . 15 1 1 A 99 99 ARG H H 99 7.450 7.672 -0.222 1
1 1134 . 15 1 1 A 99 99 ARG HA H 99 4.350 4.495 -0.145 1
1 1141 . 15 1 1 A 99 99 ARG CA C 99 52.920 53.062 -0.142 1
1 1142 . 15 1 1 A 99 99 ARG CB C 99 30.340 31.829 -1.489 1
1 1145 . 15 1 1 A 99 99 ARG N N 99 119.960 119.490 0.470 1
1 1146 . 15 1 1 A 100 100 PRO HA H 100 4.750 4.609 0.141 1
1 1153 . 15 1 1 A 100 100 PRO C C 100 175.220 176.997 -1.777 1
1 1154 . 15 1 1 A 100 100 PRO CA C 100 62.680 62.621 0.059 1
1 1155 . 15 1 1 A 100 100 PRO CB C 100 32.820 31.647 1.173 1
1 1158 . 15 1 1 A 101 101 ALA H H 101 7.210 8.349 -1.139 1
1 1159 . 15 1 1 A 101 101 ALA HA H 101 5.030 4.469 0.561 1
1 1163 . 15 1 1 A 101 101 ALA CA C 101 48.570 50.690 -2.120 1
1 1164 . 15 1 1 A 101 101 ALA CB C 101 19.660 17.742 1.918 1
1 1165 . 15 1 1 A 101 101 ALA N N 101 124.490 125.205 -0.715 1
1 1166 . 15 1 1 A 102 102 PRO HA H 102 4.440 4.593 -0.153 1
1 1173 . 15 1 1 A 102 102 PRO C C 102 177.200 176.458 0.742 1
1 1174 . 15 1 1 A 102 102 PRO CA C 102 62.190 62.816 -0.626 1
1 1175 . 15 1 1 A 102 102 PRO CB C 102 32.310 32.771 -0.461 1
1 1178 . 15 1 1 A 103 103 ILE H H 103 8.550 8.191 0.359 1
1 1179 . 15 1 1 A 103 103 ILE HA H 103 4.630 4.920 -0.290 1
1 1189 . 15 1 1 A 103 103 ILE C C 103 175.460 175.171 0.289 1
1 1190 . 15 1 1 A 103 103 ILE CA C 103 59.730 58.496 1.234 1
1 1191 . 15 1 1 A 103 103 ILE CB C 103 40.140 41.960 -1.820 1
1 1195 . 15 1 1 A 103 103 ILE N N 103 115.670 116.524 -0.854 1
1 1196 . 15 1 1 A 104 104 SER H H 104 8.730 8.627 0.103 1
1 1197 . 15 1 1 A 104 104 SER HA H 104 4.500 4.512 -0.012 1
1 1200 . 15 1 1 A 104 104 SER C C 104 174.840 175.336 -0.496 1
1 1201 . 15 1 1 A 104 104 SER CA C 104 58.010 59.027 -1.017 1
1 1202 . 15 1 1 A 104 104 SER CB C 104 65.470 63.496 1.974 1
1 1203 . 15 1 1 A 104 104 SER N N 104 119.170 120.444 -1.274 1
1 1204 . 15 1 1 A 105 105 ASP H H 105 8.830 8.958 -0.128 1
1 1205 . 15 1 1 A 105 105 ASP HA H 105 4.200 4.244 -0.044 1
1 1208 . 15 1 1 A 105 105 ASP C C 105 178.520 178.317 0.203 1
1 1209 . 15 1 1 A 105 105 ASP CA C 105 57.870 58.010 -0.140 1
1 1210 . 15 1 1 A 105 105 ASP CB C 105 40.040 40.279 -0.239 1
1 1211 . 15 1 1 A 105 105 ASP N N 105 121.640 125.376 -3.736 1
1 1212 . 15 1 1 A 106 106 LYS H H 106 8.130 8.010 0.120 1
1 1213 . 15 1 1 A 106 106 LYS HA H 106 4.100 3.924 0.176 1
1 1222 . 15 1 1 A 106 106 LYS C C 106 179.400 178.913 0.487 1
1 1223 . 15 1 1 A 106 106 LYS CA C 106 58.980 59.873 -0.893 1
1 1224 . 15 1 1 A 106 106 LYS CB C 106 32.330 32.341 -0.011 1
1 1228 . 15 1 1 A 106 106 LYS N N 106 118.300 120.662 -2.362 1
1 1229 . 15 1 1 A 107 107 GLU H H 107 7.670 8.066 -0.396 1
1 1230 . 15 1 1 A 107 107 GLU HA H 107 4.020 4.028 -0.008 1
1 1235 . 15 1 1 A 107 107 GLU C C 107 178.750 179.155 -0.405 1
1 1236 . 15 1 1 A 107 107 GLU CA C 107 59.210 59.252 -0.042 1
1 1237 . 15 1 1 A 107 107 GLU CB C 107 29.780 29.380 0.400 1
1 1239 . 15 1 1 A 107 107 GLU N N 107 121.270 119.271 1.999 1
1 1240 . 15 1 1 A 108 108 VAL H H 108 7.790 7.596 0.194 1
1 1241 . 15 1 1 A 108 108 VAL HA H 108 3.050 3.441 -0.391 1
1 1249 . 15 1 1 A 108 108 VAL C C 108 177.550 177.038 0.512 1
1 1250 . 15 1 1 A 108 108 VAL CA C 108 67.080 66.329 0.751 1
1 1251 . 15 1 1 A 108 108 VAL CB C 108 31.220 30.978 0.242 1
1 1254 . 15 1 1 A 108 108 VAL N N 108 120.940 119.316 1.624 1
1 1255 . 15 1 1 A 109 109 ASP H H 109 7.840 7.976 -0.136 1
1 1256 . 15 1 1 A 109 109 ASP HA H 109 4.110 4.190 -0.080 1
1 1259 . 15 1 1 A 109 109 ASP C C 109 178.190 178.701 -0.511 1
1 1260 . 15 1 1 A 109 109 ASP CA C 109 57.470 57.321 0.149 1
1 1261 . 15 1 1 A 109 109 ASP CB C 109 40.480 40.027 0.453 1
1 1262 . 15 1 1 A 109 109 ASP N N 109 118.780 119.467 -0.687 1
1 1263 . 15 1 1 A 110 110 ALA H H 110 7.520 7.526 -0.006 1
1 1264 . 15 1 1 A 110 110 ALA HA H 110 4.110 4.096 0.014 1
1 1268 . 15 1 1 A 110 110 ALA C C 110 180.550 179.859 0.691 1
1 1269 . 15 1 1 A 110 110 ALA CA C 110 54.880 55.111 -0.231 1
1 1270 . 15 1 1 A 110 110 ALA CB C 110 18.440 18.350 0.090 1
1 1271 . 15 1 1 A 110 110 ALA N N 110 120.640 121.990 -1.350 1
1 1272 . 15 1 1 A 111 111 ILE H H 111 7.840 7.922 -0.082 1
1 1273 . 15 1 1 A 111 111 ILE HA H 111 3.580 3.704 -0.124 1
1 1281 . 15 1 1 A 111 111 ILE C C 111 177.470 178.086 -0.616 1
1 1282 . 15 1 1 A 111 111 ILE CA C 111 64.620 64.971 -0.351 1
1 1283 . 15 1 1 A 111 111 ILE CB C 111 38.600 37.769 0.831 1
1 1286 . 15 1 1 A 111 111 ILE N N 111 119.840 118.197 1.643 1
1 1287 . 15 1 1 A 112 112 MET H H 112 8.100 8.016 0.084 1
1 1288 . 15 1 1 A 112 112 MET HA H 112 4.400 4.109 0.291 1
1 1296 . 15 1 1 A 112 112 MET C C 112 177.710 178.811 -1.101 1
1 1297 . 15 1 1 A 112 112 MET CA C 112 55.300 58.814 -3.514 1
1 1298 . 15 1 1 A 112 112 MET CB C 112 30.510 32.464 -1.954 1
1 1301 . 15 1 1 A 112 112 MET N N 112 115.180 118.389 -3.209 1
1 1302 . 15 1 1 A 113 113 ASN H H 113 8.070 8.088 -0.018 1
1 1303 . 15 1 1 A 113 113 ASN HA H 113 4.570 4.457 0.113 1
1 1308 . 15 1 1 A 113 113 ASN C C 113 175.530 178.633 -3.103 1
1 1309 . 15 1 1 A 113 113 ASN CA C 113 54.420 56.108 -1.688 1
1 1310 . 15 1 1 A 113 113 ASN CB C 113 38.350 37.882 0.468 1
1 1311 . 15 1 1 A 113 113 ASN N N 113 117.190 117.320 -0.130 1
1 1313 . 15 1 1 A 114 114 ARG H H 114 8.070 8.021 0.049 1
1 1314 . 15 1 1 A 114 114 ARG HA H 114 4.280 4.029 0.251 1
1 1321 . 15 1 1 A 114 114 ARG C C 114 176.620 178.693 -2.073 1
1 1322 . 15 1 1 A 114 114 ARG CA C 114 56.910 59.187 -2.277 1
1 1323 . 15 1 1 A 114 114 ARG CB C 114 30.370 30.167 0.203 1
1 1326 . 15 1 1 A 114 114 ARG N N 114 118.360 119.743 -1.383 1
1 1327 . 15 1 1 A 115 115 LEU H H 115 8.100 7.794 0.306 1
1 1328 . 15 1 1 A 115 115 LEU HA H 115 4.310 3.121 1.189 1
1 1338 . 15 1 1 A 115 115 LEU C C 115 177.440 178.530 -1.090 1
1 1339 . 15 1 1 A 115 115 LEU CA C 115 55.440 57.438 -1.998 1
1 1340 . 15 1 1 A 115 115 LEU CB C 115 42.250 41.361 0.889 1
1 1344 . 15 1 1 A 115 115 LEU N N 115 120.580 121.350 -0.770 1
1 1345 . 15 1 1 A 116 116 GLN H H 116 8.180 7.970 0.210 1
1 1346 . 15 1 1 A 116 116 GLN HA H 116 4.360 4.047 0.313 1
1 1353 . 15 1 1 A 116 116 GLN C C 116 175.890 176.948 -1.058 1
1 1354 . 15 1 1 A 116 116 GLN CA C 116 55.810 58.624 -2.814 1
1 1355 . 15 1 1 A 116 116 GLN CB C 116 29.500 28.254 1.246 1
1 1357 . 15 1 1 A 116 116 GLN N N 116 119.770 117.887 1.883 1
1 1358 . 15 1 1 A 117 117 GLN H H 117 8.350 8.163 0.187 1
1 1359 . 15 1 1 A 117 117 GLN HA H 117 4.380 4.256 0.124 1
1 1366 . 15 1 1 A 117 117 GLN C C 117 176.130 177.196 -1.066 1
1 1367 . 15 1 1 A 117 117 GLN CA C 117 55.810 56.151 -0.341 1
1 1368 . 15 1 1 A 117 117 GLN CB C 117 29.500 30.648 -1.148 1
1 1370 . 15 1 1 A 117 117 GLN N N 117 121.440 119.572 1.868 1
1 1371 . 15 1 1 A 118 118 VAL H H 118 8.240 8.903 -0.663 1
1 1372 . 15 1 1 A 118 118 VAL HA H 118 4.120 3.700 0.420 1
1 1380 . 15 1 1 A 118 118 VAL C C 118 176.650 176.471 0.179 1
1 1381 . 15 1 1 A 118 118 VAL CA C 118 62.720 65.152 -2.432 1
1 1382 . 15 1 1 A 118 118 VAL CB C 118 32.730 32.012 0.718 1
1 1385 . 15 1 1 A 118 118 VAL N N 118 121.250 124.935 -3.685 1
1 1386 . 15 1 1 A 119 119 GLY H H 119 8.460 7.784 0.676 1
1 1387 . 15 1 1 A 119 119 GLY HA2 H 119 3.990 3.867 0.123 1
1 1388 . 15 1 1 A 119 119 GLY HA3 H 119 3.990 3.957 0.033 1
1 1389 . 15 1 1 A 119 119 GLY C C 119 173.770 174.817 -1.047 1
1 1390 . 15 1 1 A 119 119 GLY CA C 119 45.260 46.057 -0.797 1
1 1391 . 15 1 1 A 119 119 GLY N N 119 112.300 109.328 2.972 1
1 1392 . 15 1 1 A 120 120 ASP H H 120 8.230 8.346 -0.116 1
1 1393 . 15 1 1 A 120 120 ASP HA H 120 4.580 4.261 0.319 1
1 1396 . 15 1 1 A 120 120 ASP C C 120 175.180 177.001 -1.821 1
1 1397 . 15 1 1 A 120 120 ASP CA C 120 54.340 56.393 -2.053 1
1 1398 . 15 1 1 A 120 120 ASP CB C 120 41.390 40.863 0.527 1
1 1399 . 15 1 1 A 120 120 ASP N N 120 120.420 118.405 2.015 1
1 1400 . 15 1 1 A 121 121 LYS H H 121 7.950 7.813 0.137 1
1 1401 . 15 1 1 A 121 121 LYS HA H 121 4.240 4.493 -0.253 1
1 1402 . 15 1 1 A 121 121 LYS CA C 121 53.620 52.603 1.017 1
1 1403 . 15 1 1 A 121 121 LYS N N 121 119.110 117.893 1.217 1
1 1404 . 15 1 1 A 122 122 PRO HA H 122 4.410 4.404 0.006 1
1 1405 . 15 1 1 A 122 122 PRO C C 122 176.560 176.873 -0.313 1
1 1406 . 15 1 1 A 122 122 PRO CA C 122 63.130 63.501 -0.371 1
1 2 . 16 1 1 A 2 2 SER H H 2 7.890 8.374 -0.484 1
1 3 . 16 1 1 A 2 2 SER HA H 2 4.270 4.178 0.092 1
1 4 . 16 1 1 A 2 2 SER C C 2 173.960 177.321 -3.361 1
1 5 . 16 1 1 A 2 2 SER CA C 2 60.800 61.428 -0.628 1
1 6 . 16 1 1 A 2 2 SER N N 2 111.940 114.335 -2.395 1
1 7 . 16 1 1 A 3 3 GLU H H 3 8.010 8.077 -0.067 1
1 8 . 16 1 1 A 3 3 GLU HA H 3 4.360 4.098 0.262 1
1 9 . 16 1 1 A 3 3 GLU C C 3 175.710 178.020 -2.310 1
1 10 . 16 1 1 A 3 3 GLU CA C 3 56.310 58.891 -2.581 1
1 11 . 16 1 1 A 3 3 GLU N N 3 121.280 119.372 1.908 1
1 12 . 16 1 1 A 4 4 ALA H H 4 8.540 7.447 1.093 1
1 13 . 16 1 1 A 4 4 ALA HA H 4 4.560 4.424 0.136 1
1 14 . 16 1 1 A 4 4 ALA CA C 4 50.630 50.853 -0.223 1
1 15 . 16 1 1 A 4 4 ALA N N 4 127.840 123.011 4.829 1
1 16 . 16 1 1 A 5 5 PRO HA H 5 4.420 4.567 -0.147 1
1 17 . 16 1 1 A 5 5 PRO C C 5 174.240 176.464 -2.224 1
1 18 . 16 1 1 A 5 5 PRO CA C 5 62.840 62.588 0.252 1
1 19 . 16 1 1 A 6 6 LYS H H 6 8.320 8.443 -0.123 1
1 20 . 16 1 1 A 6 6 LYS HA H 6 4.290 4.656 -0.366 1
1 21 . 16 1 1 A 6 6 LYS C C 6 176.100 176.331 -0.231 1
1 22 . 16 1 1 A 6 6 LYS CA C 6 55.540 55.687 -0.147 1
1 23 . 16 1 1 A 6 6 LYS N N 6 121.910 121.564 0.346 1
1 24 . 16 1 1 A 7 7 LYS H H 7 8.450 8.529 -0.079 1
1 25 . 16 1 1 A 7 7 LYS HA H 7 3.940 4.677 -0.737 1
1 26 . 16 1 1 A 7 7 LYS C C 7 175.700 175.984 -0.284 1
1 27 . 16 1 1 A 7 7 LYS CA C 7 56.440 55.751 0.689 1
1 28 . 16 1 1 A 7 7 LYS N N 7 122.250 122.385 -0.135 1
1 29 . 16 1 1 A 8 8 ARG H H 8 8.210 8.776 -0.566 1
1 30 . 16 1 1 A 8 8 ARG HA H 8 4.670 4.801 -0.131 1
1 31 . 16 1 1 A 8 8 ARG C C 8 173.760 174.685 -0.925 1
1 32 . 16 1 1 A 8 8 ARG CA C 8 53.420 53.841 -0.421 1
1 33 . 16 1 1 A 8 8 ARG N N 8 122.560 123.492 -0.932 1
1 34 . 16 1 1 A 9 9 TRP H H 9 8.610 8.702 -0.092 1
1 35 . 16 1 1 A 9 9 TRP HA H 9 4.910 5.463 -0.553 1
1 44 . 16 1 1 A 9 9 TRP C C 9 174.610 175.261 -0.651 1
1 45 . 16 1 1 A 9 9 TRP CA C 9 57.630 55.505 2.125 1
1 46 . 16 1 1 A 9 9 TRP CB C 9 31.020 30.806 0.214 1
1 52 . 16 1 1 A 9 9 TRP N N 9 120.540 119.986 0.554 1
1 54 . 16 1 1 A 10 10 TYR H H 10 9.260 9.086 0.174 1
1 55 . 16 1 1 A 10 10 TYR HA H 10 4.820 5.246 -0.426 1
1 62 . 16 1 1 A 10 10 TYR C C 10 174.340 175.634 -1.294 1
1 63 . 16 1 1 A 10 10 TYR CA C 10 57.050 56.709 0.341 1
1 64 . 16 1 1 A 10 10 TYR CB C 10 41.920 41.990 -0.070 1
1 69 . 16 1 1 A 10 10 TYR N N 10 118.990 122.766 -3.776 1
1 70 . 16 1 1 A 11 11 VAL H H 11 9.450 8.988 0.462 1
1 71 . 16 1 1 A 11 11 VAL HA H 11 4.470 5.060 -0.590 1
1 79 . 16 1 1 A 11 11 VAL C C 11 175.030 175.221 -0.191 1
1 80 . 16 1 1 A 11 11 VAL CA C 11 62.320 61.414 0.906 1
1 81 . 16 1 1 A 11 11 VAL CB C 11 32.400 33.584 -1.184 1
1 84 . 16 1 1 A 11 11 VAL N N 11 120.930 121.316 -0.386 1
1 85 . 16 1 1 A 12 12 VAL H H 12 9.320 10.030 -0.710 1
1 86 . 16 1 1 A 12 12 VAL HA H 12 3.940 4.559 -0.619 1
1 94 . 16 1 1 A 12 12 VAL C C 12 173.870 174.104 -0.234 1
1 95 . 16 1 1 A 12 12 VAL CA C 12 61.330 60.855 0.475 1
1 96 . 16 1 1 A 12 12 VAL CB C 12 33.500 34.782 -1.282 1
1 99 . 16 1 1 A 12 12 VAL N N 12 128.860 127.015 1.845 1
1 100 . 16 1 1 A 13 13 GLN H H 13 8.830 8.914 -0.084 1
1 101 . 16 1 1 A 13 13 GLN HA H 13 4.710 5.022 -0.312 1
1 108 . 16 1 1 A 13 13 GLN C C 13 174.230 174.882 -0.652 1
1 109 . 16 1 1 A 13 13 GLN CA C 13 54.800 55.287 -0.487 1
1 110 . 16 1 1 A 13 13 GLN CB C 13 29.450 29.717 -0.267 1
1 111 . 16 1 1 A 13 13 GLN N N 13 126.050 128.071 -2.021 1
1 113 . 16 1 1 A 14 14 ALA H H 14 9.420 8.290 1.130 1
1 114 . 16 1 1 A 14 14 ALA HA H 14 5.150 4.706 0.444 1
1 118 . 16 1 1 A 14 14 ALA C C 14 176.400 176.236 0.164 1
1 119 . 16 1 1 A 14 14 ALA CA C 14 49.660 51.107 -1.447 1
1 120 . 16 1 1 A 14 14 ALA CB C 14 22.840 22.810 0.030 1
1 121 . 16 1 1 A 14 14 ALA N N 14 131.620 127.254 4.366 1
1 122 . 16 1 1 A 15 15 PHE H H 15 8.070 8.595 -0.525 1
1 123 . 16 1 1 A 15 15 PHE HA H 15 4.410 4.680 -0.270 1
1 128 . 16 1 1 A 15 15 PHE C C 15 176.130 176.228 -0.098 1
1 129 . 16 1 1 A 15 15 PHE CA C 15 58.550 58.981 -0.431 1
1 130 . 16 1 1 A 15 15 PHE CB C 15 39.780 39.627 0.153 1
1 133 . 16 1 1 A 15 15 PHE N N 15 119.680 119.814 -0.134 1
1 134 . 16 1 1 A 16 16 SER H H 16 8.370 8.871 -0.501 1
1 135 . 16 1 1 A 16 16 SER HA H 16 4.140 4.250 -0.110 1
1 138 . 16 1 1 A 16 16 SER C C 16 175.820 175.202 0.618 1
1 139 . 16 1 1 A 16 16 SER CA C 16 60.570 59.936 0.634 1
1 140 . 16 1 1 A 16 16 SER CB C 16 63.030 63.124 -0.094 1
1 141 . 16 1 1 A 16 16 SER N N 16 119.700 118.772 0.928 1
1 142 . 16 1 1 A 17 17 GLY H H 17 9.130 8.774 0.356 1
1 143 . 16 1 1 A 17 17 GLY HA2 H 17 3.640 3.645 -0.005 1
1 144 . 16 1 1 A 17 17 GLY HA3 H 17 4.200 3.776 0.424 1
1 145 . 16 1 1 A 17 17 GLY C C 17 175.520 174.870 0.650 1
1 146 . 16 1 1 A 17 17 GLY CA C 17 45.260 45.264 -0.004 1
1 147 . 16 1 1 A 17 17 GLY N N 17 115.850 115.144 0.706 1
1 148 . 16 1 1 A 18 18 PHE H H 18 8.480 7.816 0.664 1
1 149 . 16 1 1 A 18 18 PHE HA H 18 4.740 4.532 0.208 1
1 154 . 16 1 1 A 18 18 PHE C C 18 175.430 176.386 -0.956 1
1 155 . 16 1 1 A 18 18 PHE CA C 18 58.240 58.436 -0.196 1
1 156 . 16 1 1 A 18 18 PHE CB C 18 39.010 38.540 0.470 1
1 159 . 16 1 1 A 18 18 PHE N N 18 118.550 119.858 -1.308 1
1 160 . 16 1 1 A 19 19 GLU H H 19 10.690 8.303 2.387 1
1 161 . 16 1 1 A 19 19 GLU HA H 19 3.490 4.057 -0.567 1
1 166 . 16 1 1 A 19 19 GLU C C 19 177.650 179.156 -1.506 1
1 167 . 16 1 1 A 19 19 GLU CA C 19 62.280 59.662 2.618 1
1 168 . 16 1 1 A 19 19 GLU CB C 19 28.380 29.307 -0.927 1
1 170 . 16 1 1 A 19 19 GLU N N 19 123.470 123.204 0.266 1
1 171 . 16 1 1 A 20 20 GLY H H 20 8.740 8.233 0.507 1
1 172 . 16 1 1 A 20 20 GLY HA2 H 20 3.840 3.704 0.136 1
1 173 . 16 1 1 A 20 20 GLY HA3 H 20 3.940 3.725 0.215 1
1 174 . 16 1 1 A 20 20 GLY C C 20 176.860 175.455 1.405 1
1 175 . 16 1 1 A 20 20 GLY CA C 20 47.140 47.097 0.043 1
1 176 . 16 1 1 A 20 20 GLY N N 20 105.480 107.997 -2.517 1
1 177 . 16 1 1 A 21 21 ARG H H 21 7.690 8.165 -0.475 1
1 178 . 16 1 1 A 21 21 ARG HA H 21 4.180 4.109 0.071 1
1 185 . 16 1 1 A 21 21 ARG C C 21 179.490 178.973 0.517 1
1 186 . 16 1 1 A 21 21 ARG CA C 21 58.660 59.829 -1.169 1
1 187 . 16 1 1 A 21 21 ARG CB C 21 30.100 30.014 0.086 1
1 190 . 16 1 1 A 21 21 ARG N N 21 123.120 122.027 1.093 1
1 191 . 16 1 1 A 22 22 VAL H H 22 8.980 8.420 0.560 1
1 192 . 16 1 1 A 22 22 VAL HA H 22 3.560 3.726 -0.166 1
1 200 . 16 1 1 A 22 22 VAL C C 22 177.320 178.350 -1.030 1
1 201 . 16 1 1 A 22 22 VAL CA C 22 66.960 66.370 0.590 1
1 202 . 16 1 1 A 22 22 VAL CB C 22 31.050 31.585 -0.535 1
1 205 . 16 1 1 A 22 22 VAL N N 22 122.760 120.094 2.666 1
1 206 . 16 1 1 A 23 23 ALA H H 23 8.280 7.910 0.370 1
1 207 . 16 1 1 A 23 23 ALA HA H 23 3.850 4.059 -0.209 1
1 211 . 16 1 1 A 23 23 ALA C C 23 179.340 179.674 -0.334 1
1 212 . 16 1 1 A 23 23 ALA CA C 23 56.260 55.261 0.999 1
1 213 . 16 1 1 A 23 23 ALA CB C 23 18.260 18.069 0.191 1
1 214 . 16 1 1 A 23 23 ALA N N 23 122.120 121.860 0.260 1
1 215 . 16 1 1 A 24 24 THR H H 24 8.020 7.688 0.332 1
1 216 . 16 1 1 A 24 24 THR HA H 24 3.920 3.896 0.024 1
1 221 . 16 1 1 A 24 24 THR C C 24 176.940 176.378 0.562 1
1 222 . 16 1 1 A 24 24 THR CA C 24 66.820 66.655 0.165 1
1 223 . 16 1 1 A 24 24 THR CB C 24 68.930 68.604 0.326 1
1 225 . 16 1 1 A 24 24 THR N N 24 113.410 115.627 -2.217 1
1 226 . 16 1 1 A 25 25 SER H H 25 8.570 8.423 0.147 1
1 227 . 16 1 1 A 25 25 SER HA H 25 4.400 4.037 0.363 1
1 230 . 16 1 1 A 25 25 SER C C 25 177.610 176.297 1.313 1
1 231 . 16 1 1 A 25 25 SER CA C 25 61.920 62.424 -0.504 1
1 232 . 16 1 1 A 25 25 SER CB C 25 63.540 62.752 0.788 1
1 233 . 16 1 1 A 25 25 SER N N 25 118.260 117.783 0.477 1
1 234 . 16 1 1 A 26 26 LEU H H 26 9.430 8.489 0.941 1
1 235 . 16 1 1 A 26 26 LEU HA H 26 3.900 4.191 -0.291 1
1 245 . 16 1 1 A 26 26 LEU C C 26 177.710 178.466 -0.756 1
1 246 . 16 1 1 A 26 26 LEU CA C 26 58.910 58.315 0.595 1
1 247 . 16 1 1 A 26 26 LEU CB C 26 41.300 41.610 -0.310 1
1 251 . 16 1 1 A 26 26 LEU N N 26 124.120 122.690 1.430 1
1 252 . 16 1 1 A 27 27 ARG H H 27 7.790 7.895 -0.105 1
1 253 . 16 1 1 A 27 27 ARG HA H 27 3.880 3.820 0.060 1
1 260 . 16 1 1 A 27 27 ARG C C 27 179.380 178.771 0.609 1
1 261 . 16 1 1 A 27 27 ARG CA C 27 60.510 59.657 0.853 1
1 262 . 16 1 1 A 27 27 ARG CB C 27 29.670 29.781 -0.111 1
1 265 . 16 1 1 A 27 27 ARG N N 27 116.710 119.388 -2.678 1
1 266 . 16 1 1 A 28 28 GLU H H 28 7.900 7.805 0.095 1
1 267 . 16 1 1 A 28 28 GLU HA H 28 4.070 3.877 0.193 1
1 272 . 16 1 1 A 28 28 GLU C C 28 179.450 179.302 0.148 1
1 273 . 16 1 1 A 28 28 GLU CA C 28 59.450 59.344 0.106 1
1 274 . 16 1 1 A 28 28 GLU CB C 28 29.610 29.170 0.440 1
1 276 . 16 1 1 A 28 28 GLU N N 28 118.340 118.020 0.320 1
1 277 . 16 1 1 A 29 29 HIS H H 29 8.940 7.381 1.559 1
1 278 . 16 1 1 A 29 29 HIS HA H 29 4.160 4.581 -0.421 1
1 283 . 16 1 1 A 29 29 HIS C C 29 177.750 178.069 -0.319 1
1 284 . 16 1 1 A 29 29 HIS CA C 29 61.260 59.663 1.597 1
1 285 . 16 1 1 A 29 29 HIS CB C 29 29.870 29.626 0.244 1
1 287 . 16 1 1 A 29 29 HIS N N 29 120.440 118.522 1.918 1
1 288 . 16 1 1 A 30 30 ILE H H 30 8.580 7.774 0.806 1
1 289 . 16 1 1 A 30 30 ILE HA H 30 3.160 3.548 -0.388 1
1 299 . 16 1 1 A 30 30 ILE C C 30 177.230 177.724 -0.494 1
1 300 . 16 1 1 A 30 30 ILE CA C 30 66.460 65.005 1.455 1
1 301 . 16 1 1 A 30 30 ILE CB C 30 38.630 37.467 1.163 1
1 305 . 16 1 1 A 30 30 ILE N N 30 121.010 120.408 0.602 1
1 306 . 16 1 1 A 31 31 LYS H H 31 7.020 7.768 -0.748 1
1 307 . 16 1 1 A 31 31 LYS HA H 31 4.170 4.004 0.166 1
1 316 . 16 1 1 A 31 31 LYS C C 31 180.570 179.284 1.286 1
1 317 . 16 1 1 A 31 31 LYS CA C 31 58.920 59.783 -0.863 1
1 318 . 16 1 1 A 31 31 LYS CB C 31 32.490 32.103 0.387 1
1 322 . 16 1 1 A 31 31 LYS N N 31 117.400 119.418 -2.018 1
1 323 . 16 1 1 A 32 32 LEU H H 32 8.400 8.469 -0.069 1
1 324 . 16 1 1 A 32 32 LEU HA H 32 3.990 3.853 0.137 1
1 334 . 16 1 1 A 32 32 LEU C C 32 178.230 178.369 -0.139 1
1 335 . 16 1 1 A 32 32 LEU CA C 32 57.700 58.000 -0.300 1
1 336 . 16 1 1 A 32 32 LEU CB C 32 42.540 41.857 0.683 1
1 340 . 16 1 1 A 32 32 LEU N N 32 121.180 119.732 1.448 1
1 341 . 16 1 1 A 33 33 HIS H H 33 7.620 7.897 -0.277 1
1 342 . 16 1 1 A 33 33 HIS HA H 33 4.600 4.680 -0.080 1
1 347 . 16 1 1 A 33 33 HIS C C 33 177.090 174.474 2.616 1
1 348 . 16 1 1 A 33 33 HIS CA C 33 55.840 55.492 0.348 1
1 349 . 16 1 1 A 33 33 HIS CB C 33 29.330 30.069 -0.739 1
1 351 . 16 1 1 A 33 33 HIS N N 33 112.220 115.324 -3.104 1
1 352 . 16 1 1 A 34 34 ASN H H 34 8.030 8.125 -0.095 1
1 353 . 16 1 1 A 34 34 ASN HA H 34 4.890 4.375 0.515 1
1 358 . 16 1 1 A 34 34 ASN C C 34 175.910 175.755 0.155 1
1 359 . 16 1 1 A 34 34 ASN CA C 34 54.530 54.080 0.450 1
1 360 . 16 1 1 A 34 34 ASN CB C 34 37.380 37.253 0.127 1
1 361 . 16 1 1 A 34 34 ASN N N 34 117.600 116.979 0.621 1
1 363 . 16 1 1 A 35 35 MET H H 35 8.330 8.702 -0.372 1
1 364 . 16 1 1 A 35 35 MET HA H 35 4.940 4.894 0.046 1
1 372 . 16 1 1 A 35 35 MET C C 35 176.880 176.728 0.152 1
1 373 . 16 1 1 A 35 35 MET CA C 35 55.600 54.681 0.919 1
1 374 . 16 1 1 A 35 35 MET CB C 35 33.790 33.157 0.633 1
1 377 . 16 1 1 A 35 35 MET N N 35 116.190 117.123 -0.933 1
1 378 . 16 1 1 A 36 36 GLU H H 36 9.730 8.249 1.481 1
1 379 . 16 1 1 A 36 36 GLU HA H 36 3.850 4.134 -0.284 1
1 384 . 16 1 1 A 36 36 GLU C C 36 178.290 178.847 -0.557 1
1 385 . 16 1 1 A 36 36 GLU CA C 36 61.280 59.574 1.706 1
1 386 . 16 1 1 A 36 36 GLU CB C 36 29.270 29.174 0.096 1
1 388 . 16 1 1 A 36 36 GLU N N 36 121.630 120.770 0.860 1
1 389 . 16 1 1 A 37 37 ASP H H 37 8.850 8.088 0.762 1
1 390 . 16 1 1 A 37 37 ASP HA H 37 4.470 4.456 0.014 1
1 393 . 16 1 1 A 37 37 ASP C C 37 177.190 179.039 -1.849 1
1 394 . 16 1 1 A 37 37 ASP CA C 37 56.140 57.306 -1.166 1
1 395 . 16 1 1 A 37 37 ASP CB C 37 40.050 40.873 -0.823 1
1 396 . 16 1 1 A 37 37 ASP N N 37 114.390 119.776 -5.386 1
1 397 . 16 1 1 A 38 38 LEU H H 38 7.880 7.659 0.221 1
1 398 . 16 1 1 A 38 38 LEU HA H 38 4.290 3.907 0.383 1
1 408 . 16 1 1 A 38 38 LEU C C 38 175.090 177.579 -2.489 1
1 409 . 16 1 1 A 38 38 LEU CA C 38 54.670 58.047 -3.377 1
1 410 . 16 1 1 A 38 38 LEU CB C 38 42.940 42.133 0.807 1
1 414 . 16 1 1 A 38 38 LEU N N 38 116.550 119.052 -2.502 1
1 415 . 16 1 1 A 39 39 PHE H H 39 7.500 7.820 -0.320 1
1 416 . 16 1 1 A 39 39 PHE HA H 39 4.970 4.455 0.515 1
1 424 . 16 1 1 A 39 39 PHE C C 39 175.380 175.550 -0.170 1
1 425 . 16 1 1 A 39 39 PHE CA C 39 57.580 58.539 -0.959 1
1 426 . 16 1 1 A 39 39 PHE CB C 39 44.990 39.672 5.318 1
1 432 . 16 1 1 A 39 39 PHE N N 39 115.370 116.752 -1.382 1
1 433 . 16 1 1 A 40 40 GLY H H 40 8.680 8.272 0.408 1
1 434 . 16 1 1 A 40 40 GLY HA2 H 40 3.370 4.079 -0.709 1
1 435 . 16 1 1 A 40 40 GLY HA3 H 40 4.550 4.151 0.399 1
1 436 . 16 1 1 A 40 40 GLY C C 40 173.090 173.837 -0.747 1
1 437 . 16 1 1 A 40 40 GLY CA C 40 44.180 46.127 -1.947 1
1 438 . 16 1 1 A 40 40 GLY N N 40 110.930 110.944 -0.014 1
1 439 . 16 1 1 A 41 41 GLU H H 41 8.320 7.820 0.500 1
1 440 . 16 1 1 A 41 41 GLU HA H 41 4.280 4.895 -0.615 1
1 445 . 16 1 1 A 41 41 GLU C C 41 173.900 175.022 -1.122 1
1 446 . 16 1 1 A 41 41 GLU CA C 41 56.900 54.634 2.266 1
1 447 . 16 1 1 A 41 41 GLU CB C 41 32.110 34.447 -2.337 1
1 449 . 16 1 1 A 41 41 GLU N N 41 126.730 117.402 9.328 1
1 450 . 16 1 1 A 42 42 VAL H H 42 8.100 8.791 -0.691 1
1 451 . 16 1 1 A 42 42 VAL HA H 42 5.160 5.133 0.027 1
1 459 . 16 1 1 A 42 42 VAL C C 42 176.340 174.726 1.614 1
1 460 . 16 1 1 A 42 42 VAL CA C 42 61.200 60.814 0.386 1
1 461 . 16 1 1 A 42 42 VAL CB C 42 34.770 35.101 -0.331 1
1 464 . 16 1 1 A 42 42 VAL N N 42 119.360 122.111 -2.751 1
1 465 . 16 1 1 A 43 43 MET H H 43 9.870 9.440 0.430 1
1 466 . 16 1 1 A 43 43 MET HA H 43 5.070 5.392 -0.322 1
1 474 . 16 1 1 A 43 43 MET C C 43 173.890 175.710 -1.820 1
1 475 . 16 1 1 A 43 43 MET CA C 43 54.740 53.797 0.943 1
1 476 . 16 1 1 A 43 43 MET CB C 43 37.500 35.355 2.145 1
1 479 . 16 1 1 A 43 43 MET N N 43 125.720 124.321 1.399 1
1 480 . 16 1 1 A 44 44 VAL H H 44 8.800 8.830 -0.030 1
1 481 . 16 1 1 A 44 44 VAL HA H 44 4.720 4.752 -0.032 1
1 489 . 16 1 1 A 44 44 VAL CA C 44 59.090 59.054 0.036 1
1 490 . 16 1 1 A 44 44 VAL CB C 44 33.710 32.787 0.923 1
1 493 . 16 1 1 A 44 44 VAL N N 44 122.340 124.404 -2.064 1
1 494 . 16 1 1 A 45 45 PRO HA H 45 4.480 4.489 -0.009 1
1 501 . 16 1 1 A 45 45 PRO C C 45 177.080 175.820 1.260 1
1 502 . 16 1 1 A 45 45 PRO CA C 45 63.240 63.948 -0.708 1
1 503 . 16 1 1 A 45 45 PRO CB C 45 32.170 31.556 0.614 1
1 506 . 16 1 1 A 46 46 THR H H 46 8.200 7.566 0.634 1
1 507 . 16 1 1 A 46 46 THR HA H 46 4.290 4.587 -0.297 1
1 512 . 16 1 1 A 46 46 THR C C 46 174.600 173.618 0.982 1
1 513 . 16 1 1 A 46 46 THR CA C 46 62.100 59.980 2.120 1
1 514 . 16 1 1 A 46 46 THR CB C 46 69.990 71.534 -1.544 1
1 516 . 16 1 1 A 46 46 THR N N 46 113.410 111.900 1.510 1
1 517 . 16 1 1 A 47 47 GLU H H 47 8.380 8.596 -0.216 1
1 518 . 16 1 1 A 47 47 GLU HA H 47 4.400 3.682 0.718 1
1 521 . 16 1 1 A 47 47 GLU C C 47 175.970 174.673 1.297 1
1 522 . 16 1 1 A 47 47 GLU CA C 47 55.200 57.100 -1.900 1
1 523 . 16 1 1 A 47 47 GLU CB C 47 32.300 27.973 4.327 1
1 524 . 16 1 1 A 47 47 GLU N N 47 122.830 122.949 -0.119 1
1 525 . 16 1 1 A 48 48 GLU H H 48 8.400 7.895 0.505 1
1 526 . 16 1 1 A 48 48 GLU HA H 48 4.280 4.533 -0.253 1
1 531 . 16 1 1 A 48 48 GLU C C 48 175.750 176.777 -1.027 1
1 532 . 16 1 1 A 48 48 GLU CA C 48 55.190 55.577 -0.387 1
1 533 . 16 1 1 A 48 48 GLU CB C 48 31.980 31.233 0.747 1
1 535 . 16 1 1 A 48 48 GLU N N 48 121.950 119.031 2.919 1
1 536 . 16 1 1 A 49 49 VAL H H 49 8.240 8.517 -0.277 1
1 537 . 16 1 1 A 49 49 VAL HA H 49 4.170 3.655 0.515 1
1 542 . 16 1 1 A 49 49 VAL C C 49 174.610 177.321 -2.711 1
1 543 . 16 1 1 A 49 49 VAL CA C 49 62.280 66.004 -3.724 1
1 544 . 16 1 1 A 49 49 VAL CB C 49 32.930 31.718 1.212 1
1 546 . 16 1 1 A 49 49 VAL N N 49 123.990 125.840 -1.850 1
1 547 . 16 1 1 A 50 50 VAL H H 50 8.230 8.002 0.228 1
1 548 . 16 1 1 A 50 50 VAL HA H 50 4.220 3.573 0.647 1
1 553 . 16 1 1 A 50 50 VAL C C 50 175.770 176.929 -1.159 1
1 554 . 16 1 1 A 50 50 VAL CA C 50 62.170 66.803 -4.633 1
1 555 . 16 1 1 A 50 50 VAL CB C 50 33.110 31.644 1.466 1
1 557 . 16 1 1 A 50 50 VAL N N 50 123.960 119.977 3.983 1
1 558 . 16 1 1 A 51 51 GLU H H 51 8.570 7.791 0.779 1
1 559 . 16 1 1 A 51 51 GLU HA H 51 4.380 4.413 -0.033 1
1 564 . 16 1 1 A 51 51 GLU C C 51 175.920 175.663 0.257 1
1 565 . 16 1 1 A 51 51 GLU CA C 51 56.050 56.518 -0.468 1
1 566 . 16 1 1 A 51 51 GLU CB C 51 31.080 30.858 0.222 1
1 568 . 16 1 1 A 51 51 GLU N N 51 125.070 120.798 4.272 1
1 569 . 16 1 1 A 52 52 ILE H H 52 8.320 8.647 -0.327 1
1 570 . 16 1 1 A 52 52 ILE HA H 52 4.290 4.605 -0.315 1
1 580 . 16 1 1 A 52 52 ILE C C 52 176.330 174.436 1.894 1
1 581 . 16 1 1 A 52 52 ILE CA C 52 60.940 60.827 0.113 1
1 582 . 16 1 1 A 52 52 ILE CB C 52 38.510 39.801 -1.291 1
1 586 . 16 1 1 A 52 52 ILE N N 52 122.760 126.190 -3.430 1
1 587 . 16 1 1 A 53 53 ARG H H 53 8.500 9.083 -0.583 1
1 588 . 16 1 1 A 53 53 ARG HA H 53 4.430 4.710 -0.280 1
1 595 . 16 1 1 A 53 53 ARG C C 53 176.950 175.516 1.434 1
1 596 . 16 1 1 A 53 53 ARG CA C 53 56.150 55.596 0.554 1
1 597 . 16 1 1 A 53 53 ARG CB C 53 30.200 31.330 -1.130 1
1 600 . 16 1 1 A 53 53 ARG N N 53 125.250 129.199 -3.949 1
1 601 . 16 1 1 A 54 54 GLY H H 54 8.760 8.545 0.215 1
1 602 . 16 1 1 A 54 54 GLY HA2 H 54 3.920 4.318 -0.398 1
1 603 . 16 1 1 A 54 54 GLY HA3 H 54 4.010 4.319 -0.309 1
1 604 . 16 1 1 A 54 54 GLY C C 54 175.110 173.633 1.477 1
1 605 . 16 1 1 A 54 54 GLY CA C 54 46.030 45.565 0.465 1
1 606 . 16 1 1 A 54 54 GLY N N 54 112.510 112.085 0.425 1
1 607 . 16 1 1 A 55 55 GLY H H 55 8.350 8.665 -0.315 1
1 608 . 16 1 1 A 55 55 GLY HA2 H 55 3.980 3.879 0.101 1
1 609 . 16 1 1 A 55 55 GLY HA3 H 55 3.980 3.881 0.099 1
1 610 . 16 1 1 A 55 55 GLY C C 55 173.920 174.360 -0.440 1
1 611 . 16 1 1 A 55 55 GLY CA C 55 45.200 46.547 -1.347 1
1 612 . 16 1 1 A 55 55 GLY N N 55 107.940 107.775 0.165 1
1 613 . 16 1 1 A 56 56 GLN H H 56 8.100 7.873 0.227 1
1 614 . 16 1 1 A 56 56 GLN HA H 56 4.420 4.462 -0.042 1
1 619 . 16 1 1 A 56 56 GLN C C 56 175.570 174.940 0.630 1
1 620 . 16 1 1 A 56 56 GLN CA C 56 55.420 55.188 0.232 1
1 621 . 16 1 1 A 56 56 GLN CB C 56 30.100 29.884 0.216 1
1 623 . 16 1 1 A 56 56 GLN N N 56 119.350 120.871 -1.521 1
1 624 . 16 1 1 A 57 57 ARG H H 57 8.520 8.844 -0.324 1
1 625 . 16 1 1 A 57 57 ARG HA H 57 4.400 4.632 -0.232 1
1 632 . 16 1 1 A 57 57 ARG C C 57 176.210 177.188 -0.978 1
1 633 . 16 1 1 A 57 57 ARG CA C 57 56.440 54.347 2.093 1
1 634 . 16 1 1 A 57 57 ARG CB C 57 30.930 32.447 -1.517 1
1 637 . 16 1 1 A 57 57 ARG N N 57 122.610 124.741 -2.131 1
1 638 . 16 1 1 A 58 58 ARG H H 58 8.630 8.846 -0.216 1
1 639 . 16 1 1 A 58 58 ARG HA H 58 4.430 4.031 0.399 1
1 646 . 16 1 1 A 58 58 ARG C C 58 175.950 175.808 0.142 1
1 647 . 16 1 1 A 58 58 ARG CA C 58 55.450 58.839 -3.389 1
1 648 . 16 1 1 A 58 58 ARG CB C 58 31.300 30.098 1.202 1
1 651 . 16 1 1 A 58 58 ARG N N 58 123.320 123.248 0.072 1
1 652 . 16 1 1 A 59 59 LYS H H 59 8.560 7.673 0.887 1
1 653 . 16 1 1 A 59 59 LYS HA H 59 4.410 4.903 -0.493 1
1 662 . 16 1 1 A 59 59 LYS C C 59 176.590 174.413 2.177 1
1 663 . 16 1 1 A 59 59 LYS CA C 59 56.720 55.073 1.647 1
1 664 . 16 1 1 A 59 59 LYS CB C 59 33.150 35.161 -2.011 1
1 668 . 16 1 1 A 59 59 LYS N N 59 123.380 119.132 4.248 1
1 669 . 16 1 1 A 60 60 SER H H 60 8.450 8.895 -0.445 1
1 670 . 16 1 1 A 60 60 SER HA H 60 4.480 4.952 -0.472 1
1 673 . 16 1 1 A 60 60 SER C C 60 174.280 173.097 1.183 1
1 674 . 16 1 1 A 60 60 SER CA C 60 58.140 56.524 1.616 1
1 675 . 16 1 1 A 60 60 SER CB C 60 64.160 65.206 -1.046 1
1 676 . 16 1 1 A 60 60 SER N N 60 117.320 120.466 -3.146 1
1 677 . 16 1 1 A 61 61 GLU H H 61 8.550 8.478 0.072 1
1 678 . 16 1 1 A 61 61 GLU HA H 61 4.400 4.915 -0.515 1
1 683 . 16 1 1 A 61 61 GLU C C 61 176.150 175.628 0.522 1
1 684 . 16 1 1 A 61 61 GLU CA C 61 56.300 55.554 0.746 1
1 685 . 16 1 1 A 61 61 GLU CB C 61 30.790 31.369 -0.579 1
1 687 . 16 1 1 A 61 61 GLU N N 61 122.810 122.897 -0.087 1
1 688 . 16 1 1 A 62 62 ARG H H 62 8.310 8.767 -0.457 1
1 689 . 16 1 1 A 62 62 ARG HA H 62 4.340 5.146 -0.806 1
1 692 . 16 1 1 A 62 62 ARG C C 62 176.140 174.586 1.554 1
1 693 . 16 1 1 A 62 62 ARG CA C 62 56.230 54.329 1.901 1
1 694 . 16 1 1 A 62 62 ARG CB C 62 30.780 34.460 -3.680 1
1 695 . 16 1 1 A 62 62 ARG N N 62 122.080 123.527 -1.447 1
1 696 . 16 1 1 A 63 63 LYS H H 63 8.470 8.304 0.166 1
1 697 . 16 1 1 A 63 63 LYS HA H 63 4.300 5.138 -0.838 1
1 700 . 16 1 1 A 63 63 LYS C C 63 175.490 174.694 0.796 1
1 701 . 16 1 1 A 63 63 LYS CA C 63 56.200 54.725 1.475 1
1 702 . 16 1 1 A 63 63 LYS CB C 63 30.730 35.451 -4.721 1
1 703 . 16 1 1 A 63 63 LYS N N 63 123.450 123.123 0.327 1
1 704 . 16 1 1 A 64 64 PHE H H 64 8.200 9.120 -0.920 1
1 705 . 16 1 1 A 64 64 PHE HA H 64 4.450 4.980 -0.530 1
1 710 . 16 1 1 A 64 64 PHE C C 64 174.250 174.063 0.187 1
1 711 . 16 1 1 A 64 64 PHE CA C 64 57.430 56.518 0.912 1
1 712 . 16 1 1 A 64 64 PHE CB C 64 40.330 43.746 -3.416 1
1 715 . 16 1 1 A 64 64 PHE N N 64 121.740 125.035 -3.295 1
1 716 . 16 1 1 A 65 65 PHE H H 65 8.130 8.591 -0.461 1
1 717 . 16 1 1 A 65 65 PHE HA H 65 4.440 5.087 -0.647 1
1 725 . 16 1 1 A 65 65 PHE CA C 65 55.650 54.465 1.185 1
1 726 . 16 1 1 A 65 65 PHE CB C 65 38.900 38.918 -0.018 1
1 731 . 16 1 1 A 65 65 PHE N N 65 120.910 117.861 3.049 1
1 732 . 16 1 1 A 66 66 PRO C C 66 176.780 177.402 -0.622 1
1 733 . 16 1 1 A 67 67 GLY H H 67 9.970 8.960 1.010 1
1 734 . 16 1 1 A 67 67 GLY HA2 H 67 3.820 3.950 -0.130 1
1 735 . 16 1 1 A 67 67 GLY HA3 H 67 4.400 4.011 0.389 1
1 736 . 16 1 1 A 67 67 GLY C C 67 173.670 173.403 0.267 1
1 737 . 16 1 1 A 67 67 GLY CA C 67 45.900 45.255 0.645 1
1 738 . 16 1 1 A 67 67 GLY N N 67 111.550 111.446 0.104 1
1 739 . 16 1 1 A 68 68 TYR H H 68 7.650 8.187 -0.537 1
1 740 . 16 1 1 A 68 68 TYR HA H 68 5.000 5.091 -0.091 1
1 747 . 16 1 1 A 68 68 TYR C C 68 175.220 174.993 0.227 1
1 748 . 16 1 1 A 68 68 TYR CA C 68 57.940 56.788 1.152 1
1 753 . 16 1 1 A 68 68 TYR N N 68 118.800 119.151 -0.351 1
1 754 . 16 1 1 A 69 69 VAL H H 69 9.090 8.826 0.264 1
1 755 . 16 1 1 A 69 69 VAL HA H 69 4.330 4.853 -0.523 1
1 763 . 16 1 1 A 69 69 VAL C C 69 174.250 174.966 -0.716 1
1 764 . 16 1 1 A 69 69 VAL CA C 69 62.120 60.376 1.744 1
1 765 . 16 1 1 A 69 69 VAL CB C 69 35.240 35.948 -0.708 1
1 768 . 16 1 1 A 69 69 VAL N N 69 119.300 123.088 -3.788 1
1 769 . 16 1 1 A 70 70 LEU H H 70 9.190 8.957 0.233 1
1 770 . 16 1 1 A 70 70 LEU HA H 70 5.460 5.528 -0.068 1
1 780 . 16 1 1 A 70 70 LEU C C 70 176.130 176.238 -0.108 1
1 781 . 16 1 1 A 70 70 LEU CA C 70 54.120 53.406 0.714 1
1 782 . 16 1 1 A 70 70 LEU CB C 70 43.330 43.428 -0.098 1
1 786 . 16 1 1 A 70 70 LEU N N 70 126.710 126.868 -0.158 1
1 787 . 16 1 1 A 71 71 VAL H H 71 9.350 9.592 -0.242 1
1 788 . 16 1 1 A 71 71 VAL HA H 71 5.040 4.904 0.136 1
1 796 . 16 1 1 A 71 71 VAL C C 71 173.670 174.847 -1.177 1
1 797 . 16 1 1 A 71 71 VAL CA C 71 61.090 61.392 -0.302 1
1 798 . 16 1 1 A 71 71 VAL CB C 71 35.800 35.626 0.174 1
1 801 . 16 1 1 A 71 71 VAL N N 71 121.920 124.328 -2.408 1
1 802 . 16 1 1 A 72 72 GLN H H 72 8.390 8.960 -0.570 1
1 803 . 16 1 1 A 72 72 GLN HA H 72 4.610 4.247 0.363 1
1 810 . 16 1 1 A 72 72 GLN C C 72 175.920 174.503 1.417 1
1 811 . 16 1 1 A 72 72 GLN CA C 72 53.810 55.341 -1.531 1
1 812 . 16 1 1 A 72 72 GLN CB C 72 28.850 28.662 0.188 1
1 814 . 16 1 1 A 72 72 GLN N N 72 130.760 127.782 2.978 1
1 816 . 16 1 1 A 73 73 MET H H 73 9.750 8.583 1.167 1
1 817 . 16 1 1 A 73 73 MET HA H 73 5.060 5.212 -0.152 1
1 825 . 16 1 1 A 73 73 MET C C 73 175.500 174.041 1.459 1
1 826 . 16 1 1 A 73 73 MET CA C 73 55.520 54.715 0.805 1
1 827 . 16 1 1 A 73 73 MET CB C 73 35.350 35.597 -0.247 1
1 830 . 16 1 1 A 73 73 MET N N 73 121.070 123.959 -2.889 1
1 831 . 16 1 1 A 74 74 VAL H H 74 8.530 8.229 0.301 1
1 832 . 16 1 1 A 74 74 VAL HA H 74 3.970 4.556 -0.586 1
1 840 . 16 1 1 A 74 74 VAL C C 74 174.900 174.695 0.205 1
1 841 . 16 1 1 A 74 74 VAL CA C 74 62.150 61.744 0.406 1
1 842 . 16 1 1 A 74 74 VAL CB C 74 32.480 33.087 -0.607 1
1 845 . 16 1 1 A 74 74 VAL N N 74 124.120 123.283 0.837 1
1 846 . 16 1 1 A 75 75 MET H H 75 8.600 8.623 -0.023 1
1 847 . 16 1 1 A 75 75 MET HA H 75 4.360 4.720 -0.360 1
1 855 . 16 1 1 A 75 75 MET C C 75 173.480 175.304 -1.824 1
1 856 . 16 1 1 A 75 75 MET CA C 75 53.830 53.958 -0.128 1
1 857 . 16 1 1 A 75 75 MET CB C 75 29.960 32.837 -2.877 1
1 860 . 16 1 1 A 75 75 MET N N 75 128.250 127.139 1.111 1
1 861 . 16 1 1 A 76 76 ASN H H 76 8.410 8.119 0.291 1
1 862 . 16 1 1 A 76 76 ASN HA H 76 4.540 5.019 -0.479 1
1 867 . 16 1 1 A 76 76 ASN C C 76 173.950 175.274 -1.324 1
1 868 . 16 1 1 A 76 76 ASN CA C 76 51.720 51.603 0.117 1
1 869 . 16 1 1 A 76 76 ASN CB C 76 38.430 40.072 -1.642 1
1 870 . 16 1 1 A 76 76 ASN N N 76 127.500 122.596 4.904 1
1 872 . 16 1 1 A 77 77 ASP H H 77 8.470 8.812 -0.342 1
1 873 . 16 1 1 A 77 77 ASP HA H 77 4.410 4.512 -0.102 1
1 876 . 16 1 1 A 77 77 ASP C C 77 178.530 177.290 1.240 1
1 877 . 16 1 1 A 77 77 ASP CA C 77 58.730 56.200 2.530 1
1 878 . 16 1 1 A 77 77 ASP CB C 77 40.940 40.465 0.475 1
1 879 . 16 1 1 A 77 77 ASP N N 77 117.090 118.408 -1.318 1
1 880 . 16 1 1 A 78 78 ALA H H 78 8.160 7.677 0.483 1
1 881 . 16 1 1 A 78 78 ALA HA H 78 4.350 4.480 -0.130 1
1 885 . 16 1 1 A 78 78 ALA C C 78 181.250 179.049 2.201 1
1 886 . 16 1 1 A 78 78 ALA CA C 78 55.190 54.358 0.832 1
1 887 . 16 1 1 A 78 78 ALA CB C 78 18.260 19.896 -1.636 1
1 888 . 16 1 1 A 78 78 ALA N N 78 122.500 122.422 0.078 1
1 889 . 16 1 1 A 79 79 SER H H 79 9.320 8.647 0.673 1
1 890 . 16 1 1 A 79 79 SER HA H 79 4.290 4.096 0.194 1
1 893 . 16 1 1 A 79 79 SER C C 79 176.570 176.521 0.049 1
1 894 . 16 1 1 A 79 79 SER CA C 79 61.080 61.399 -0.319 1
1 895 . 16 1 1 A 79 79 SER CB C 79 62.200 62.203 -0.003 1
1 896 . 16 1 1 A 79 79 SER N N 79 119.280 112.754 6.526 1
1 897 . 16 1 1 A 80 80 TRP H H 80 8.900 7.772 1.128 1
1 898 . 16 1 1 A 80 80 TRP HA H 80 4.020 4.252 -0.232 1
1 907 . 16 1 1 A 80 80 TRP C C 80 178.210 178.083 0.127 1
1 908 . 16 1 1 A 80 80 TRP CA C 80 62.490 61.395 1.095 1
1 909 . 16 1 1 A 80 80 TRP CB C 80 29.800 29.962 -0.162 1
1 915 . 16 1 1 A 80 80 TRP N N 80 125.870 123.687 2.183 1
1 917 . 16 1 1 A 81 81 HIS H H 81 8.190 8.674 -0.484 1
1 918 . 16 1 1 A 81 81 HIS HA H 81 3.930 3.979 -0.049 1
1 923 . 16 1 1 A 81 81 HIS C C 81 177.740 176.789 0.951 1
1 924 . 16 1 1 A 81 81 HIS CA C 81 61.020 58.617 2.403 1
1 925 . 16 1 1 A 81 81 HIS CB C 81 28.910 28.802 0.108 1
1 927 . 16 1 1 A 81 81 HIS N N 81 114.080 117.633 -3.553 1
1 928 . 16 1 1 A 82 82 LEU H H 82 8.080 7.494 0.586 1
1 929 . 16 1 1 A 82 82 LEU HA H 82 3.900 3.834 0.066 1
1 939 . 16 1 1 A 82 82 LEU C C 82 180.330 178.310 2.020 1
1 940 . 16 1 1 A 82 82 LEU CA C 82 58.590 57.956 0.634 1
1 941 . 16 1 1 A 82 82 LEU CB C 82 41.350 41.440 -0.090 1
1 945 . 16 1 1 A 82 82 LEU N N 82 121.320 123.560 -2.240 1
1 946 . 16 1 1 A 83 83 VAL H H 83 8.000 8.243 -0.243 1
1 947 . 16 1 1 A 83 83 VAL HA H 83 3.210 3.469 -0.259 1
1 955 . 16 1 1 A 83 83 VAL C C 83 177.060 178.247 -1.187 1
1 956 . 16 1 1 A 83 83 VAL CA C 83 67.430 66.420 1.010 1
1 957 . 16 1 1 A 83 83 VAL CB C 83 31.680 31.244 0.436 1
1 960 . 16 1 1 A 83 83 VAL N N 83 118.850 118.911 -0.061 1
1 961 . 16 1 1 A 84 84 ARG H H 84 7.540 7.400 0.140 1
1 962 . 16 1 1 A 84 84 ARG HA H 84 3.590 3.736 -0.146 1
1 969 . 16 1 1 A 84 84 ARG C C 84 177.240 178.765 -1.525 1
1 970 . 16 1 1 A 84 84 ARG CA C 84 56.050 59.619 -3.569 1
1 971 . 16 1 1 A 84 84 ARG CB C 84 28.190 29.513 -1.323 1
1 974 . 16 1 1 A 84 84 ARG N N 84 111.460 120.603 -9.143 1
1 975 . 16 1 1 A 85 85 SER H H 85 7.530 7.497 0.033 1
1 976 . 16 1 1 A 85 85 SER HA H 85 4.280 4.079 0.201 1
1 979 . 16 1 1 A 85 85 SER C C 85 173.930 175.207 -1.277 1
1 980 . 16 1 1 A 85 85 SER CA C 85 59.220 62.208 -2.988 1
1 981 . 16 1 1 A 85 85 SER CB C 85 63.830 62.633 1.197 1
1 982 . 16 1 1 A 85 85 SER N N 85 113.660 114.860 -1.200 1
1 983 . 16 1 1 A 86 86 VAL H H 86 7.230 7.114 0.116 1
1 984 . 16 1 1 A 86 86 VAL HA H 86 3.480 4.156 -0.676 1
1 992 . 16 1 1 A 86 86 VAL CA C 86 61.300 61.307 -0.007 1
1 993 . 16 1 1 A 86 86 VAL CB C 86 31.780 32.221 -0.441 1
1 996 . 16 1 1 A 86 86 VAL N N 86 128.120 122.114 6.006 1
1 997 . 16 1 1 A 87 87 PRO HA H 87 4.140 4.392 -0.252 1
1 1004 . 16 1 1 A 87 87 PRO C C 87 176.400 176.781 -0.381 1
1 1005 . 16 1 1 A 87 87 PRO CA C 87 64.100 63.359 0.741 1
1 1006 . 16 1 1 A 87 87 PRO CB C 87 31.710 32.328 -0.618 1
1 1009 . 16 1 1 A 88 88 ARG H H 88 8.320 8.775 -0.455 1
1 1010 . 16 1 1 A 88 88 ARG HA H 88 3.030 3.951 -0.921 1
1 1017 . 16 1 1 A 88 88 ARG C C 88 174.630 174.476 0.154 1
1 1018 . 16 1 1 A 88 88 ARG CA C 88 57.620 57.436 0.184 1
1 1019 . 16 1 1 A 88 88 ARG CB C 88 26.960 27.828 -0.868 1
1 1022 . 16 1 1 A 88 88 ARG N N 88 111.360 116.106 -4.746 1
1 1023 . 16 1 1 A 89 89 VAL H H 89 7.390 7.875 -0.485 1
1 1024 . 16 1 1 A 89 89 VAL HA H 89 3.910 4.392 -0.482 1
1 1032 . 16 1 1 A 89 89 VAL C C 89 177.370 175.642 1.728 1
1 1033 . 16 1 1 A 89 89 VAL CA C 89 64.170 59.629 4.541 1
1 1034 . 16 1 1 A 89 89 VAL CB C 89 32.070 34.143 -2.073 1
1 1037 . 16 1 1 A 89 89 VAL N N 89 117.900 118.663 -0.763 1
1 1038 . 16 1 1 A 90 90 MET H H 90 9.290 8.527 0.763 1
1 1039 . 16 1 1 A 90 90 MET HA H 90 4.340 4.023 0.317 1
1 1047 . 16 1 1 A 90 90 MET C C 90 175.800 176.109 -0.309 1
1 1048 . 16 1 1 A 90 90 MET CA C 90 56.440 57.104 -0.664 1
1 1049 . 16 1 1 A 90 90 MET CB C 90 34.160 32.944 1.216 1
1 1052 . 16 1 1 A 90 90 MET N N 90 128.200 127.876 0.324 1
1 1053 . 16 1 1 A 91 91 GLY H H 91 7.130 7.159 -0.029 1
1 1054 . 16 1 1 A 91 91 GLY HA2 H 91 3.340 3.697 -0.357 1
1 1055 . 16 1 1 A 91 91 GLY HA3 H 91 4.410 3.932 0.478 1
1 1056 . 16 1 1 A 91 91 GLY C C 91 170.920 171.362 -0.442 1
1 1057 . 16 1 1 A 91 91 GLY CA C 91 44.440 45.856 -1.416 1
1 1058 . 16 1 1 A 91 91 GLY N N 91 104.320 103.028 1.292 1
1 1059 . 16 1 1 A 92 92 PHE H H 92 8.790 8.510 0.280 1
1 1060 . 16 1 1 A 92 92 PHE HA H 92 5.270 4.960 0.310 1
1 1068 . 16 1 1 A 92 92 PHE C C 92 176.230 175.458 0.772 1
1 1069 . 16 1 1 A 92 92 PHE CA C 92 57.480 57.757 -0.277 1
1 1070 . 16 1 1 A 92 92 PHE CB C 92 42.190 41.585 0.605 1
1 1075 . 16 1 1 A 92 92 PHE N N 92 118.770 119.921 -1.151 1
1 1076 . 16 1 1 A 93 93 ILE H H 93 8.800 8.105 0.695 1
1 1077 . 16 1 1 A 93 93 ILE HA H 93 4.310 4.681 -0.371 1
1 1087 . 16 1 1 A 93 93 ILE C C 93 176.380 176.711 -0.331 1
1 1088 . 16 1 1 A 93 93 ILE CA C 93 60.480 60.531 -0.051 1
1 1089 . 16 1 1 A 93 93 ILE CB C 93 38.010 40.133 -2.123 1
1 1093 . 16 1 1 A 93 93 ILE N N 93 122.300 121.033 1.267 1
1 1094 . 16 1 1 A 94 94 GLY H H 94 8.640 8.565 0.075 1
1 1095 . 16 1 1 A 94 94 GLY HA2 H 94 3.830 3.924 -0.094 1
1 1096 . 16 1 1 A 94 94 GLY HA3 H 94 4.600 3.932 0.668 1
1 1097 . 16 1 1 A 94 94 GLY C C 94 175.080 175.845 -0.765 1
1 1098 . 16 1 1 A 94 94 GLY CA C 94 44.530 47.233 -2.703 1
1 1099 . 16 1 1 A 94 94 GLY N N 94 116.550 112.979 3.571 1
1 1100 . 16 1 1 A 95 95 GLY H H 95 8.900 8.889 0.011 1
1 1101 . 16 1 1 A 95 95 GLY HA2 H 95 3.970 3.882 0.088 1
1 1102 . 16 1 1 A 95 95 GLY HA3 H 95 4.370 3.885 0.485 1
1 1103 . 16 1 1 A 95 95 GLY C C 95 174.560 174.522 0.038 1
1 1104 . 16 1 1 A 95 95 GLY CA C 95 45.640 47.289 -1.649 1
1 1105 . 16 1 1 A 95 95 GLY N N 95 112.960 114.294 -1.334 1
1 1106 . 16 1 1 A 96 96 THR H H 96 7.830 8.275 -0.445 1
1 1107 . 16 1 1 A 96 96 THR HA H 96 4.720 4.490 0.230 1
1 1112 . 16 1 1 A 96 96 THR C C 96 176.260 174.462 1.798 1
1 1113 . 16 1 1 A 96 96 THR CA C 96 60.360 63.803 -3.443 1
1 1114 . 16 1 1 A 96 96 THR CB C 96 70.960 69.073 1.887 1
1 1116 . 16 1 1 A 96 96 THR N N 96 113.350 114.072 -0.722 1
1 1117 . 16 1 1 A 97 97 SER H H 97 8.850 8.977 -0.127 1
1 1118 . 16 1 1 A 97 97 SER HA H 97 4.310 4.190 0.120 1
1 1121 . 16 1 1 A 97 97 SER C C 97 175.570 173.135 2.435 1
1 1122 . 16 1 1 A 97 97 SER CA C 97 60.850 59.350 1.500 1
1 1123 . 16 1 1 A 97 97 SER CB C 97 63.000 62.045 0.955 1
1 1124 . 16 1 1 A 97 97 SER N N 97 116.420 118.387 -1.967 1
1 1125 . 16 1 1 A 98 98 ASP H H 98 8.360 8.836 -0.476 1
1 1126 . 16 1 1 A 98 98 ASP HA H 98 4.310 4.952 -0.642 1
1 1129 . 16 1 1 A 98 98 ASP C C 98 175.380 174.592 0.788 1
1 1130 . 16 1 1 A 98 98 ASP CA C 98 54.190 55.875 -1.685 1
1 1131 . 16 1 1 A 98 98 ASP CB C 98 40.740 39.142 1.598 1
1 1132 . 16 1 1 A 98 98 ASP N N 98 116.320 112.863 3.457 1
1 1133 . 16 1 1 A 99 99 ARG H H 99 7.450 7.861 -0.411 1
1 1134 . 16 1 1 A 99 99 ARG HA H 99 4.350 4.590 -0.240 1
1 1141 . 16 1 1 A 99 99 ARG CA C 99 52.920 53.499 -0.579 1
1 1142 . 16 1 1 A 99 99 ARG CB C 99 30.340 30.800 -0.460 1
1 1145 . 16 1 1 A 99 99 ARG N N 99 119.960 117.886 2.074 1
1 1146 . 16 1 1 A 100 100 PRO HA H 100 4.750 4.672 0.078 1
1 1153 . 16 1 1 A 100 100 PRO C C 100 175.220 176.416 -1.196 1
1 1154 . 16 1 1 A 100 100 PRO CA C 100 62.680 62.531 0.149 1
1 1155 . 16 1 1 A 100 100 PRO CB C 100 32.820 32.225 0.595 1
1 1158 . 16 1 1 A 101 101 ALA H H 101 7.210 7.968 -0.758 1
1 1159 . 16 1 1 A 101 101 ALA HA H 101 5.030 4.911 0.119 1
1 1163 . 16 1 1 A 101 101 ALA CA C 101 48.570 50.267 -1.697 1
1 1164 . 16 1 1 A 101 101 ALA CB C 101 19.660 19.846 -0.186 1
1 1165 . 16 1 1 A 101 101 ALA N N 101 124.490 124.535 -0.045 1
1 1166 . 16 1 1 A 102 102 PRO HA H 102 4.440 4.203 0.237 1
1 1173 . 16 1 1 A 102 102 PRO C C 102 177.200 176.402 0.798 1
1 1174 . 16 1 1 A 102 102 PRO CA C 102 62.190 62.509 -0.319 1
1 1175 . 16 1 1 A 102 102 PRO CB C 102 32.310 32.895 -0.585 1
1 1178 . 16 1 1 A 103 103 ILE H H 103 8.550 7.784 0.766 1
1 1179 . 16 1 1 A 103 103 ILE HA H 103 4.630 4.928 -0.298 1
1 1189 . 16 1 1 A 103 103 ILE C C 103 175.460 175.247 0.213 1
1 1190 . 16 1 1 A 103 103 ILE CA C 103 59.730 58.482 1.248 1
1 1191 . 16 1 1 A 103 103 ILE CB C 103 40.140 42.064 -1.924 1
1 1195 . 16 1 1 A 103 103 ILE N N 103 115.670 116.371 -0.701 1
1 1196 . 16 1 1 A 104 104 SER H H 104 8.730 8.678 0.052 1
1 1197 . 16 1 1 A 104 104 SER HA H 104 4.500 4.518 -0.018 1
1 1200 . 16 1 1 A 104 104 SER C C 104 174.840 175.291 -0.451 1
1 1201 . 16 1 1 A 104 104 SER CA C 104 58.010 58.407 -0.397 1
1 1202 . 16 1 1 A 104 104 SER CB C 104 65.470 63.768 1.702 1
1 1203 . 16 1 1 A 104 104 SER N N 104 119.170 120.053 -0.883 1
1 1204 . 16 1 1 A 105 105 ASP H H 105 8.830 9.008 -0.178 1
1 1205 . 16 1 1 A 105 105 ASP HA H 105 4.200 4.285 -0.085 1
1 1208 . 16 1 1 A 105 105 ASP C C 105 178.520 178.388 0.132 1
1 1209 . 16 1 1 A 105 105 ASP CA C 105 57.870 58.101 -0.231 1
1 1210 . 16 1 1 A 105 105 ASP CB C 105 40.040 40.462 -0.422 1
1 1211 . 16 1 1 A 105 105 ASP N N 105 121.640 125.093 -3.453 1
1 1212 . 16 1 1 A 106 106 LYS H H 106 8.130 8.108 0.022 1
1 1213 . 16 1 1 A 106 106 LYS HA H 106 4.100 3.886 0.214 1
1 1222 . 16 1 1 A 106 106 LYS C C 106 179.400 178.936 0.464 1
1 1223 . 16 1 1 A 106 106 LYS CA C 106 58.980 59.873 -0.893 1
1 1224 . 16 1 1 A 106 106 LYS CB C 106 32.330 32.136 0.194 1
1 1228 . 16 1 1 A 106 106 LYS N N 106 118.300 120.891 -2.591 1
1 1229 . 16 1 1 A 107 107 GLU H H 107 7.670 8.266 -0.596 1
1 1230 . 16 1 1 A 107 107 GLU HA H 107 4.020 3.983 0.037 1
1 1235 . 16 1 1 A 107 107 GLU C C 107 178.750 179.208 -0.458 1
1 1236 . 16 1 1 A 107 107 GLU CA C 107 59.210 59.160 0.050 1
1 1237 . 16 1 1 A 107 107 GLU CB C 107 29.780 29.351 0.429 1
1 1239 . 16 1 1 A 107 107 GLU N N 107 121.270 118.506 2.764 1
1 1240 . 16 1 1 A 108 108 VAL H H 108 7.790 7.655 0.135 1
1 1241 . 16 1 1 A 108 108 VAL HA H 108 3.050 3.448 -0.398 1
1 1249 . 16 1 1 A 108 108 VAL C C 108 177.550 177.209 0.341 1
1 1250 . 16 1 1 A 108 108 VAL CA C 108 67.080 66.234 0.846 1
1 1251 . 16 1 1 A 108 108 VAL CB C 108 31.220 31.132 0.088 1
1 1254 . 16 1 1 A 108 108 VAL N N 108 120.940 121.042 -0.102 1
1 1255 . 16 1 1 A 109 109 ASP H H 109 7.840 7.904 -0.064 1
1 1256 . 16 1 1 A 109 109 ASP HA H 109 4.110 4.307 -0.197 1
1 1259 . 16 1 1 A 109 109 ASP C C 109 178.190 178.418 -0.228 1
1 1260 . 16 1 1 A 109 109 ASP CA C 109 57.470 57.020 0.450 1
1 1261 . 16 1 1 A 109 109 ASP CB C 109 40.480 40.043 0.437 1
1 1262 . 16 1 1 A 109 109 ASP N N 109 118.780 120.894 -2.114 1
1 1263 . 16 1 1 A 110 110 ALA H H 110 7.520 7.796 -0.276 1
1 1264 . 16 1 1 A 110 110 ALA HA H 110 4.110 4.072 0.038 1
1 1268 . 16 1 1 A 110 110 ALA C C 110 180.550 179.649 0.901 1
1 1269 . 16 1 1 A 110 110 ALA CA C 110 54.880 55.098 -0.218 1
1 1270 . 16 1 1 A 110 110 ALA CB C 110 18.440 18.454 -0.014 1
1 1271 . 16 1 1 A 110 110 ALA N N 110 120.640 122.604 -1.964 1
1 1272 . 16 1 1 A 111 111 ILE H H 111 7.840 7.847 -0.007 1
1 1273 . 16 1 1 A 111 111 ILE HA H 111 3.580 3.532 0.048 1
1 1281 . 16 1 1 A 111 111 ILE C C 111 177.470 178.116 -0.646 1
1 1282 . 16 1 1 A 111 111 ILE CA C 111 64.620 64.846 -0.226 1
1 1283 . 16 1 1 A 111 111 ILE CB C 111 38.600 37.885 0.715 1
1 1286 . 16 1 1 A 111 111 ILE N N 111 119.840 118.906 0.934 1
1 1287 . 16 1 1 A 112 112 MET H H 112 8.100 8.244 -0.144 1
1 1288 . 16 1 1 A 112 112 MET HA H 112 4.400 4.261 0.139 1
1 1296 . 16 1 1 A 112 112 MET C C 112 177.710 178.391 -0.681 1
1 1297 . 16 1 1 A 112 112 MET CA C 112 55.300 58.452 -3.152 1
1 1298 . 16 1 1 A 112 112 MET CB C 112 30.510 31.770 -1.260 1
1 1301 . 16 1 1 A 112 112 MET N N 112 115.180 118.525 -3.345 1
1 1302 . 16 1 1 A 113 113 ASN H H 113 8.070 8.008 0.062 1
1 1303 . 16 1 1 A 113 113 ASN HA H 113 4.570 4.426 0.144 1
1 1308 . 16 1 1 A 113 113 ASN C C 113 175.530 177.685 -2.155 1
1 1309 . 16 1 1 A 113 113 ASN CA C 113 54.420 56.414 -1.994 1
1 1310 . 16 1 1 A 113 113 ASN CB C 113 38.350 39.199 -0.849 1
1 1311 . 16 1 1 A 113 113 ASN N N 113 117.190 118.931 -1.741 1
1 1313 . 16 1 1 A 114 114 ARG H H 114 8.070 7.728 0.342 1
1 1314 . 16 1 1 A 114 114 ARG HA H 114 4.280 3.916 0.364 1
1 1321 . 16 1 1 A 114 114 ARG C C 114 176.620 178.826 -2.206 1
1 1322 . 16 1 1 A 114 114 ARG CA C 114 56.910 59.056 -2.146 1
1 1323 . 16 1 1 A 114 114 ARG CB C 114 30.370 29.570 0.800 1
1 1326 . 16 1 1 A 114 114 ARG N N 114 118.360 118.769 -0.409 1
1 1327 . 16 1 1 A 115 115 LEU H H 115 8.100 7.615 0.485 1
1 1328 . 16 1 1 A 115 115 LEU HA H 115 4.310 4.233 0.077 1
1 1338 . 16 1 1 A 115 115 LEU C C 115 177.440 178.635 -1.195 1
1 1339 . 16 1 1 A 115 115 LEU CA C 115 55.440 57.768 -2.328 1
1 1340 . 16 1 1 A 115 115 LEU CB C 115 42.250 41.930 0.320 1
1 1344 . 16 1 1 A 115 115 LEU N N 115 120.580 121.279 -0.699 1
1 1345 . 16 1 1 A 116 116 GLN H H 116 8.180 7.200 0.980 1
1 1346 . 16 1 1 A 116 116 GLN HA H 116 4.360 4.308 0.052 1
1 1353 . 16 1 1 A 116 116 GLN C C 116 175.890 175.700 0.190 1
1 1354 . 16 1 1 A 116 116 GLN CA C 116 55.810 56.488 -0.678 1
1 1355 . 16 1 1 A 116 116 GLN CB C 116 29.500 28.791 0.709 1
1 1357 . 16 1 1 A 116 116 GLN N N 116 119.770 116.692 3.078 1
1 1358 . 16 1 1 A 117 117 GLN H H 117 8.350 8.158 0.192 1
1 1359 . 16 1 1 A 117 117 GLN HA H 117 4.380 4.370 0.010 1
1 1366 . 16 1 1 A 117 117 GLN C C 117 176.130 175.299 0.831 1
1 1367 . 16 1 1 A 117 117 GLN CA C 117 55.810 55.817 -0.007 1
1 1368 . 16 1 1 A 117 117 GLN CB C 117 29.500 29.287 0.213 1
1 1370 . 16 1 1 A 117 117 GLN N N 117 121.440 121.491 -0.051 1
1 1371 . 16 1 1 A 118 118 VAL H H 118 8.240 8.740 -0.500 1
1 1372 . 16 1 1 A 118 118 VAL HA H 118 4.120 4.421 -0.301 1
1 1380 . 16 1 1 A 118 118 VAL C C 118 176.650 177.344 -0.694 1
1 1381 . 16 1 1 A 118 118 VAL CA C 118 62.720 60.675 2.045 1
1 1382 . 16 1 1 A 118 118 VAL CB C 118 32.730 33.401 -0.671 1
1 1385 . 16 1 1 A 118 118 VAL N N 118 121.250 125.936 -4.686 1
1 1386 . 16 1 1 A 119 119 GLY H H 119 8.460 8.648 -0.188 1
1 1387 . 16 1 1 A 119 119 GLY HA2 H 119 3.990 3.806 0.184 1
1 1388 . 16 1 1 A 119 119 GLY HA3 H 119 3.990 3.808 0.182 1
1 1389 . 16 1 1 A 119 119 GLY C C 119 173.770 174.369 -0.599 1
1 1390 . 16 1 1 A 119 119 GLY CA C 119 45.260 47.035 -1.775 1
1 1391 . 16 1 1 A 119 119 GLY N N 119 112.300 113.422 -1.122 1
1 1392 . 16 1 1 A 120 120 ASP H H 120 8.230 7.733 0.497 1
1 1393 . 16 1 1 A 120 120 ASP HA H 120 4.580 4.648 -0.068 1
1 1396 . 16 1 1 A 120 120 ASP C C 120 175.180 176.044 -0.864 1
1 1397 . 16 1 1 A 120 120 ASP CA C 120 54.340 54.882 -0.542 1
1 1398 . 16 1 1 A 120 120 ASP CB C 120 41.390 41.284 0.106 1
1 1399 . 16 1 1 A 120 120 ASP N N 120 120.420 120.821 -0.401 1
1 1400 . 16 1 1 A 121 121 LYS H H 121 7.950 8.569 -0.619 1
1 1401 . 16 1 1 A 121 121 LYS HA H 121 4.240 4.519 -0.279 1
1 1402 . 16 1 1 A 121 121 LYS CA C 121 53.620 53.572 0.048 1
1 1403 . 16 1 1 A 121 121 LYS N N 121 119.110 123.932 -4.822 1
1 1404 . 16 1 1 A 122 122 PRO HA H 122 4.410 4.871 -0.461 1
1 1405 . 16 1 1 A 122 122 PRO C C 122 176.560 175.292 1.268 1
1 1406 . 16 1 1 A 122 122 PRO CA C 122 63.130 62.643 0.487 1
1 2 . 17 1 1 A 2 2 SER H H 2 7.890 7.674 0.216 1
1 3 . 17 1 1 A 2 2 SER HA H 2 4.270 4.868 -0.598 1
1 4 . 17 1 1 A 2 2 SER C C 2 173.960 174.759 -0.799 1
1 5 . 17 1 1 A 2 2 SER CA C 2 60.800 57.319 3.481 1
1 6 . 17 1 1 A 2 2 SER N N 2 111.940 115.248 -3.308 1
1 7 . 17 1 1 A 3 3 GLU H H 3 8.010 9.151 -1.141 1
1 8 . 17 1 1 A 3 3 GLU HA H 3 4.360 3.944 0.416 1
1 9 . 17 1 1 A 3 3 GLU C C 3 175.710 176.157 -0.447 1
1 10 . 17 1 1 A 3 3 GLU CA C 3 56.310 59.886 -3.576 1
1 11 . 17 1 1 A 3 3 GLU N N 3 121.280 124.231 -2.951 1
1 12 . 17 1 1 A 4 4 ALA H H 4 8.540 7.894 0.646 1
1 13 . 17 1 1 A 4 4 ALA HA H 4 4.560 4.063 0.497 1
1 14 . 17 1 1 A 4 4 ALA CA C 4 50.630 52.509 -1.879 1
1 15 . 17 1 1 A 4 4 ALA N N 4 127.840 121.037 6.803 1
1 16 . 17 1 1 A 5 5 PRO HA H 5 4.420 4.390 0.030 1
1 17 . 17 1 1 A 5 5 PRO C C 5 174.240 176.712 -2.472 1
1 18 . 17 1 1 A 5 5 PRO CA C 5 62.840 63.600 -0.760 1
1 19 . 17 1 1 A 6 6 LYS H H 6 8.320 7.913 0.407 1
1 20 . 17 1 1 A 6 6 LYS HA H 6 4.290 3.821 0.469 1
1 21 . 17 1 1 A 6 6 LYS C C 6 176.100 175.478 0.622 1
1 22 . 17 1 1 A 6 6 LYS CA C 6 55.540 57.431 -1.891 1
1 23 . 17 1 1 A 6 6 LYS N N 6 121.910 116.176 5.734 1
1 24 . 17 1 1 A 7 7 LYS H H 7 8.450 8.070 0.380 1
1 25 . 17 1 1 A 7 7 LYS HA H 7 3.940 4.271 -0.331 1
1 26 . 17 1 1 A 7 7 LYS C C 7 175.700 176.079 -0.379 1
1 27 . 17 1 1 A 7 7 LYS CA C 7 56.440 56.147 0.293 1
1 28 . 17 1 1 A 7 7 LYS N N 7 122.250 118.845 3.405 1
1 29 . 17 1 1 A 8 8 ARG H H 8 8.210 8.880 -0.670 1
1 30 . 17 1 1 A 8 8 ARG HA H 8 4.670 4.799 -0.129 1
1 31 . 17 1 1 A 8 8 ARG C C 8 173.760 175.278 -1.518 1
1 32 . 17 1 1 A 8 8 ARG CA C 8 53.420 53.971 -0.551 1
1 33 . 17 1 1 A 8 8 ARG N N 8 122.560 123.444 -0.884 1
1 34 . 17 1 1 A 9 9 TRP H H 9 8.610 8.795 -0.185 1
1 35 . 17 1 1 A 9 9 TRP HA H 9 4.910 5.133 -0.223 1
1 44 . 17 1 1 A 9 9 TRP C C 9 174.610 175.800 -1.190 1
1 45 . 17 1 1 A 9 9 TRP CA C 9 57.630 56.593 1.037 1
1 46 . 17 1 1 A 9 9 TRP CB C 9 31.020 30.423 0.597 1
1 52 . 17 1 1 A 9 9 TRP N N 9 120.540 121.654 -1.114 1
1 54 . 17 1 1 A 10 10 TYR H H 10 9.260 8.885 0.375 1
1 55 . 17 1 1 A 10 10 TYR HA H 10 4.820 5.269 -0.449 1
1 62 . 17 1 1 A 10 10 TYR C C 10 174.340 175.315 -0.975 1
1 63 . 17 1 1 A 10 10 TYR CA C 10 57.050 56.576 0.474 1
1 64 . 17 1 1 A 10 10 TYR CB C 10 41.920 42.732 -0.812 1
1 69 . 17 1 1 A 10 10 TYR N N 10 118.990 121.980 -2.990 1
1 70 . 17 1 1 A 11 11 VAL H H 11 9.450 8.848 0.602 1
1 71 . 17 1 1 A 11 11 VAL HA H 11 4.470 4.530 -0.060 1
1 79 . 17 1 1 A 11 11 VAL C C 11 175.030 175.265 -0.235 1
1 80 . 17 1 1 A 11 11 VAL CA C 11 62.320 61.846 0.474 1
1 81 . 17 1 1 A 11 11 VAL CB C 11 32.400 32.879 -0.479 1
1 84 . 17 1 1 A 11 11 VAL N N 11 120.930 122.830 -1.900 1
1 85 . 17 1 1 A 12 12 VAL H H 12 9.320 8.334 0.986 1
1 86 . 17 1 1 A 12 12 VAL HA H 12 3.940 4.380 -0.440 1
1 94 . 17 1 1 A 12 12 VAL C C 12 173.870 174.638 -0.768 1
1 95 . 17 1 1 A 12 12 VAL CA C 12 61.330 60.790 0.540 1
1 96 . 17 1 1 A 12 12 VAL CB C 12 33.500 35.133 -1.633 1
1 99 . 17 1 1 A 12 12 VAL N N 12 128.860 126.648 2.212 1
1 100 . 17 1 1 A 13 13 GLN H H 13 8.830 8.515 0.315 1
1 101 . 17 1 1 A 13 13 GLN HA H 13 4.710 4.874 -0.164 1
1 108 . 17 1 1 A 13 13 GLN C C 13 174.230 175.293 -1.063 1
1 109 . 17 1 1 A 13 13 GLN CA C 13 54.800 55.523 -0.723 1
1 110 . 17 1 1 A 13 13 GLN CB C 13 29.450 30.100 -0.650 1
1 111 . 17 1 1 A 13 13 GLN N N 13 126.050 126.588 -0.538 1
1 113 . 17 1 1 A 14 14 ALA H H 14 9.420 8.247 1.173 1
1 114 . 17 1 1 A 14 14 ALA HA H 14 5.150 4.916 0.234 1
1 118 . 17 1 1 A 14 14 ALA C C 14 176.400 176.108 0.292 1
1 119 . 17 1 1 A 14 14 ALA CA C 14 49.660 51.168 -1.508 1
1 120 . 17 1 1 A 14 14 ALA CB C 14 22.840 22.736 0.104 1
1 121 . 17 1 1 A 14 14 ALA N N 14 131.620 122.419 9.201 1
1 122 . 17 1 1 A 15 15 PHE H H 15 8.070 8.519 -0.449 1
1 123 . 17 1 1 A 15 15 PHE HA H 15 4.410 4.801 -0.391 1
1 128 . 17 1 1 A 15 15 PHE C C 15 176.130 175.802 0.328 1
1 129 . 17 1 1 A 15 15 PHE CA C 15 58.550 58.508 0.042 1
1 130 . 17 1 1 A 15 15 PHE CB C 15 39.780 39.597 0.183 1
1 133 . 17 1 1 A 15 15 PHE N N 15 119.680 119.540 0.140 1
1 134 . 17 1 1 A 16 16 SER H H 16 8.370 8.871 -0.501 1
1 135 . 17 1 1 A 16 16 SER HA H 16 4.140 4.077 0.063 1
1 138 . 17 1 1 A 16 16 SER C C 16 175.820 175.546 0.274 1
1 139 . 17 1 1 A 16 16 SER CA C 16 60.570 60.641 -0.071 1
1 140 . 17 1 1 A 16 16 SER CB C 16 63.030 63.058 -0.028 1
1 141 . 17 1 1 A 16 16 SER N N 16 119.700 119.391 0.309 1
1 142 . 17 1 1 A 17 17 GLY H H 17 9.130 8.748 0.382 1
1 143 . 17 1 1 A 17 17 GLY HA2 H 17 3.640 3.565 0.075 1
1 144 . 17 1 1 A 17 17 GLY HA3 H 17 4.200 3.765 0.435 1
1 145 . 17 1 1 A 17 17 GLY C C 17 175.520 174.763 0.757 1
1 146 . 17 1 1 A 17 17 GLY CA C 17 45.260 45.208 0.052 1
1 147 . 17 1 1 A 17 17 GLY N N 17 115.850 113.167 2.683 1
1 148 . 17 1 1 A 18 18 PHE H H 18 8.480 7.763 0.717 1
1 149 . 17 1 1 A 18 18 PHE HA H 18 4.740 4.628 0.112 1
1 154 . 17 1 1 A 18 18 PHE C C 18 175.430 176.230 -0.800 1
1 155 . 17 1 1 A 18 18 PHE CA C 18 58.240 57.886 0.354 1
1 156 . 17 1 1 A 18 18 PHE CB C 18 39.010 38.650 0.360 1
1 159 . 17 1 1 A 18 18 PHE N N 18 118.550 119.705 -1.155 1
1 160 . 17 1 1 A 19 19 GLU H H 19 10.690 8.190 2.500 1
1 161 . 17 1 1 A 19 19 GLU HA H 19 3.490 4.021 -0.531 1
1 166 . 17 1 1 A 19 19 GLU C C 19 177.650 179.085 -1.435 1
1 167 . 17 1 1 A 19 19 GLU CA C 19 62.280 59.824 2.456 1
1 168 . 17 1 1 A 19 19 GLU CB C 19 28.380 29.300 -0.920 1
1 170 . 17 1 1 A 19 19 GLU N N 19 123.470 123.098 0.372 1
1 171 . 17 1 1 A 20 20 GLY H H 20 8.740 8.261 0.479 1
1 172 . 17 1 1 A 20 20 GLY HA2 H 20 3.840 3.836 0.004 1
1 173 . 17 1 1 A 20 20 GLY HA3 H 20 3.940 3.843 0.097 1
1 174 . 17 1 1 A 20 20 GLY C C 20 176.860 175.557 1.303 1
1 175 . 17 1 1 A 20 20 GLY CA C 20 47.140 46.901 0.239 1
1 176 . 17 1 1 A 20 20 GLY N N 20 105.480 107.360 -1.880 1
1 177 . 17 1 1 A 21 21 ARG H H 21 7.690 8.260 -0.570 1
1 178 . 17 1 1 A 21 21 ARG HA H 21 4.180 4.156 0.024 1
1 185 . 17 1 1 A 21 21 ARG C C 21 179.490 178.890 0.600 1
1 186 . 17 1 1 A 21 21 ARG CA C 21 58.660 59.314 -0.654 1
1 187 . 17 1 1 A 21 21 ARG CB C 21 30.100 30.037 0.063 1
1 190 . 17 1 1 A 21 21 ARG N N 21 123.120 122.308 0.812 1
1 191 . 17 1 1 A 22 22 VAL H H 22 8.980 8.244 0.736 1
1 192 . 17 1 1 A 22 22 VAL HA H 22 3.560 3.724 -0.164 1
1 200 . 17 1 1 A 22 22 VAL C C 22 177.320 178.244 -0.924 1
1 201 . 17 1 1 A 22 22 VAL CA C 22 66.960 66.279 0.681 1
1 202 . 17 1 1 A 22 22 VAL CB C 22 31.050 31.621 -0.571 1
1 205 . 17 1 1 A 22 22 VAL N N 22 122.760 119.905 2.855 1
1 206 . 17 1 1 A 23 23 ALA H H 23 8.280 8.221 0.059 1
1 207 . 17 1 1 A 23 23 ALA HA H 23 3.850 4.033 -0.183 1
1 211 . 17 1 1 A 23 23 ALA C C 23 179.340 179.556 -0.216 1
1 212 . 17 1 1 A 23 23 ALA CA C 23 56.260 55.234 1.026 1
1 213 . 17 1 1 A 23 23 ALA CB C 23 18.260 18.209 0.051 1
1 214 . 17 1 1 A 23 23 ALA N N 23 122.120 121.548 0.572 1
1 215 . 17 1 1 A 24 24 THR H H 24 8.020 7.816 0.204 1
1 216 . 17 1 1 A 24 24 THR HA H 24 3.920 3.891 0.029 1
1 221 . 17 1 1 A 24 24 THR C C 24 176.940 176.523 0.417 1
1 222 . 17 1 1 A 24 24 THR CA C 24 66.820 66.675 0.145 1
1 223 . 17 1 1 A 24 24 THR CB C 24 68.930 68.536 0.394 1
1 225 . 17 1 1 A 24 24 THR N N 24 113.410 115.649 -2.239 1
1 226 . 17 1 1 A 25 25 SER H H 25 8.570 8.263 0.307 1
1 227 . 17 1 1 A 25 25 SER HA H 25 4.400 4.036 0.364 1
1 230 . 17 1 1 A 25 25 SER C C 25 177.610 175.984 1.626 1
1 231 . 17 1 1 A 25 25 SER CA C 25 61.920 62.270 -0.350 1
1 232 . 17 1 1 A 25 25 SER CB C 25 63.540 62.943 0.597 1
1 233 . 17 1 1 A 25 25 SER N N 25 118.260 117.817 0.443 1
1 234 . 17 1 1 A 26 26 LEU H H 26 9.430 8.364 1.066 1
1 235 . 17 1 1 A 26 26 LEU HA H 26 3.900 4.187 -0.287 1
1 245 . 17 1 1 A 26 26 LEU C C 26 177.710 178.673 -0.963 1
1 246 . 17 1 1 A 26 26 LEU CA C 26 58.910 57.698 1.212 1
1 247 . 17 1 1 A 26 26 LEU CB C 26 41.300 41.577 -0.277 1
1 251 . 17 1 1 A 26 26 LEU N N 26 124.120 122.904 1.216 1
1 252 . 17 1 1 A 27 27 ARG H H 27 7.790 7.769 0.021 1
1 253 . 17 1 1 A 27 27 ARG HA H 27 3.880 3.720 0.160 1
1 260 . 17 1 1 A 27 27 ARG C C 27 179.380 178.880 0.500 1
1 261 . 17 1 1 A 27 27 ARG CA C 27 60.510 59.559 0.951 1
1 262 . 17 1 1 A 27 27 ARG CB C 27 29.670 29.688 -0.018 1
1 265 . 17 1 1 A 27 27 ARG N N 27 116.710 119.091 -2.381 1
1 266 . 17 1 1 A 28 28 GLU H H 28 7.900 7.510 0.390 1
1 267 . 17 1 1 A 28 28 GLU HA H 28 4.070 3.957 0.113 1
1 272 . 17 1 1 A 28 28 GLU C C 28 179.450 179.377 0.073 1
1 273 . 17 1 1 A 28 28 GLU CA C 28 59.450 59.181 0.269 1
1 274 . 17 1 1 A 28 28 GLU CB C 28 29.610 29.452 0.158 1
1 276 . 17 1 1 A 28 28 GLU N N 28 118.340 118.304 0.036 1
1 277 . 17 1 1 A 29 29 HIS H H 29 8.940 7.280 1.660 1
1 278 . 17 1 1 A 29 29 HIS HA H 29 4.160 4.482 -0.322 1
1 283 . 17 1 1 A 29 29 HIS C C 29 177.750 177.879 -0.129 1
1 284 . 17 1 1 A 29 29 HIS CA C 29 61.260 59.415 1.845 1
1 285 . 17 1 1 A 29 29 HIS CB C 29 29.870 29.930 -0.060 1
1 287 . 17 1 1 A 29 29 HIS N N 29 120.440 118.693 1.747 1
1 288 . 17 1 1 A 30 30 ILE H H 30 8.580 8.630 -0.050 1
1 289 . 17 1 1 A 30 30 ILE HA H 30 3.160 3.638 -0.478 1
1 299 . 17 1 1 A 30 30 ILE C C 30 177.230 177.941 -0.711 1
1 300 . 17 1 1 A 30 30 ILE CA C 30 66.460 65.078 1.382 1
1 301 . 17 1 1 A 30 30 ILE CB C 30 38.630 37.520 1.110 1
1 305 . 17 1 1 A 30 30 ILE N N 30 121.010 120.003 1.007 1
1 306 . 17 1 1 A 31 31 LYS H H 31 7.020 8.883 -1.863 1
1 307 . 17 1 1 A 31 31 LYS HA H 31 4.170 3.992 0.178 1
1 316 . 17 1 1 A 31 31 LYS C C 31 180.570 178.640 1.930 1
1 317 . 17 1 1 A 31 31 LYS CA C 31 58.920 59.803 -0.883 1
1 318 . 17 1 1 A 31 31 LYS CB C 31 32.490 32.035 0.455 1
1 322 . 17 1 1 A 31 31 LYS N N 31 117.400 121.080 -3.680 1
1 323 . 17 1 1 A 32 32 LEU H H 32 8.400 8.369 0.031 1
1 324 . 17 1 1 A 32 32 LEU HA H 32 3.990 3.882 0.108 1
1 334 . 17 1 1 A 32 32 LEU C C 32 178.230 178.464 -0.234 1
1 335 . 17 1 1 A 32 32 LEU CA C 32 57.700 57.862 -0.162 1
1 336 . 17 1 1 A 32 32 LEU CB C 32 42.540 41.736 0.804 1
1 340 . 17 1 1 A 32 32 LEU N N 32 121.180 119.724 1.456 1
1 341 . 17 1 1 A 33 33 HIS H H 33 7.620 7.762 -0.142 1
1 342 . 17 1 1 A 33 33 HIS HA H 33 4.600 4.646 -0.046 1
1 347 . 17 1 1 A 33 33 HIS C C 33 177.090 174.045 3.045 1
1 348 . 17 1 1 A 33 33 HIS CA C 33 55.840 55.564 0.276 1
1 349 . 17 1 1 A 33 33 HIS CB C 33 29.330 29.878 -0.548 1
1 351 . 17 1 1 A 33 33 HIS N N 33 112.220 115.939 -3.719 1
1 352 . 17 1 1 A 34 34 ASN H H 34 8.030 8.171 -0.141 1
1 353 . 17 1 1 A 34 34 ASN HA H 34 4.890 4.425 0.465 1
1 358 . 17 1 1 A 34 34 ASN C C 34 175.910 175.407 0.503 1
1 359 . 17 1 1 A 34 34 ASN CA C 34 54.530 54.403 0.127 1
1 360 . 17 1 1 A 34 34 ASN CB C 34 37.380 36.606 0.774 1
1 361 . 17 1 1 A 34 34 ASN N N 34 117.600 114.510 3.090 1
1 363 . 17 1 1 A 35 35 MET H H 35 8.330 8.794 -0.464 1
1 364 . 17 1 1 A 35 35 MET HA H 35 4.940 4.705 0.235 1
1 372 . 17 1 1 A 35 35 MET C C 35 176.880 177.280 -0.400 1
1 373 . 17 1 1 A 35 35 MET CA C 35 55.600 55.014 0.586 1
1 374 . 17 1 1 A 35 35 MET CB C 35 33.790 32.396 1.394 1
1 377 . 17 1 1 A 35 35 MET N N 35 116.190 116.201 -0.011 1
1 378 . 17 1 1 A 36 36 GLU H H 36 9.730 8.070 1.660 1
1 379 . 17 1 1 A 36 36 GLU HA H 36 3.850 4.165 -0.315 1
1 384 . 17 1 1 A 36 36 GLU C C 36 178.290 179.360 -1.070 1
1 385 . 17 1 1 A 36 36 GLU CA C 36 61.280 59.620 1.660 1
1 386 . 17 1 1 A 36 36 GLU CB C 36 29.270 29.291 -0.021 1
1 388 . 17 1 1 A 36 36 GLU N N 36 121.630 119.936 1.694 1
1 389 . 17 1 1 A 37 37 ASP H H 37 8.850 8.071 0.779 1
1 390 . 17 1 1 A 37 37 ASP HA H 37 4.470 4.490 -0.020 1
1 393 . 17 1 1 A 37 37 ASP C C 37 177.190 178.901 -1.711 1
1 394 . 17 1 1 A 37 37 ASP CA C 37 56.140 57.294 -1.154 1
1 395 . 17 1 1 A 37 37 ASP CB C 37 40.050 40.790 -0.740 1
1 396 . 17 1 1 A 37 37 ASP N N 37 114.390 119.915 -5.525 1
1 397 . 17 1 1 A 38 38 LEU H H 38 7.880 7.897 -0.017 1
1 398 . 17 1 1 A 38 38 LEU HA H 38 4.290 4.013 0.277 1
1 408 . 17 1 1 A 38 38 LEU C C 38 175.090 177.544 -2.454 1
1 409 . 17 1 1 A 38 38 LEU CA C 38 54.670 57.600 -2.930 1
1 410 . 17 1 1 A 38 38 LEU CB C 38 42.940 41.826 1.114 1
1 414 . 17 1 1 A 38 38 LEU N N 38 116.550 119.284 -2.734 1
1 415 . 17 1 1 A 39 39 PHE H H 39 7.500 7.665 -0.165 1
1 416 . 17 1 1 A 39 39 PHE HA H 39 4.970 4.639 0.331 1
1 424 . 17 1 1 A 39 39 PHE C C 39 175.380 175.793 -0.413 1
1 425 . 17 1 1 A 39 39 PHE CA C 39 57.580 58.225 -0.645 1
1 426 . 17 1 1 A 39 39 PHE CB C 39 44.990 39.647 5.343 1
1 432 . 17 1 1 A 39 39 PHE N N 39 115.370 116.849 -1.479 1
1 433 . 17 1 1 A 40 40 GLY H H 40 8.680 8.816 -0.136 1
1 434 . 17 1 1 A 40 40 GLY HA2 H 40 3.370 4.008 -0.638 1
1 435 . 17 1 1 A 40 40 GLY HA3 H 40 4.550 4.081 0.469 1
1 436 . 17 1 1 A 40 40 GLY C C 40 173.090 173.740 -0.650 1
1 437 . 17 1 1 A 40 40 GLY CA C 40 44.180 46.307 -2.127 1
1 438 . 17 1 1 A 40 40 GLY N N 40 110.930 111.245 -0.315 1
1 439 . 17 1 1 A 41 41 GLU H H 41 8.320 7.669 0.651 1
1 440 . 17 1 1 A 41 41 GLU HA H 41 4.280 4.864 -0.584 1
1 445 . 17 1 1 A 41 41 GLU C C 41 173.900 175.185 -1.285 1
1 446 . 17 1 1 A 41 41 GLU CA C 41 56.900 54.555 2.345 1
1 447 . 17 1 1 A 41 41 GLU CB C 41 32.110 34.683 -2.573 1
1 449 . 17 1 1 A 41 41 GLU N N 41 126.730 117.302 9.428 1
1 450 . 17 1 1 A 42 42 VAL H H 42 8.100 8.547 -0.447 1
1 451 . 17 1 1 A 42 42 VAL HA H 42 5.160 5.081 0.079 1
1 459 . 17 1 1 A 42 42 VAL C C 42 176.340 175.076 1.264 1
1 460 . 17 1 1 A 42 42 VAL CA C 42 61.200 60.746 0.454 1
1 461 . 17 1 1 A 42 42 VAL CB C 42 34.770 35.162 -0.392 1
1 464 . 17 1 1 A 42 42 VAL N N 42 119.360 121.476 -2.116 1
1 465 . 17 1 1 A 43 43 MET H H 43 9.870 9.459 0.411 1
1 466 . 17 1 1 A 43 43 MET HA H 43 5.070 5.231 -0.161 1
1 474 . 17 1 1 A 43 43 MET C C 43 173.890 174.575 -0.685 1
1 475 . 17 1 1 A 43 43 MET CA C 43 54.740 54.364 0.376 1
1 476 . 17 1 1 A 43 43 MET CB C 43 37.500 36.976 0.524 1
1 479 . 17 1 1 A 43 43 MET N N 43 125.720 124.745 0.975 1
1 480 . 17 1 1 A 44 44 VAL H H 44 8.800 9.073 -0.273 1
1 481 . 17 1 1 A 44 44 VAL HA H 44 4.720 4.593 0.127 1
1 489 . 17 1 1 A 44 44 VAL CA C 44 59.090 59.263 -0.173 1
1 490 . 17 1 1 A 44 44 VAL CB C 44 33.710 33.860 -0.150 1
1 493 . 17 1 1 A 44 44 VAL N N 44 122.340 122.659 -0.319 1
1 494 . 17 1 1 A 45 45 PRO HA H 45 4.480 4.700 -0.220 1
1 501 . 17 1 1 A 45 45 PRO C C 45 177.080 174.666 2.414 1
1 502 . 17 1 1 A 45 45 PRO CA C 45 63.240 62.523 0.717 1
1 503 . 17 1 1 A 45 45 PRO CB C 45 32.170 29.151 3.019 1
1 506 . 17 1 1 A 46 46 THR H H 46 8.200 8.390 -0.190 1
1 507 . 17 1 1 A 46 46 THR HA H 46 4.290 4.779 -0.489 1
1 512 . 17 1 1 A 46 46 THR C C 46 174.600 174.712 -0.112 1
1 513 . 17 1 1 A 46 46 THR CA C 46 62.100 59.523 2.577 1
1 514 . 17 1 1 A 46 46 THR CB C 46 69.990 72.548 -2.558 1
1 516 . 17 1 1 A 46 46 THR N N 46 113.410 111.890 1.520 1
1 517 . 17 1 1 A 47 47 GLU H H 47 8.380 8.425 -0.045 1
1 518 . 17 1 1 A 47 47 GLU HA H 47 4.400 4.178 0.222 1
1 521 . 17 1 1 A 47 47 GLU C C 47 175.970 176.468 -0.498 1
1 522 . 17 1 1 A 47 47 GLU CA C 47 55.200 58.890 -3.690 1
1 523 . 17 1 1 A 47 47 GLU CB C 47 32.300 30.263 2.037 1
1 524 . 17 1 1 A 47 47 GLU N N 47 122.830 121.982 0.848 1
1 525 . 17 1 1 A 48 48 GLU H H 48 8.400 7.790 0.610 1
1 526 . 17 1 1 A 48 48 GLU HA H 48 4.280 4.767 -0.487 1
1 531 . 17 1 1 A 48 48 GLU C C 48 175.750 176.954 -1.204 1
1 532 . 17 1 1 A 48 48 GLU CA C 48 55.190 55.179 0.011 1
1 533 . 17 1 1 A 48 48 GLU CB C 48 31.980 32.314 -0.334 1
1 535 . 17 1 1 A 48 48 GLU N N 48 121.950 119.380 2.570 1
1 536 . 17 1 1 A 49 49 VAL H H 49 8.240 8.560 -0.320 1
1 537 . 17 1 1 A 49 49 VAL HA H 49 4.170 3.833 0.337 1
1 542 . 17 1 1 A 49 49 VAL C C 49 174.610 176.306 -1.696 1
1 543 . 17 1 1 A 49 49 VAL CA C 49 62.280 65.274 -2.994 1
1 544 . 17 1 1 A 49 49 VAL CB C 49 32.930 31.800 1.130 1
1 546 . 17 1 1 A 49 49 VAL N N 49 123.990 122.609 1.381 1
1 547 . 17 1 1 A 50 50 VAL H H 50 8.230 7.982 0.248 1
1 548 . 17 1 1 A 50 50 VAL HA H 50 4.220 4.343 -0.123 1
1 553 . 17 1 1 A 50 50 VAL C C 50 175.770 175.225 0.545 1
1 554 . 17 1 1 A 50 50 VAL CA C 50 62.170 61.084 1.086 1
1 555 . 17 1 1 A 50 50 VAL CB C 50 33.110 33.377 -0.267 1
1 557 . 17 1 1 A 50 50 VAL N N 50 123.960 121.467 2.493 1
1 558 . 17 1 1 A 51 51 GLU H H 51 8.570 8.666 -0.096 1
1 559 . 17 1 1 A 51 51 GLU HA H 51 4.380 4.468 -0.088 1
1 564 . 17 1 1 A 51 51 GLU C C 51 175.920 177.184 -1.264 1
1 565 . 17 1 1 A 51 51 GLU CA C 51 56.050 56.053 -0.003 1
1 566 . 17 1 1 A 51 51 GLU CB C 51 31.080 29.917 1.163 1
1 568 . 17 1 1 A 51 51 GLU N N 51 125.070 126.010 -0.940 1
1 569 . 17 1 1 A 52 52 ILE H H 52 8.320 8.807 -0.487 1
1 570 . 17 1 1 A 52 52 ILE HA H 52 4.290 4.369 -0.079 1
1 580 . 17 1 1 A 52 52 ILE C C 52 176.330 175.013 1.317 1
1 581 . 17 1 1 A 52 52 ILE CA C 52 60.940 61.172 -0.232 1
1 582 . 17 1 1 A 52 52 ILE CB C 52 38.510 38.381 0.129 1
1 586 . 17 1 1 A 52 52 ILE N N 52 122.760 122.357 0.403 1
1 587 . 17 1 1 A 53 53 ARG H H 53 8.500 7.629 0.871 1
1 588 . 17 1 1 A 53 53 ARG HA H 53 4.430 4.819 -0.389 1
1 595 . 17 1 1 A 53 53 ARG C C 53 176.950 175.768 1.182 1
1 596 . 17 1 1 A 53 53 ARG CA C 53 56.150 54.320 1.830 1
1 597 . 17 1 1 A 53 53 ARG CB C 53 30.200 33.131 -2.931 1
1 600 . 17 1 1 A 53 53 ARG N N 53 125.250 121.673 3.577 1
1 601 . 17 1 1 A 54 54 GLY H H 54 8.760 8.554 0.206 1
1 602 . 17 1 1 A 54 54 GLY HA2 H 54 3.920 4.269 -0.349 1
1 603 . 17 1 1 A 54 54 GLY HA3 H 54 4.010 4.277 -0.267 1
1 604 . 17 1 1 A 54 54 GLY C C 54 175.110 174.121 0.989 1
1 605 . 17 1 1 A 54 54 GLY CA C 54 46.030 44.926 1.104 1
1 606 . 17 1 1 A 54 54 GLY N N 54 112.510 108.705 3.805 1
1 607 . 17 1 1 A 55 55 GLY H H 55 8.350 8.684 -0.334 1
1 608 . 17 1 1 A 55 55 GLY HA2 H 55 3.980 4.017 -0.037 1
1 609 . 17 1 1 A 55 55 GLY HA3 H 55 3.980 4.022 -0.042 1
1 610 . 17 1 1 A 55 55 GLY C C 55 173.920 174.701 -0.781 1
1 611 . 17 1 1 A 55 55 GLY CA C 55 45.200 45.407 -0.207 1
1 612 . 17 1 1 A 55 55 GLY N N 55 107.940 109.990 -2.050 1
1 613 . 17 1 1 A 56 56 GLN H H 56 8.100 8.315 -0.215 1
1 614 . 17 1 1 A 56 56 GLN HA H 56 4.420 3.925 0.495 1
1 619 . 17 1 1 A 56 56 GLN C C 56 175.570 175.124 0.446 1
1 620 . 17 1 1 A 56 56 GLN CA C 56 55.420 57.105 -1.685 1
1 621 . 17 1 1 A 56 56 GLN CB C 56 30.100 26.840 3.260 1
1 623 . 17 1 1 A 56 56 GLN N N 56 119.350 113.587 5.763 1
1 624 . 17 1 1 A 57 57 ARG H H 57 8.520 8.172 0.348 1
1 625 . 17 1 1 A 57 57 ARG HA H 57 4.400 4.293 0.107 1
1 632 . 17 1 1 A 57 57 ARG C C 57 176.210 175.623 0.587 1
1 633 . 17 1 1 A 57 57 ARG CA C 57 56.440 56.709 -0.269 1
1 634 . 17 1 1 A 57 57 ARG CB C 57 30.930 31.238 -0.308 1
1 637 . 17 1 1 A 57 57 ARG N N 57 122.610 119.215 3.395 1
1 638 . 17 1 1 A 58 58 ARG H H 58 8.630 8.827 -0.197 1
1 639 . 17 1 1 A 58 58 ARG HA H 58 4.430 5.138 -0.708 1
1 646 . 17 1 1 A 58 58 ARG C C 58 175.950 174.672 1.278 1
1 647 . 17 1 1 A 58 58 ARG CA C 58 55.450 54.458 0.992 1
1 648 . 17 1 1 A 58 58 ARG CB C 58 31.300 34.176 -2.876 1
1 651 . 17 1 1 A 58 58 ARG N N 58 123.320 122.948 0.372 1
1 652 . 17 1 1 A 59 59 LYS H H 59 8.560 8.832 -0.272 1
1 653 . 17 1 1 A 59 59 LYS HA H 59 4.410 4.810 -0.400 1
1 662 . 17 1 1 A 59 59 LYS C C 59 176.590 176.892 -0.302 1
1 663 . 17 1 1 A 59 59 LYS CA C 59 56.720 55.035 1.685 1
1 664 . 17 1 1 A 59 59 LYS CB C 59 33.150 34.290 -1.140 1
1 668 . 17 1 1 A 59 59 LYS N N 59 123.380 123.200 0.180 1
1 669 . 17 1 1 A 60 60 SER H H 60 8.450 9.082 -0.632 1
1 670 . 17 1 1 A 60 60 SER HA H 60 4.480 4.157 0.323 1
1 673 . 17 1 1 A 60 60 SER C C 60 174.280 176.746 -2.466 1
1 674 . 17 1 1 A 60 60 SER CA C 60 58.140 61.531 -3.391 1
1 675 . 17 1 1 A 60 60 SER CB C 60 64.160 63.123 1.037 1
1 676 . 17 1 1 A 60 60 SER N N 60 117.320 118.736 -1.416 1
1 677 . 17 1 1 A 61 61 GLU H H 61 8.550 8.067 0.483 1
1 678 . 17 1 1 A 61 61 GLU HA H 61 4.400 4.230 0.170 1
1 683 . 17 1 1 A 61 61 GLU C C 61 176.150 176.600 -0.450 1
1 684 . 17 1 1 A 61 61 GLU CA C 61 56.300 59.157 -2.857 1
1 685 . 17 1 1 A 61 61 GLU CB C 61 30.790 30.098 0.692 1
1 687 . 17 1 1 A 61 61 GLU N N 61 122.810 119.079 3.731 1
1 688 . 17 1 1 A 62 62 ARG H H 62 8.310 7.555 0.755 1
1 689 . 17 1 1 A 62 62 ARG HA H 62 4.340 4.603 -0.263 1
1 692 . 17 1 1 A 62 62 ARG C C 62 176.140 174.469 1.671 1
1 693 . 17 1 1 A 62 62 ARG CA C 62 56.230 54.428 1.802 1
1 694 . 17 1 1 A 62 62 ARG CB C 62 30.780 33.501 -2.721 1
1 695 . 17 1 1 A 62 62 ARG N N 62 122.080 117.977 4.103 1
1 696 . 17 1 1 A 63 63 LYS H H 63 8.470 8.522 -0.052 1
1 697 . 17 1 1 A 63 63 LYS HA H 63 4.300 4.835 -0.535 1
1 700 . 17 1 1 A 63 63 LYS C C 63 175.490 175.557 -0.067 1
1 701 . 17 1 1 A 63 63 LYS CA C 63 56.200 55.011 1.189 1
1 702 . 17 1 1 A 63 63 LYS CB C 63 30.730 33.794 -3.064 1
1 703 . 17 1 1 A 63 63 LYS N N 63 123.450 121.865 1.585 1
1 704 . 17 1 1 A 64 64 PHE H H 64 8.200 9.095 -0.895 1
1 705 . 17 1 1 A 64 64 PHE HA H 64 4.450 4.945 -0.495 1
1 710 . 17 1 1 A 64 64 PHE C C 64 174.250 173.969 0.281 1
1 711 . 17 1 1 A 64 64 PHE CA C 64 57.430 56.436 0.994 1
1 712 . 17 1 1 A 64 64 PHE CB C 64 40.330 43.058 -2.728 1
1 715 . 17 1 1 A 64 64 PHE N N 64 121.740 122.602 -0.862 1
1 716 . 17 1 1 A 65 65 PHE H H 65 8.130 8.149 -0.019 1
1 717 . 17 1 1 A 65 65 PHE HA H 65 4.440 5.395 -0.955 1
1 725 . 17 1 1 A 65 65 PHE CA C 65 55.650 54.513 1.137 1
1 726 . 17 1 1 A 65 65 PHE CB C 65 38.900 39.342 -0.442 1
1 731 . 17 1 1 A 65 65 PHE N N 65 120.910 117.792 3.118 1
1 732 . 17 1 1 A 66 66 PRO C C 66 176.780 177.436 -0.656 1
1 733 . 17 1 1 A 67 67 GLY H H 67 9.970 8.864 1.106 1
1 734 . 17 1 1 A 67 67 GLY HA2 H 67 3.820 3.980 -0.160 1
1 735 . 17 1 1 A 67 67 GLY HA3 H 67 4.400 3.987 0.413 1
1 736 . 17 1 1 A 67 67 GLY C C 67 173.670 173.220 0.450 1
1 737 . 17 1 1 A 67 67 GLY CA C 67 45.900 45.512 0.388 1
1 738 . 17 1 1 A 67 67 GLY N N 67 111.550 111.218 0.332 1
1 739 . 17 1 1 A 68 68 TYR H H 68 7.650 7.888 -0.238 1
1 740 . 17 1 1 A 68 68 TYR HA H 68 5.000 4.920 0.080 1
1 747 . 17 1 1 A 68 68 TYR C C 68 175.220 174.318 0.902 1
1 748 . 17 1 1 A 68 68 TYR CA C 68 57.940 56.486 1.454 1
1 753 . 17 1 1 A 68 68 TYR N N 68 118.800 121.003 -2.203 1
1 754 . 17 1 1 A 69 69 VAL H H 69 9.090 8.300 0.790 1
1 755 . 17 1 1 A 69 69 VAL HA H 69 4.330 4.793 -0.463 1
1 763 . 17 1 1 A 69 69 VAL C C 69 174.250 174.681 -0.431 1
1 764 . 17 1 1 A 69 69 VAL CA C 69 62.120 60.341 1.779 1
1 765 . 17 1 1 A 69 69 VAL CB C 69 35.240 35.947 -0.707 1
1 768 . 17 1 1 A 69 69 VAL N N 69 119.300 126.854 -7.554 1
1 769 . 17 1 1 A 70 70 LEU H H 70 9.190 8.583 0.607 1
1 770 . 17 1 1 A 70 70 LEU HA H 70 5.460 5.295 0.165 1
1 780 . 17 1 1 A 70 70 LEU C C 70 176.130 176.385 -0.255 1
1 781 . 17 1 1 A 70 70 LEU CA C 70 54.120 53.437 0.683 1
1 782 . 17 1 1 A 70 70 LEU CB C 70 43.330 43.866 -0.536 1
1 786 . 17 1 1 A 70 70 LEU N N 70 126.710 126.667 0.043 1
1 787 . 17 1 1 A 71 71 VAL H H 71 9.350 8.905 0.445 1
1 788 . 17 1 1 A 71 71 VAL HA H 71 5.040 4.793 0.247 1
1 796 . 17 1 1 A 71 71 VAL C C 71 173.670 174.732 -1.062 1
1 797 . 17 1 1 A 71 71 VAL CA C 71 61.090 61.413 -0.323 1
1 798 . 17 1 1 A 71 71 VAL CB C 71 35.800 35.471 0.329 1
1 801 . 17 1 1 A 71 71 VAL N N 71 121.920 123.913 -1.993 1
1 802 . 17 1 1 A 72 72 GLN H H 72 8.390 8.917 -0.527 1
1 803 . 17 1 1 A 72 72 GLN HA H 72 4.610 4.392 0.218 1
1 810 . 17 1 1 A 72 72 GLN C C 72 175.920 174.713 1.207 1
1 811 . 17 1 1 A 72 72 GLN CA C 72 53.810 55.398 -1.588 1
1 812 . 17 1 1 A 72 72 GLN CB C 72 28.850 28.682 0.168 1
1 814 . 17 1 1 A 72 72 GLN N N 72 130.760 128.023 2.737 1
1 816 . 17 1 1 A 73 73 MET H H 73 9.750 8.745 1.005 1
1 817 . 17 1 1 A 73 73 MET HA H 73 5.060 5.198 -0.138 1
1 825 . 17 1 1 A 73 73 MET C C 73 175.500 174.809 0.691 1
1 826 . 17 1 1 A 73 73 MET CA C 73 55.520 54.455 1.065 1
1 827 . 17 1 1 A 73 73 MET CB C 73 35.350 35.802 -0.452 1
1 830 . 17 1 1 A 73 73 MET N N 73 121.070 124.966 -3.896 1
1 831 . 17 1 1 A 74 74 VAL H H 74 8.530 8.255 0.275 1
1 832 . 17 1 1 A 74 74 VAL HA H 74 3.970 4.106 -0.136 1
1 840 . 17 1 1 A 74 74 VAL C C 74 174.900 176.011 -1.111 1
1 841 . 17 1 1 A 74 74 VAL CA C 74 62.150 62.717 -0.567 1
1 842 . 17 1 1 A 74 74 VAL CB C 74 32.480 31.785 0.695 1
1 845 . 17 1 1 A 74 74 VAL N N 74 124.120 124.075 0.045 1
1 846 . 17 1 1 A 75 75 MET H H 75 8.600 8.774 -0.174 1
1 847 . 17 1 1 A 75 75 MET HA H 75 4.360 3.970 0.390 1
1 855 . 17 1 1 A 75 75 MET C C 75 173.480 175.575 -2.095 1
1 856 . 17 1 1 A 75 75 MET CA C 75 53.830 55.990 -2.160 1
1 857 . 17 1 1 A 75 75 MET CB C 75 29.960 32.387 -2.427 1
1 860 . 17 1 1 A 75 75 MET N N 75 128.250 127.912 0.338 1
1 861 . 17 1 1 A 76 76 ASN H H 76 8.410 8.208 0.202 1
1 862 . 17 1 1 A 76 76 ASN HA H 76 4.540 5.001 -0.461 1
1 867 . 17 1 1 A 76 76 ASN C C 76 173.950 175.135 -1.185 1
1 868 . 17 1 1 A 76 76 ASN CA C 76 51.720 51.993 -0.273 1
1 869 . 17 1 1 A 76 76 ASN CB C 76 38.430 40.622 -2.192 1
1 870 . 17 1 1 A 76 76 ASN N N 76 127.500 123.169 4.331 1
1 872 . 17 1 1 A 77 77 ASP H H 77 8.470 8.983 -0.513 1
1 873 . 17 1 1 A 77 77 ASP HA H 77 4.410 4.287 0.123 1
1 876 . 17 1 1 A 77 77 ASP C C 77 178.530 178.450 0.080 1
1 877 . 17 1 1 A 77 77 ASP CA C 77 58.730 57.306 1.424 1
1 878 . 17 1 1 A 77 77 ASP CB C 77 40.940 40.257 0.683 1
1 879 . 17 1 1 A 77 77 ASP N N 77 117.090 121.341 -4.251 1
1 880 . 17 1 1 A 78 78 ALA H H 78 8.160 7.890 0.270 1
1 881 . 17 1 1 A 78 78 ALA HA H 78 4.350 4.095 0.255 1
1 885 . 17 1 1 A 78 78 ALA C C 78 181.250 179.877 1.373 1
1 886 . 17 1 1 A 78 78 ALA CA C 78 55.190 55.348 -0.158 1
1 887 . 17 1 1 A 78 78 ALA CB C 78 18.260 19.177 -0.917 1
1 888 . 17 1 1 A 78 78 ALA N N 78 122.500 124.153 -1.653 1
1 889 . 17 1 1 A 79 79 SER H H 79 9.320 8.741 0.579 1
1 890 . 17 1 1 A 79 79 SER HA H 79 4.290 4.325 -0.035 1
1 893 . 17 1 1 A 79 79 SER C C 79 176.570 176.747 -0.177 1
1 894 . 17 1 1 A 79 79 SER CA C 79 61.080 61.635 -0.555 1
1 895 . 17 1 1 A 79 79 SER CB C 79 62.200 62.334 -0.134 1
1 896 . 17 1 1 A 79 79 SER N N 79 119.280 112.419 6.861 1
1 897 . 17 1 1 A 80 80 TRP H H 80 8.900 8.454 0.446 1
1 898 . 17 1 1 A 80 80 TRP HA H 80 4.020 4.427 -0.407 1
1 907 . 17 1 1 A 80 80 TRP C C 80 178.210 177.823 0.387 1
1 908 . 17 1 1 A 80 80 TRP CA C 80 62.490 61.497 0.993 1
1 909 . 17 1 1 A 80 80 TRP CB C 80 29.800 29.419 0.381 1
1 915 . 17 1 1 A 80 80 TRP N N 80 125.870 123.891 1.979 1
1 917 . 17 1 1 A 81 81 HIS H H 81 8.190 8.271 -0.081 1
1 918 . 17 1 1 A 81 81 HIS HA H 81 3.930 4.278 -0.348 1
1 923 . 17 1 1 A 81 81 HIS C C 81 177.740 176.694 1.046 1
1 924 . 17 1 1 A 81 81 HIS CA C 81 61.020 59.968 1.052 1
1 925 . 17 1 1 A 81 81 HIS CB C 81 28.910 29.773 -0.863 1
1 927 . 17 1 1 A 81 81 HIS N N 81 114.080 119.652 -5.572 1
1 928 . 17 1 1 A 82 82 LEU H H 82 8.080 8.561 -0.481 1
1 929 . 17 1 1 A 82 82 LEU HA H 82 3.900 3.763 0.137 1
1 939 . 17 1 1 A 82 82 LEU C C 82 180.330 178.506 1.824 1
1 940 . 17 1 1 A 82 82 LEU CA C 82 58.590 58.249 0.341 1
1 941 . 17 1 1 A 82 82 LEU CB C 82 41.350 41.689 -0.339 1
1 945 . 17 1 1 A 82 82 LEU N N 82 121.320 120.558 0.762 1
1 946 . 17 1 1 A 83 83 VAL H H 83 8.000 8.472 -0.472 1
1 947 . 17 1 1 A 83 83 VAL HA H 83 3.210 3.342 -0.132 1
1 955 . 17 1 1 A 83 83 VAL C C 83 177.060 177.938 -0.878 1
1 956 . 17 1 1 A 83 83 VAL CA C 83 67.430 66.841 0.589 1
1 957 . 17 1 1 A 83 83 VAL CB C 83 31.680 31.260 0.420 1
1 960 . 17 1 1 A 83 83 VAL N N 83 118.850 119.337 -0.487 1
1 961 . 17 1 1 A 84 84 ARG H H 84 7.540 7.653 -0.113 1
1 962 . 17 1 1 A 84 84 ARG HA H 84 3.590 3.665 -0.075 1
1 969 . 17 1 1 A 84 84 ARG C C 84 177.240 178.084 -0.844 1
1 970 . 17 1 1 A 84 84 ARG CA C 84 56.050 59.578 -3.528 1
1 971 . 17 1 1 A 84 84 ARG CB C 84 28.190 29.464 -1.274 1
1 974 . 17 1 1 A 84 84 ARG N N 84 111.460 120.148 -8.688 1
1 975 . 17 1 1 A 85 85 SER H H 85 7.530 7.564 -0.034 1
1 976 . 17 1 1 A 85 85 SER HA H 85 4.280 3.980 0.300 1
1 979 . 17 1 1 A 85 85 SER C C 85 173.930 174.466 -0.536 1
1 980 . 17 1 1 A 85 85 SER CA C 85 59.220 61.123 -1.903 1
1 981 . 17 1 1 A 85 85 SER CB C 85 63.830 62.621 1.209 1
1 982 . 17 1 1 A 85 85 SER N N 85 113.660 114.180 -0.520 1
1 983 . 17 1 1 A 86 86 VAL H H 86 7.230 7.260 -0.030 1
1 984 . 17 1 1 A 86 86 VAL HA H 86 3.480 3.752 -0.272 1
1 992 . 17 1 1 A 86 86 VAL CA C 86 61.300 61.128 0.172 1
1 993 . 17 1 1 A 86 86 VAL CB C 86 31.780 32.134 -0.354 1
1 996 . 17 1 1 A 86 86 VAL N N 86 128.120 121.465 6.655 1
1 997 . 17 1 1 A 87 87 PRO HA H 87 4.140 4.347 -0.207 1
1 1004 . 17 1 1 A 87 87 PRO C C 87 176.400 176.693 -0.293 1
1 1005 . 17 1 1 A 87 87 PRO CA C 87 64.100 63.113 0.987 1
1 1006 . 17 1 1 A 87 87 PRO CB C 87 31.710 32.328 -0.618 1
1 1009 . 17 1 1 A 88 88 ARG H H 88 8.320 8.744 -0.424 1
1 1010 . 17 1 1 A 88 88 ARG HA H 88 3.030 4.020 -0.990 1
1 1017 . 17 1 1 A 88 88 ARG C C 88 174.630 174.682 -0.052 1
1 1018 . 17 1 1 A 88 88 ARG CA C 88 57.620 57.782 -0.162 1
1 1019 . 17 1 1 A 88 88 ARG CB C 88 26.960 28.002 -1.042 1
1 1022 . 17 1 1 A 88 88 ARG N N 88 111.360 115.944 -4.584 1
1 1023 . 17 1 1 A 89 89 VAL H H 89 7.390 7.884 -0.494 1
1 1024 . 17 1 1 A 89 89 VAL HA H 89 3.910 4.605 -0.695 1
1 1032 . 17 1 1 A 89 89 VAL C C 89 177.370 174.836 2.534 1
1 1033 . 17 1 1 A 89 89 VAL CA C 89 64.170 59.552 4.618 1
1 1034 . 17 1 1 A 89 89 VAL CB C 89 32.070 35.003 -2.933 1
1 1037 . 17 1 1 A 89 89 VAL N N 89 117.900 118.519 -0.619 1
1 1038 . 17 1 1 A 90 90 MET H H 90 9.290 8.418 0.872 1
1 1039 . 17 1 1 A 90 90 MET HA H 90 4.340 4.500 -0.160 1
1 1047 . 17 1 1 A 90 90 MET C C 90 175.800 175.700 0.100 1
1 1048 . 17 1 1 A 90 90 MET CA C 90 56.440 56.313 0.127 1
1 1049 . 17 1 1 A 90 90 MET CB C 90 34.160 33.888 0.272 1
1 1052 . 17 1 1 A 90 90 MET N N 90 128.200 125.684 2.516 1
1 1053 . 17 1 1 A 91 91 GLY H H 91 7.130 7.231 -0.101 1
1 1054 . 17 1 1 A 91 91 GLY HA2 H 91 3.340 3.866 -0.526 1
1 1055 . 17 1 1 A 91 91 GLY HA3 H 91 4.410 4.071 0.339 1
1 1056 . 17 1 1 A 91 91 GLY C C 91 170.920 171.665 -0.745 1
1 1057 . 17 1 1 A 91 91 GLY CA C 91 44.440 45.523 -1.083 1
1 1058 . 17 1 1 A 91 91 GLY N N 91 104.320 103.855 0.465 1
1 1059 . 17 1 1 A 92 92 PHE H H 92 8.790 8.674 0.116 1
1 1060 . 17 1 1 A 92 92 PHE HA H 92 5.270 5.132 0.138 1
1 1068 . 17 1 1 A 92 92 PHE C C 92 176.230 175.325 0.905 1
1 1069 . 17 1 1 A 92 92 PHE CA C 92 57.480 57.476 0.004 1
1 1070 . 17 1 1 A 92 92 PHE CB C 92 42.190 42.182 0.008 1
1 1075 . 17 1 1 A 92 92 PHE N N 92 118.770 120.211 -1.441 1
1 1076 . 17 1 1 A 93 93 ILE H H 93 8.800 8.680 0.120 1
1 1077 . 17 1 1 A 93 93 ILE HA H 93 4.310 5.054 -0.744 1
1 1087 . 17 1 1 A 93 93 ILE C C 93 176.380 175.721 0.659 1
1 1088 . 17 1 1 A 93 93 ILE CA C 93 60.480 59.888 0.592 1
1 1089 . 17 1 1 A 93 93 ILE CB C 93 38.010 40.517 -2.507 1
1 1093 . 17 1 1 A 93 93 ILE N N 93 122.300 122.019 0.281 1
1 1094 . 17 1 1 A 94 94 GLY H H 94 8.640 8.451 0.189 1
1 1095 . 17 1 1 A 94 94 GLY HA2 H 94 3.830 4.250 -0.420 1
1 1096 . 17 1 1 A 94 94 GLY HA3 H 94 4.600 4.277 0.323 1
1 1097 . 17 1 1 A 94 94 GLY C C 94 175.080 174.232 0.848 1
1 1098 . 17 1 1 A 94 94 GLY CA C 94 44.530 45.674 -1.144 1
1 1099 . 17 1 1 A 94 94 GLY N N 94 116.550 112.937 3.613 1
1 1100 . 17 1 1 A 95 95 GLY H H 95 8.900 8.757 0.143 1
1 1101 . 17 1 1 A 95 95 GLY HA2 H 95 3.970 3.763 0.207 1
1 1102 . 17 1 1 A 95 95 GLY HA3 H 95 4.370 3.767 0.603 1
1 1103 . 17 1 1 A 95 95 GLY C C 95 174.560 174.433 0.127 1
1 1104 . 17 1 1 A 95 95 GLY CA C 95 45.640 47.207 -1.567 1
1 1105 . 17 1 1 A 95 95 GLY N N 95 112.960 114.328 -1.368 1
1 1106 . 17 1 1 A 96 96 THR H H 96 7.830 8.007 -0.177 1
1 1107 . 17 1 1 A 96 96 THR HA H 96 4.720 4.924 -0.204 1
1 1112 . 17 1 1 A 96 96 THR C C 96 176.260 174.173 2.087 1
1 1113 . 17 1 1 A 96 96 THR CA C 96 60.360 59.972 0.388 1
1 1114 . 17 1 1 A 96 96 THR CB C 96 70.960 72.395 -1.435 1
1 1116 . 17 1 1 A 96 96 THR N N 96 113.350 109.729 3.621 1
1 1117 . 17 1 1 A 97 97 SER H H 97 8.850 8.787 0.063 1
1 1118 . 17 1 1 A 97 97 SER HA H 97 4.310 4.843 -0.533 1
1 1121 . 17 1 1 A 97 97 SER C C 97 175.570 174.366 1.204 1
1 1122 . 17 1 1 A 97 97 SER CA C 97 60.850 58.658 2.192 1
1 1123 . 17 1 1 A 97 97 SER CB C 97 63.000 63.765 -0.765 1
1 1124 . 17 1 1 A 97 97 SER N N 97 116.420 115.802 0.618 1
1 1125 . 17 1 1 A 98 98 ASP H H 98 8.360 7.926 0.434 1
1 1126 . 17 1 1 A 98 98 ASP HA H 98 4.310 5.024 -0.714 1
1 1129 . 17 1 1 A 98 98 ASP C C 98 175.380 175.914 -0.534 1
1 1130 . 17 1 1 A 98 98 ASP CA C 98 54.190 54.979 -0.789 1
1 1131 . 17 1 1 A 98 98 ASP CB C 98 40.740 43.630 -2.890 1
1 1132 . 17 1 1 A 98 98 ASP N N 98 116.320 119.368 -3.048 1
1 1133 . 17 1 1 A 99 99 ARG H H 99 7.450 7.441 0.009 1
1 1134 . 17 1 1 A 99 99 ARG HA H 99 4.350 4.687 -0.337 1
1 1141 . 17 1 1 A 99 99 ARG CA C 99 52.920 53.515 -0.595 1
1 1142 . 17 1 1 A 99 99 ARG CB C 99 30.340 30.910 -0.570 1
1 1145 . 17 1 1 A 99 99 ARG N N 99 119.960 118.682 1.278 1
1 1146 . 17 1 1 A 100 100 PRO HA H 100 4.750 4.525 0.225 1
1 1153 . 17 1 1 A 100 100 PRO C C 100 175.220 177.237 -2.017 1
1 1154 . 17 1 1 A 100 100 PRO CA C 100 62.680 62.750 -0.070 1
1 1155 . 17 1 1 A 100 100 PRO CB C 100 32.820 31.689 1.131 1
1 1158 . 17 1 1 A 101 101 ALA H H 101 7.210 8.388 -1.178 1
1 1159 . 17 1 1 A 101 101 ALA HA H 101 5.030 4.597 0.433 1
1 1163 . 17 1 1 A 101 101 ALA CA C 101 48.570 50.471 -1.901 1
1 1164 . 17 1 1 A 101 101 ALA CB C 101 19.660 17.896 1.764 1
1 1165 . 17 1 1 A 101 101 ALA N N 101 124.490 125.486 -0.996 1
1 1166 . 17 1 1 A 102 102 PRO HA H 102 4.440 4.262 0.178 1
1 1173 . 17 1 1 A 102 102 PRO C C 102 177.200 176.446 0.754 1
1 1174 . 17 1 1 A 102 102 PRO CA C 102 62.190 62.575 -0.385 1
1 1175 . 17 1 1 A 102 102 PRO CB C 102 32.310 32.607 -0.297 1
1 1178 . 17 1 1 A 103 103 ILE H H 103 8.550 7.682 0.868 1
1 1179 . 17 1 1 A 103 103 ILE HA H 103 4.630 4.824 -0.194 1
1 1189 . 17 1 1 A 103 103 ILE C C 103 175.460 175.348 0.112 1
1 1190 . 17 1 1 A 103 103 ILE CA C 103 59.730 58.572 1.158 1
1 1191 . 17 1 1 A 103 103 ILE CB C 103 40.140 41.936 -1.796 1
1 1195 . 17 1 1 A 103 103 ILE N N 103 115.670 116.175 -0.505 1
1 1196 . 17 1 1 A 104 104 SER H H 104 8.730 8.621 0.109 1
1 1197 . 17 1 1 A 104 104 SER HA H 104 4.500 4.531 -0.031 1
1 1200 . 17 1 1 A 104 104 SER C C 104 174.840 175.171 -0.331 1
1 1201 . 17 1 1 A 104 104 SER CA C 104 58.010 58.430 -0.420 1
1 1202 . 17 1 1 A 104 104 SER CB C 104 65.470 63.896 1.574 1
1 1203 . 17 1 1 A 104 104 SER N N 104 119.170 119.881 -0.711 1
1 1204 . 17 1 1 A 105 105 ASP H H 105 8.830 9.040 -0.210 1
1 1205 . 17 1 1 A 105 105 ASP HA H 105 4.200 4.282 -0.082 1
1 1208 . 17 1 1 A 105 105 ASP C C 105 178.520 178.317 0.203 1
1 1209 . 17 1 1 A 105 105 ASP CA C 105 57.870 57.954 -0.084 1
1 1210 . 17 1 1 A 105 105 ASP CB C 105 40.040 40.448 -0.408 1
1 1211 . 17 1 1 A 105 105 ASP N N 105 121.640 124.996 -3.356 1
1 1212 . 17 1 1 A 106 106 LYS H H 106 8.130 7.934 0.196 1
1 1213 . 17 1 1 A 106 106 LYS HA H 106 4.100 3.917 0.183 1
1 1222 . 17 1 1 A 106 106 LYS C C 106 179.400 178.749 0.651 1
1 1223 . 17 1 1 A 106 106 LYS CA C 106 58.980 59.314 -0.334 1
1 1224 . 17 1 1 A 106 106 LYS CB C 106 32.330 32.012 0.318 1
1 1228 . 17 1 1 A 106 106 LYS N N 106 118.300 120.843 -2.543 1
1 1229 . 17 1 1 A 107 107 GLU H H 107 7.670 7.876 -0.206 1
1 1230 . 17 1 1 A 107 107 GLU HA H 107 4.020 4.034 -0.014 1
1 1235 . 17 1 1 A 107 107 GLU C C 107 178.750 179.107 -0.357 1
1 1236 . 17 1 1 A 107 107 GLU CA C 107 59.210 59.194 0.016 1
1 1237 . 17 1 1 A 107 107 GLU CB C 107 29.780 29.408 0.372 1
1 1239 . 17 1 1 A 107 107 GLU N N 107 121.270 118.774 2.496 1
1 1240 . 17 1 1 A 108 108 VAL H H 108 7.790 7.692 0.098 1
1 1241 . 17 1 1 A 108 108 VAL HA H 108 3.050 3.482 -0.432 1
1 1249 . 17 1 1 A 108 108 VAL C C 108 177.550 177.649 -0.099 1
1 1250 . 17 1 1 A 108 108 VAL CA C 108 67.080 66.410 0.670 1
1 1251 . 17 1 1 A 108 108 VAL CB C 108 31.220 31.157 0.063 1
1 1254 . 17 1 1 A 108 108 VAL N N 108 120.940 120.265 0.675 1
1 1255 . 17 1 1 A 109 109 ASP H H 109 7.840 7.763 0.077 1
1 1256 . 17 1 1 A 109 109 ASP HA H 109 4.110 4.246 -0.136 1
1 1259 . 17 1 1 A 109 109 ASP C C 109 178.190 178.545 -0.355 1
1 1260 . 17 1 1 A 109 109 ASP CA C 109 57.470 57.096 0.374 1
1 1261 . 17 1 1 A 109 109 ASP CB C 109 40.480 40.077 0.403 1
1 1262 . 17 1 1 A 109 109 ASP N N 109 118.780 121.331 -2.551 1
1 1263 . 17 1 1 A 110 110 ALA H H 110 7.520 7.607 -0.087 1
1 1264 . 17 1 1 A 110 110 ALA HA H 110 4.110 4.436 -0.326 1
1 1268 . 17 1 1 A 110 110 ALA C C 110 180.550 179.905 0.645 1
1 1269 . 17 1 1 A 110 110 ALA CA C 110 54.880 54.993 -0.113 1
1 1270 . 17 1 1 A 110 110 ALA CB C 110 18.440 18.343 0.097 1
1 1271 . 17 1 1 A 110 110 ALA N N 110 120.640 122.891 -2.251 1
1 1272 . 17 1 1 A 111 111 ILE H H 111 7.840 7.591 0.249 1
1 1273 . 17 1 1 A 111 111 ILE HA H 111 3.580 3.388 0.192 1
1 1281 . 17 1 1 A 111 111 ILE C C 111 177.470 177.771 -0.301 1
1 1282 . 17 1 1 A 111 111 ILE CA C 111 64.620 64.898 -0.278 1
1 1283 . 17 1 1 A 111 111 ILE CB C 111 38.600 37.552 1.048 1
1 1286 . 17 1 1 A 111 111 ILE N N 111 119.840 119.286 0.554 1
1 1287 . 17 1 1 A 112 112 MET H H 112 8.100 7.964 0.136 1
1 1288 . 17 1 1 A 112 112 MET HA H 112 4.400 4.214 0.186 1
1 1296 . 17 1 1 A 112 112 MET C C 112 177.710 178.043 -0.333 1
1 1297 . 17 1 1 A 112 112 MET CA C 112 55.300 58.572 -3.272 1
1 1298 . 17 1 1 A 112 112 MET CB C 112 30.510 32.134 -1.624 1
1 1301 . 17 1 1 A 112 112 MET N N 112 115.180 120.831 -5.651 1
1 1302 . 17 1 1 A 113 113 ASN H H 113 8.070 7.924 0.146 1
1 1303 . 17 1 1 A 113 113 ASN HA H 113 4.570 4.499 0.071 1
1 1308 . 17 1 1 A 113 113 ASN C C 113 175.530 178.503 -2.973 1
1 1309 . 17 1 1 A 113 113 ASN CA C 113 54.420 56.088 -1.668 1
1 1310 . 17 1 1 A 113 113 ASN CB C 113 38.350 37.837 0.513 1
1 1311 . 17 1 1 A 113 113 ASN N N 113 117.190 116.468 0.722 1
1 1313 . 17 1 1 A 114 114 ARG H H 114 8.070 7.823 0.247 1
1 1314 . 17 1 1 A 114 114 ARG HA H 114 4.280 4.038 0.242 1
1 1321 . 17 1 1 A 114 114 ARG C C 114 176.620 178.596 -1.976 1
1 1322 . 17 1 1 A 114 114 ARG CA C 114 56.910 58.929 -2.019 1
1 1323 . 17 1 1 A 114 114 ARG CB C 114 30.370 29.834 0.536 1
1 1326 . 17 1 1 A 114 114 ARG N N 114 118.360 120.028 -1.668 1
1 1327 . 17 1 1 A 115 115 LEU H H 115 8.100 8.199 -0.099 1
1 1328 . 17 1 1 A 115 115 LEU HA H 115 4.310 3.962 0.348 1
1 1338 . 17 1 1 A 115 115 LEU C C 115 177.440 178.085 -0.645 1
1 1339 . 17 1 1 A 115 115 LEU CA C 115 55.440 58.108 -2.668 1
1 1340 . 17 1 1 A 115 115 LEU CB C 115 42.250 41.631 0.619 1
1 1344 . 17 1 1 A 115 115 LEU N N 115 120.580 120.199 0.381 1
1 1345 . 17 1 1 A 116 116 GLN H H 116 8.180 7.261 0.919 1
1 1346 . 17 1 1 A 116 116 GLN HA H 116 4.360 4.424 -0.064 1
1 1353 . 17 1 1 A 116 116 GLN C C 116 175.890 175.498 0.392 1
1 1354 . 17 1 1 A 116 116 GLN CA C 116 55.810 55.896 -0.086 1
1 1355 . 17 1 1 A 116 116 GLN CB C 116 29.500 29.136 0.364 1
1 1357 . 17 1 1 A 116 116 GLN N N 116 119.770 115.311 4.459 1
1 1358 . 17 1 1 A 117 117 GLN H H 117 8.350 7.996 0.354 1
1 1359 . 17 1 1 A 117 117 GLN HA H 117 4.380 4.777 -0.397 1
1 1366 . 17 1 1 A 117 117 GLN C C 117 176.130 174.996 1.134 1
1 1367 . 17 1 1 A 117 117 GLN CA C 117 55.810 55.198 0.612 1
1 1368 . 17 1 1 A 117 117 GLN CB C 117 29.500 30.462 -0.962 1
1 1370 . 17 1 1 A 117 117 GLN N N 117 121.440 121.404 0.036 1
1 1371 . 17 1 1 A 118 118 VAL H H 118 8.240 8.825 -0.585 1
1 1372 . 17 1 1 A 118 118 VAL HA H 118 4.120 4.802 -0.682 1
1 1380 . 17 1 1 A 118 118 VAL C C 118 176.650 175.593 1.057 1
1 1381 . 17 1 1 A 118 118 VAL CA C 118 62.720 59.439 3.281 1
1 1382 . 17 1 1 A 118 118 VAL CB C 118 32.730 35.269 -2.539 1
1 1385 . 17 1 1 A 118 118 VAL N N 118 121.250 120.020 1.230 1
1 1386 . 17 1 1 A 119 119 GLY H H 119 8.460 8.341 0.119 1
1 1387 . 17 1 1 A 119 119 GLY HA2 H 119 3.990 3.992 -0.002 1
1 1388 . 17 1 1 A 119 119 GLY HA3 H 119 3.990 3.994 -0.004 1
1 1389 . 17 1 1 A 119 119 GLY C C 119 173.770 175.262 -1.492 1
1 1390 . 17 1 1 A 119 119 GLY CA C 119 45.260 45.572 -0.312 1
1 1391 . 17 1 1 A 119 119 GLY N N 119 112.300 110.582 1.718 1
1 1392 . 17 1 1 A 120 120 ASP H H 120 8.230 7.823 0.407 1
1 1393 . 17 1 1 A 120 120 ASP HA H 120 4.580 4.350 0.230 1
1 1396 . 17 1 1 A 120 120 ASP C C 120 175.180 177.014 -1.834 1
1 1397 . 17 1 1 A 120 120 ASP CA C 120 54.340 56.677 -2.337 1
1 1398 . 17 1 1 A 120 120 ASP CB C 120 41.390 40.594 0.796 1
1 1399 . 17 1 1 A 120 120 ASP N N 120 120.420 119.682 0.738 1
1 1400 . 17 1 1 A 121 121 LYS H H 121 7.950 7.809 0.141 1
1 1401 . 17 1 1 A 121 121 LYS HA H 121 4.240 4.592 -0.352 1
1 1402 . 17 1 1 A 121 121 LYS CA C 121 53.620 53.787 -0.167 1
1 1403 . 17 1 1 A 121 121 LYS N N 121 119.110 115.530 3.580 1
1 1404 . 17 1 1 A 122 122 PRO HA H 122 4.410 4.642 -0.232 1
1 1405 . 17 1 1 A 122 122 PRO C C 122 176.560 176.551 0.009 1
1 1406 . 17 1 1 A 122 122 PRO CA C 122 63.130 64.148 -1.018 1
1 2 . 18 1 1 A 2 2 SER H H 2 7.890 8.955 -1.065 1
1 3 . 18 1 1 A 2 2 SER HA H 2 4.270 4.247 0.023 1
1 4 . 18 1 1 A 2 2 SER C C 2 173.960 174.184 -0.224 1
1 5 . 18 1 1 A 2 2 SER CA C 2 60.800 61.481 -0.681 1
1 6 . 18 1 1 A 2 2 SER N N 2 111.940 121.297 -9.357 1
1 7 . 18 1 1 A 3 3 GLU H H 3 8.010 7.780 0.230 1
1 8 . 18 1 1 A 3 3 GLU HA H 3 4.360 4.557 -0.197 1
1 9 . 18 1 1 A 3 3 GLU C C 3 175.710 176.115 -0.405 1
1 10 . 18 1 1 A 3 3 GLU CA C 3 56.310 55.376 0.934 1
1 11 . 18 1 1 A 3 3 GLU N N 3 121.280 118.898 2.382 1
1 12 . 18 1 1 A 4 4 ALA H H 4 8.540 8.516 0.024 1
1 13 . 18 1 1 A 4 4 ALA HA H 4 4.560 3.826 0.734 1
1 14 . 18 1 1 A 4 4 ALA CA C 4 50.630 52.813 -2.183 1
1 15 . 18 1 1 A 4 4 ALA N N 4 127.840 121.817 6.023 1
1 16 . 18 1 1 A 5 5 PRO HA H 5 4.420 4.742 -0.322 1
1 17 . 18 1 1 A 5 5 PRO C C 5 174.240 175.841 -1.601 1
1 18 . 18 1 1 A 5 5 PRO CA C 5 62.840 62.724 0.116 1
1 19 . 18 1 1 A 6 6 LYS H H 6 8.320 8.572 -0.252 1
1 20 . 18 1 1 A 6 6 LYS HA H 6 4.290 4.696 -0.406 1
1 21 . 18 1 1 A 6 6 LYS C C 6 176.100 175.303 0.797 1
1 22 . 18 1 1 A 6 6 LYS CA C 6 55.540 55.289 0.251 1
1 23 . 18 1 1 A 6 6 LYS N N 6 121.910 122.373 -0.463 1
1 24 . 18 1 1 A 7 7 LYS H H 7 8.450 8.574 -0.124 1
1 25 . 18 1 1 A 7 7 LYS HA H 7 3.940 3.902 0.038 1
1 26 . 18 1 1 A 7 7 LYS C C 7 175.700 175.202 0.498 1
1 27 . 18 1 1 A 7 7 LYS CA C 7 56.440 56.847 -0.407 1
1 28 . 18 1 1 A 7 7 LYS N N 7 122.250 122.335 -0.085 1
1 29 . 18 1 1 A 8 8 ARG H H 8 8.210 8.744 -0.534 1
1 30 . 18 1 1 A 8 8 ARG HA H 8 4.670 4.887 -0.217 1
1 31 . 18 1 1 A 8 8 ARG C C 8 173.760 174.309 -0.549 1
1 32 . 18 1 1 A 8 8 ARG CA C 8 53.420 53.777 -0.357 1
1 33 . 18 1 1 A 8 8 ARG N N 8 122.560 123.730 -1.170 1
1 34 . 18 1 1 A 9 9 TRP H H 9 8.610 8.481 0.129 1
1 35 . 18 1 1 A 9 9 TRP HA H 9 4.910 5.242 -0.332 1
1 44 . 18 1 1 A 9 9 TRP C C 9 174.610 174.964 -0.354 1
1 45 . 18 1 1 A 9 9 TRP CA C 9 57.630 55.197 2.433 1
1 46 . 18 1 1 A 9 9 TRP CB C 9 31.020 31.748 -0.728 1
1 52 . 18 1 1 A 9 9 TRP N N 9 120.540 119.632 0.908 1
1 54 . 18 1 1 A 10 10 TYR H H 10 9.260 8.794 0.466 1
1 55 . 18 1 1 A 10 10 TYR HA H 10 4.820 5.125 -0.305 1
1 62 . 18 1 1 A 10 10 TYR C C 10 174.340 174.994 -0.654 1
1 63 . 18 1 1 A 10 10 TYR CA C 10 57.050 56.297 0.753 1
1 64 . 18 1 1 A 10 10 TYR CB C 10 41.920 42.156 -0.236 1
1 69 . 18 1 1 A 10 10 TYR N N 10 118.990 122.020 -3.030 1
1 70 . 18 1 1 A 11 11 VAL H H 11 9.450 9.093 0.357 1
1 71 . 18 1 1 A 11 11 VAL HA H 11 4.470 4.631 -0.161 1
1 79 . 18 1 1 A 11 11 VAL C C 11 175.030 175.343 -0.313 1
1 80 . 18 1 1 A 11 11 VAL CA C 11 62.320 61.743 0.577 1
1 81 . 18 1 1 A 11 11 VAL CB C 11 32.400 32.938 -0.538 1
1 84 . 18 1 1 A 11 11 VAL N N 11 120.930 123.677 -2.747 1
1 85 . 18 1 1 A 12 12 VAL H H 12 9.320 10.116 -0.796 1
1 86 . 18 1 1 A 12 12 VAL HA H 12 3.940 4.379 -0.439 1
1 94 . 18 1 1 A 12 12 VAL C C 12 173.870 174.814 -0.944 1
1 95 . 18 1 1 A 12 12 VAL CA C 12 61.330 60.923 0.407 1
1 96 . 18 1 1 A 12 12 VAL CB C 12 33.500 34.113 -0.613 1
1 99 . 18 1 1 A 12 12 VAL N N 12 128.860 128.567 0.293 1
1 100 . 18 1 1 A 13 13 GLN H H 13 8.830 8.160 0.670 1
1 101 . 18 1 1 A 13 13 GLN HA H 13 4.710 4.384 0.326 1
1 108 . 18 1 1 A 13 13 GLN C C 13 174.230 175.417 -1.187 1
1 109 . 18 1 1 A 13 13 GLN CA C 13 54.800 55.691 -0.891 1
1 110 . 18 1 1 A 13 13 GLN CB C 13 29.450 29.544 -0.094 1
1 111 . 18 1 1 A 13 13 GLN N N 13 126.050 126.461 -0.411 1
1 113 . 18 1 1 A 14 14 ALA H H 14 9.420 8.505 0.915 1
1 114 . 18 1 1 A 14 14 ALA HA H 14 5.150 4.745 0.405 1
1 118 . 18 1 1 A 14 14 ALA C C 14 176.400 176.130 0.270 1
1 119 . 18 1 1 A 14 14 ALA CA C 14 49.660 51.127 -1.467 1
1 120 . 18 1 1 A 14 14 ALA CB C 14 22.840 22.924 -0.084 1
1 121 . 18 1 1 A 14 14 ALA N N 14 131.620 122.068 9.552 1
1 122 . 18 1 1 A 15 15 PHE H H 15 8.070 8.780 -0.710 1
1 123 . 18 1 1 A 15 15 PHE HA H 15 4.410 4.716 -0.306 1
1 128 . 18 1 1 A 15 15 PHE C C 15 176.130 175.786 0.344 1
1 129 . 18 1 1 A 15 15 PHE CA C 15 58.550 58.869 -0.319 1
1 130 . 18 1 1 A 15 15 PHE CB C 15 39.780 39.542 0.238 1
1 133 . 18 1 1 A 15 15 PHE N N 15 119.680 119.730 -0.050 1
1 134 . 18 1 1 A 16 16 SER H H 16 8.370 8.939 -0.569 1
1 135 . 18 1 1 A 16 16 SER HA H 16 4.140 4.139 0.001 1
1 138 . 18 1 1 A 16 16 SER C C 16 175.820 175.656 0.164 1
1 139 . 18 1 1 A 16 16 SER CA C 16 60.570 60.593 -0.023 1
1 140 . 18 1 1 A 16 16 SER CB C 16 63.030 63.047 -0.017 1
1 141 . 18 1 1 A 16 16 SER N N 16 119.700 119.800 -0.100 1
1 142 . 18 1 1 A 17 17 GLY H H 17 9.130 8.784 0.346 1
1 143 . 18 1 1 A 17 17 GLY HA2 H 17 3.640 3.714 -0.074 1
1 144 . 18 1 1 A 17 17 GLY HA3 H 17 4.200 3.819 0.381 1
1 145 . 18 1 1 A 17 17 GLY C C 17 175.520 174.880 0.640 1
1 146 . 18 1 1 A 17 17 GLY CA C 17 45.260 45.256 0.004 1
1 147 . 18 1 1 A 17 17 GLY N N 17 115.850 113.533 2.317 1
1 148 . 18 1 1 A 18 18 PHE H H 18 8.480 7.887 0.593 1
1 149 . 18 1 1 A 18 18 PHE HA H 18 4.740 4.596 0.144 1
1 154 . 18 1 1 A 18 18 PHE C C 18 175.430 176.337 -0.907 1
1 155 . 18 1 1 A 18 18 PHE CA C 18 58.240 58.320 -0.080 1
1 156 . 18 1 1 A 18 18 PHE CB C 18 39.010 38.608 0.402 1
1 159 . 18 1 1 A 18 18 PHE N N 18 118.550 119.792 -1.242 1
1 160 . 18 1 1 A 19 19 GLU H H 19 10.690 8.305 2.385 1
1 161 . 18 1 1 A 19 19 GLU HA H 19 3.490 4.093 -0.603 1
1 166 . 18 1 1 A 19 19 GLU C C 19 177.650 179.132 -1.482 1
1 167 . 18 1 1 A 19 19 GLU CA C 19 62.280 59.870 2.410 1
1 168 . 18 1 1 A 19 19 GLU CB C 19 28.380 29.584 -1.204 1
1 170 . 18 1 1 A 19 19 GLU N N 19 123.470 123.138 0.332 1
1 171 . 18 1 1 A 20 20 GLY H H 20 8.740 8.202 0.538 1
1 172 . 18 1 1 A 20 20 GLY HA2 H 20 3.840 3.848 -0.008 1
1 173 . 18 1 1 A 20 20 GLY HA3 H 20 3.940 3.863 0.077 1
1 174 . 18 1 1 A 20 20 GLY C C 20 176.860 175.771 1.089 1
1 175 . 18 1 1 A 20 20 GLY CA C 20 47.140 46.868 0.272 1
1 176 . 18 1 1 A 20 20 GLY N N 20 105.480 107.664 -2.184 1
1 177 . 18 1 1 A 21 21 ARG H H 21 7.690 8.264 -0.574 1
1 178 . 18 1 1 A 21 21 ARG HA H 21 4.180 4.165 0.015 1
1 185 . 18 1 1 A 21 21 ARG C C 21 179.490 178.385 1.105 1
1 186 . 18 1 1 A 21 21 ARG CA C 21 58.660 58.945 -0.285 1
1 187 . 18 1 1 A 21 21 ARG CB C 21 30.100 29.970 0.130 1
1 190 . 18 1 1 A 21 21 ARG N N 21 123.120 122.113 1.007 1
1 191 . 18 1 1 A 22 22 VAL H H 22 8.980 9.003 -0.023 1
1 192 . 18 1 1 A 22 22 VAL HA H 22 3.560 3.713 -0.153 1
1 200 . 18 1 1 A 22 22 VAL C C 22 177.320 178.355 -1.035 1
1 201 . 18 1 1 A 22 22 VAL CA C 22 66.960 66.402 0.558 1
1 202 . 18 1 1 A 22 22 VAL CB C 22 31.050 31.441 -0.391 1
1 205 . 18 1 1 A 22 22 VAL N N 22 122.760 119.399 3.361 1
1 206 . 18 1 1 A 23 23 ALA H H 23 8.280 7.885 0.395 1
1 207 . 18 1 1 A 23 23 ALA HA H 23 3.850 4.084 -0.234 1
1 211 . 18 1 1 A 23 23 ALA C C 23 179.340 179.479 -0.139 1
1 212 . 18 1 1 A 23 23 ALA CA C 23 56.260 55.229 1.031 1
1 213 . 18 1 1 A 23 23 ALA CB C 23 18.260 18.398 -0.138 1
1 214 . 18 1 1 A 23 23 ALA N N 23 122.120 121.971 0.149 1
1 215 . 18 1 1 A 24 24 THR H H 24 8.020 7.436 0.584 1
1 216 . 18 1 1 A 24 24 THR HA H 24 3.920 4.001 -0.081 1
1 221 . 18 1 1 A 24 24 THR C C 24 176.940 176.609 0.331 1
1 222 . 18 1 1 A 24 24 THR CA C 24 66.820 66.692 0.128 1
1 223 . 18 1 1 A 24 24 THR CB C 24 68.930 68.287 0.643 1
1 225 . 18 1 1 A 24 24 THR N N 24 113.410 115.284 -1.874 1
1 226 . 18 1 1 A 25 25 SER H H 25 8.570 7.781 0.789 1
1 227 . 18 1 1 A 25 25 SER HA H 25 4.400 4.064 0.336 1
1 230 . 18 1 1 A 25 25 SER C C 25 177.610 176.289 1.321 1
1 231 . 18 1 1 A 25 25 SER CA C 25 61.920 62.498 -0.578 1
1 232 . 18 1 1 A 25 25 SER CB C 25 63.540 62.895 0.645 1
1 233 . 18 1 1 A 25 25 SER N N 25 118.260 117.676 0.584 1
1 234 . 18 1 1 A 26 26 LEU H H 26 9.430 7.896 1.534 1
1 235 . 18 1 1 A 26 26 LEU HA H 26 3.900 3.995 -0.095 1
1 245 . 18 1 1 A 26 26 LEU C C 26 177.710 178.677 -0.967 1
1 246 . 18 1 1 A 26 26 LEU CA C 26 58.910 58.149 0.761 1
1 247 . 18 1 1 A 26 26 LEU CB C 26 41.300 41.395 -0.095 1
1 251 . 18 1 1 A 26 26 LEU N N 26 124.120 121.429 2.691 1
1 252 . 18 1 1 A 27 27 ARG H H 27 7.790 7.508 0.282 1
1 253 . 18 1 1 A 27 27 ARG HA H 27 3.880 3.735 0.145 1
1 260 . 18 1 1 A 27 27 ARG C C 27 179.380 178.717 0.663 1
1 261 . 18 1 1 A 27 27 ARG CA C 27 60.510 59.377 1.133 1
1 262 . 18 1 1 A 27 27 ARG CB C 27 29.670 29.663 0.007 1
1 265 . 18 1 1 A 27 27 ARG N N 27 116.710 119.510 -2.800 1
1 266 . 18 1 1 A 28 28 GLU H H 28 7.900 7.480 0.420 1
1 267 . 18 1 1 A 28 28 GLU HA H 28 4.070 3.952 0.118 1
1 272 . 18 1 1 A 28 28 GLU C C 28 179.450 179.024 0.426 1
1 273 . 18 1 1 A 28 28 GLU CA C 28 59.450 58.977 0.473 1
1 274 . 18 1 1 A 28 28 GLU CB C 28 29.610 29.198 0.412 1
1 276 . 18 1 1 A 28 28 GLU N N 28 118.340 118.566 -0.226 1
1 277 . 18 1 1 A 29 29 HIS H H 29 8.940 7.769 1.171 1
1 278 . 18 1 1 A 29 29 HIS HA H 29 4.160 4.405 -0.245 1
1 283 . 18 1 1 A 29 29 HIS C C 29 177.750 177.707 0.043 1
1 284 . 18 1 1 A 29 29 HIS CA C 29 61.260 58.928 2.332 1
1 285 . 18 1 1 A 29 29 HIS CB C 29 29.870 30.209 -0.339 1
1 287 . 18 1 1 A 29 29 HIS N N 29 120.440 118.521 1.919 1
1 288 . 18 1 1 A 30 30 ILE H H 30 8.580 8.849 -0.269 1
1 289 . 18 1 1 A 30 30 ILE HA H 30 3.160 3.613 -0.453 1
1 299 . 18 1 1 A 30 30 ILE C C 30 177.230 178.078 -0.848 1
1 300 . 18 1 1 A 30 30 ILE CA C 30 66.460 65.276 1.184 1
1 301 . 18 1 1 A 30 30 ILE CB C 30 38.630 37.654 0.976 1
1 305 . 18 1 1 A 30 30 ILE N N 30 121.010 119.739 1.271 1
1 306 . 18 1 1 A 31 31 LYS H H 31 7.020 8.574 -1.554 1
1 307 . 18 1 1 A 31 31 LYS HA H 31 4.170 4.024 0.146 1
1 316 . 18 1 1 A 31 31 LYS C C 31 180.570 178.709 1.861 1
1 317 . 18 1 1 A 31 31 LYS CA C 31 58.920 59.981 -1.061 1
1 318 . 18 1 1 A 31 31 LYS CB C 31 32.490 31.901 0.589 1
1 322 . 18 1 1 A 31 31 LYS N N 31 117.400 120.806 -3.406 1
1 323 . 18 1 1 A 32 32 LEU H H 32 8.400 8.584 -0.184 1
1 324 . 18 1 1 A 32 32 LEU HA H 32 3.990 3.917 0.073 1
1 334 . 18 1 1 A 32 32 LEU C C 32 178.230 178.900 -0.670 1
1 335 . 18 1 1 A 32 32 LEU CA C 32 57.700 58.033 -0.333 1
1 336 . 18 1 1 A 32 32 LEU CB C 32 42.540 41.878 0.662 1
1 340 . 18 1 1 A 32 32 LEU N N 32 121.180 119.643 1.537 1
1 341 . 18 1 1 A 33 33 HIS H H 33 7.620 8.239 -0.619 1
1 342 . 18 1 1 A 33 33 HIS HA H 33 4.600 4.610 -0.010 1
1 347 . 18 1 1 A 33 33 HIS C C 33 177.090 174.567 2.523 1
1 348 . 18 1 1 A 33 33 HIS CA C 33 55.840 57.377 -1.537 1
1 349 . 18 1 1 A 33 33 HIS CB C 33 29.330 29.735 -0.405 1
1 351 . 18 1 1 A 33 33 HIS N N 33 112.220 116.137 -3.917 1
1 352 . 18 1 1 A 34 34 ASN H H 34 8.030 8.228 -0.198 1
1 353 . 18 1 1 A 34 34 ASN HA H 34 4.890 4.421 0.469 1
1 358 . 18 1 1 A 34 34 ASN C C 34 175.910 175.548 0.362 1
1 359 . 18 1 1 A 34 34 ASN CA C 34 54.530 54.480 0.050 1
1 360 . 18 1 1 A 34 34 ASN CB C 34 37.380 36.562 0.818 1
1 361 . 18 1 1 A 34 34 ASN N N 34 117.600 114.289 3.311 1
1 363 . 18 1 1 A 35 35 MET H H 35 8.330 8.218 0.112 1
1 364 . 18 1 1 A 35 35 MET HA H 35 4.940 4.772 0.168 1
1 372 . 18 1 1 A 35 35 MET C C 35 176.880 176.789 0.091 1
1 373 . 18 1 1 A 35 35 MET CA C 35 55.600 54.695 0.905 1
1 374 . 18 1 1 A 35 35 MET CB C 35 33.790 32.702 1.088 1
1 377 . 18 1 1 A 35 35 MET N N 35 116.190 116.251 -0.061 1
1 378 . 18 1 1 A 36 36 GLU H H 36 9.730 8.138 1.592 1
1 379 . 18 1 1 A 36 36 GLU HA H 36 3.850 4.145 -0.295 1
1 384 . 18 1 1 A 36 36 GLU C C 36 178.290 179.477 -1.187 1
1 385 . 18 1 1 A 36 36 GLU CA C 36 61.280 59.428 1.852 1
1 386 . 18 1 1 A 36 36 GLU CB C 36 29.270 29.286 -0.016 1
1 388 . 18 1 1 A 36 36 GLU N N 36 121.630 120.415 1.215 1
1 389 . 18 1 1 A 37 37 ASP H H 37 8.850 8.284 0.566 1
1 390 . 18 1 1 A 37 37 ASP HA H 37 4.470 4.497 -0.027 1
1 393 . 18 1 1 A 37 37 ASP C C 37 177.190 178.396 -1.206 1
1 394 . 18 1 1 A 37 37 ASP CA C 37 56.140 57.306 -1.166 1
1 395 . 18 1 1 A 37 37 ASP CB C 37 40.050 40.663 -0.613 1
1 396 . 18 1 1 A 37 37 ASP N N 37 114.390 120.384 -5.994 1
1 397 . 18 1 1 A 38 38 LEU H H 38 7.880 7.938 -0.058 1
1 398 . 18 1 1 A 38 38 LEU HA H 38 4.290 4.330 -0.040 1
1 408 . 18 1 1 A 38 38 LEU C C 38 175.090 177.121 -2.031 1
1 409 . 18 1 1 A 38 38 LEU CA C 38 54.670 56.560 -1.890 1
1 410 . 18 1 1 A 38 38 LEU CB C 38 42.940 42.288 0.652 1
1 414 . 18 1 1 A 38 38 LEU N N 38 116.550 113.315 3.235 1
1 415 . 18 1 1 A 39 39 PHE H H 39 7.500 7.906 -0.406 1
1 416 . 18 1 1 A 39 39 PHE HA H 39 4.970 4.451 0.519 1
1 424 . 18 1 1 A 39 39 PHE C C 39 175.380 175.459 -0.079 1
1 425 . 18 1 1 A 39 39 PHE CA C 39 57.580 58.176 -0.596 1
1 426 . 18 1 1 A 39 39 PHE CB C 39 44.990 39.891 5.099 1
1 432 . 18 1 1 A 39 39 PHE N N 39 115.370 119.851 -4.481 1
1 433 . 18 1 1 A 40 40 GLY H H 40 8.680 8.232 0.448 1
1 434 . 18 1 1 A 40 40 GLY HA2 H 40 3.370 3.991 -0.621 1
1 435 . 18 1 1 A 40 40 GLY HA3 H 40 4.550 4.075 0.475 1
1 436 . 18 1 1 A 40 40 GLY C C 40 173.090 173.693 -0.603 1
1 437 . 18 1 1 A 40 40 GLY CA C 40 44.180 46.069 -1.889 1
1 438 . 18 1 1 A 40 40 GLY N N 40 110.930 111.218 -0.288 1
1 439 . 18 1 1 A 41 41 GLU H H 41 8.320 7.752 0.568 1
1 440 . 18 1 1 A 41 41 GLU HA H 41 4.280 4.908 -0.628 1
1 445 . 18 1 1 A 41 41 GLU C C 41 173.900 175.492 -1.592 1
1 446 . 18 1 1 A 41 41 GLU CA C 41 56.900 54.517 2.383 1
1 447 . 18 1 1 A 41 41 GLU CB C 41 32.110 34.033 -1.923 1
1 449 . 18 1 1 A 41 41 GLU N N 41 126.730 117.515 9.215 1
1 450 . 18 1 1 A 42 42 VAL H H 42 8.100 8.664 -0.564 1
1 451 . 18 1 1 A 42 42 VAL HA H 42 5.160 5.109 0.051 1
1 459 . 18 1 1 A 42 42 VAL C C 42 176.340 175.125 1.215 1
1 460 . 18 1 1 A 42 42 VAL CA C 42 61.200 60.367 0.833 1
1 461 . 18 1 1 A 42 42 VAL CB C 42 34.770 35.364 -0.594 1
1 464 . 18 1 1 A 42 42 VAL N N 42 119.360 121.174 -1.814 1
1 465 . 18 1 1 A 43 43 MET H H 43 9.870 9.923 -0.053 1
1 466 . 18 1 1 A 43 43 MET HA H 43 5.070 5.354 -0.284 1
1 474 . 18 1 1 A 43 43 MET C C 43 173.890 175.415 -1.525 1
1 475 . 18 1 1 A 43 43 MET CA C 43 54.740 53.969 0.771 1
1 476 . 18 1 1 A 43 43 MET CB C 43 37.500 35.575 1.925 1
1 479 . 18 1 1 A 43 43 MET N N 43 125.720 123.881 1.839 1
1 480 . 18 1 1 A 44 44 VAL H H 44 8.800 9.047 -0.247 1
1 481 . 18 1 1 A 44 44 VAL HA H 44 4.720 4.865 -0.145 1
1 489 . 18 1 1 A 44 44 VAL CA C 44 59.090 59.102 -0.012 1
1 490 . 18 1 1 A 44 44 VAL CB C 44 33.710 32.569 1.141 1
1 493 . 18 1 1 A 44 44 VAL N N 44 122.340 124.255 -1.915 1
1 494 . 18 1 1 A 45 45 PRO HA H 45 4.480 4.667 -0.187 1
1 501 . 18 1 1 A 45 45 PRO C C 45 177.080 174.998 2.082 1
1 502 . 18 1 1 A 45 45 PRO CA C 45 63.240 62.538 0.702 1
1 503 . 18 1 1 A 45 45 PRO CB C 45 32.170 29.167 3.003 1
1 506 . 18 1 1 A 46 46 THR H H 46 8.200 8.420 -0.220 1
1 507 . 18 1 1 A 46 46 THR HA H 46 4.290 4.924 -0.634 1
1 512 . 18 1 1 A 46 46 THR C C 46 174.600 174.631 -0.031 1
1 513 . 18 1 1 A 46 46 THR CA C 46 62.100 59.772 2.328 1
1 514 . 18 1 1 A 46 46 THR CB C 46 69.990 71.157 -1.167 1
1 516 . 18 1 1 A 46 46 THR N N 46 113.410 116.869 -3.459 1
1 517 . 18 1 1 A 47 47 GLU H H 47 8.380 9.185 -0.805 1
1 518 . 18 1 1 A 47 47 GLU HA H 47 4.400 4.013 0.387 1
1 521 . 18 1 1 A 47 47 GLU C C 47 175.970 178.719 -2.749 1
1 522 . 18 1 1 A 47 47 GLU CA C 47 55.200 59.891 -4.691 1
1 523 . 18 1 1 A 47 47 GLU CB C 47 32.300 29.312 2.988 1
1 524 . 18 1 1 A 47 47 GLU N N 47 122.830 128.204 -5.374 1
1 525 . 18 1 1 A 48 48 GLU H H 48 8.400 8.239 0.161 1
1 526 . 18 1 1 A 48 48 GLU HA H 48 4.280 4.056 0.224 1
1 531 . 18 1 1 A 48 48 GLU C C 48 175.750 178.535 -2.785 1
1 532 . 18 1 1 A 48 48 GLU CA C 48 55.190 59.219 -4.029 1
1 533 . 18 1 1 A 48 48 GLU CB C 48 31.980 29.481 2.499 1
1 535 . 18 1 1 A 48 48 GLU N N 48 121.950 119.964 1.986 1
1 536 . 18 1 1 A 49 49 VAL H H 49 8.240 7.794 0.446 1
1 537 . 18 1 1 A 49 49 VAL HA H 49 4.170 3.892 0.278 1
1 542 . 18 1 1 A 49 49 VAL C C 49 174.610 175.190 -0.580 1
1 543 . 18 1 1 A 49 49 VAL CA C 49 62.280 64.894 -2.614 1
1 544 . 18 1 1 A 49 49 VAL CB C 49 32.930 31.743 1.187 1
1 546 . 18 1 1 A 49 49 VAL N N 49 123.990 118.613 5.377 1
1 547 . 18 1 1 A 50 50 VAL H H 50 8.230 8.309 -0.079 1
1 548 . 18 1 1 A 50 50 VAL HA H 50 4.220 4.472 -0.252 1
1 553 . 18 1 1 A 50 50 VAL C C 50 175.770 174.453 1.317 1
1 554 . 18 1 1 A 50 50 VAL CA C 50 62.170 61.100 1.070 1
1 555 . 18 1 1 A 50 50 VAL CB C 50 33.110 33.862 -0.752 1
1 557 . 18 1 1 A 50 50 VAL N N 50 123.960 119.961 3.999 1
1 558 . 18 1 1 A 51 51 GLU H H 51 8.570 8.958 -0.388 1
1 559 . 18 1 1 A 51 51 GLU HA H 51 4.380 5.061 -0.681 1
1 564 . 18 1 1 A 51 51 GLU C C 51 175.920 175.295 0.625 1
1 565 . 18 1 1 A 51 51 GLU CA C 51 56.050 55.289 0.761 1
1 566 . 18 1 1 A 51 51 GLU CB C 51 31.080 31.516 -0.436 1
1 568 . 18 1 1 A 51 51 GLU N N 51 125.070 127.162 -2.092 1
1 569 . 18 1 1 A 52 52 ILE H H 52 8.320 8.694 -0.374 1
1 570 . 18 1 1 A 52 52 ILE HA H 52 4.290 4.764 -0.474 1
1 580 . 18 1 1 A 52 52 ILE C C 52 176.330 174.809 1.521 1
1 581 . 18 1 1 A 52 52 ILE CA C 52 60.940 58.970 1.970 1
1 582 . 18 1 1 A 52 52 ILE CB C 52 38.510 41.113 -2.603 1
1 586 . 18 1 1 A 52 52 ILE N N 52 122.760 120.345 2.415 1
1 587 . 18 1 1 A 53 53 ARG H H 53 8.500 8.526 -0.026 1
1 588 . 18 1 1 A 53 53 ARG HA H 53 4.430 4.228 0.202 1
1 595 . 18 1 1 A 53 53 ARG C C 53 176.950 176.982 -0.032 1
1 596 . 18 1 1 A 53 53 ARG CA C 53 56.150 57.383 -1.233 1
1 597 . 18 1 1 A 53 53 ARG CB C 53 30.200 30.757 -0.557 1
1 600 . 18 1 1 A 53 53 ARG N N 53 125.250 126.624 -1.374 1
1 601 . 18 1 1 A 54 54 GLY H H 54 8.760 8.572 0.188 1
1 602 . 18 1 1 A 54 54 GLY HA2 H 54 3.920 3.966 -0.046 1
1 603 . 18 1 1 A 54 54 GLY HA3 H 54 4.010 3.967 0.043 1
1 604 . 18 1 1 A 54 54 GLY C C 54 175.110 175.892 -0.782 1
1 605 . 18 1 1 A 54 54 GLY CA C 54 46.030 46.709 -0.679 1
1 606 . 18 1 1 A 54 54 GLY N N 54 112.510 110.268 2.242 1
1 607 . 18 1 1 A 55 55 GLY H H 55 8.350 8.818 -0.468 1
1 608 . 18 1 1 A 55 55 GLY HA2 H 55 3.980 3.882 0.098 1
1 609 . 18 1 1 A 55 55 GLY HA3 H 55 3.980 3.882 0.098 1
1 610 . 18 1 1 A 55 55 GLY C C 55 173.920 174.376 -0.456 1
1 611 . 18 1 1 A 55 55 GLY CA C 55 45.200 47.176 -1.976 1
1 612 . 18 1 1 A 55 55 GLY N N 55 107.940 113.223 -5.283 1
1 613 . 18 1 1 A 56 56 GLN H H 56 8.100 7.792 0.308 1
1 614 . 18 1 1 A 56 56 GLN HA H 56 4.420 3.803 0.617 1
1 619 . 18 1 1 A 56 56 GLN C C 56 175.570 175.070 0.500 1
1 620 . 18 1 1 A 56 56 GLN CA C 56 55.420 57.005 -1.585 1
1 621 . 18 1 1 A 56 56 GLN CB C 56 30.100 26.240 3.860 1
1 623 . 18 1 1 A 56 56 GLN N N 56 119.350 114.391 4.959 1
1 624 . 18 1 1 A 57 57 ARG H H 57 8.520 8.077 0.443 1
1 625 . 18 1 1 A 57 57 ARG HA H 57 4.400 4.314 0.086 1
1 632 . 18 1 1 A 57 57 ARG C C 57 176.210 177.948 -1.738 1
1 633 . 18 1 1 A 57 57 ARG CA C 57 56.440 56.331 0.109 1
1 634 . 18 1 1 A 57 57 ARG CB C 57 30.930 30.933 -0.003 1
1 637 . 18 1 1 A 57 57 ARG N N 57 122.610 119.718 2.892 1
1 638 . 18 1 1 A 58 58 ARG H H 58 8.630 8.665 -0.035 1
1 639 . 18 1 1 A 58 58 ARG HA H 58 4.430 4.061 0.369 1
1 646 . 18 1 1 A 58 58 ARG C C 58 175.950 176.853 -0.903 1
1 647 . 18 1 1 A 58 58 ARG CA C 58 55.450 59.327 -3.877 1
1 648 . 18 1 1 A 58 58 ARG CB C 58 31.300 30.078 1.222 1
1 651 . 18 1 1 A 58 58 ARG N N 58 123.320 122.625 0.695 1
1 652 . 18 1 1 A 59 59 LYS H H 59 8.560 7.488 1.072 1
1 653 . 18 1 1 A 59 59 LYS HA H 59 4.410 4.582 -0.172 1
1 662 . 18 1 1 A 59 59 LYS C C 59 176.590 175.663 0.927 1
1 663 . 18 1 1 A 59 59 LYS CA C 59 56.720 55.924 0.796 1
1 664 . 18 1 1 A 59 59 LYS CB C 59 33.150 33.706 -0.556 1
1 668 . 18 1 1 A 59 59 LYS N N 59 123.380 121.095 2.285 1
1 669 . 18 1 1 A 60 60 SER H H 60 8.450 8.834 -0.384 1
1 670 . 18 1 1 A 60 60 SER HA H 60 4.480 5.389 -0.909 1
1 673 . 18 1 1 A 60 60 SER C C 60 174.280 173.553 0.727 1
1 674 . 18 1 1 A 60 60 SER CA C 60 58.140 55.679 2.461 1
1 675 . 18 1 1 A 60 60 SER CB C 60 64.160 66.013 -1.853 1
1 676 . 18 1 1 A 60 60 SER N N 60 117.320 118.445 -1.125 1
1 677 . 18 1 1 A 61 61 GLU H H 61 8.550 8.528 0.022 1
1 678 . 18 1 1 A 61 61 GLU HA H 61 4.400 4.914 -0.514 1
1 683 . 18 1 1 A 61 61 GLU C C 61 176.150 175.202 0.948 1
1 684 . 18 1 1 A 61 61 GLU CA C 61 56.300 55.169 1.131 1
1 685 . 18 1 1 A 61 61 GLU CB C 61 30.790 32.275 -1.485 1
1 687 . 18 1 1 A 61 61 GLU N N 61 122.810 121.361 1.449 1
1 688 . 18 1 1 A 62 62 ARG H H 62 8.310 8.550 -0.240 1
1 689 . 18 1 1 A 62 62 ARG HA H 62 4.340 4.891 -0.551 1
1 692 . 18 1 1 A 62 62 ARG C C 62 176.140 175.267 0.873 1
1 693 . 18 1 1 A 62 62 ARG CA C 62 56.230 54.099 2.131 1
1 694 . 18 1 1 A 62 62 ARG CB C 62 30.780 33.307 -2.527 1
1 695 . 18 1 1 A 62 62 ARG N N 62 122.080 121.006 1.074 1
1 696 . 18 1 1 A 63 63 LYS H H 63 8.470 8.665 -0.195 1
1 697 . 18 1 1 A 63 63 LYS HA H 63 4.300 4.135 0.165 1
1 700 . 18 1 1 A 63 63 LYS C C 63 175.490 176.520 -1.030 1
1 701 . 18 1 1 A 63 63 LYS CA C 63 56.200 55.973 0.227 1
1 702 . 18 1 1 A 63 63 LYS CB C 63 30.730 32.282 -1.552 1
1 703 . 18 1 1 A 63 63 LYS N N 63 123.450 122.204 1.246 1
1 704 . 18 1 1 A 64 64 PHE H H 64 8.200 8.518 -0.318 1
1 705 . 18 1 1 A 64 64 PHE HA H 64 4.450 4.308 0.142 1
1 710 . 18 1 1 A 64 64 PHE C C 64 174.250 176.205 -1.955 1
1 711 . 18 1 1 A 64 64 PHE CA C 64 57.430 60.099 -2.669 1
1 712 . 18 1 1 A 64 64 PHE CB C 64 40.330 38.773 1.557 1
1 715 . 18 1 1 A 64 64 PHE N N 64 121.740 123.233 -1.493 1
1 716 . 18 1 1 A 65 65 PHE H H 65 8.130 7.066 1.064 1
1 717 . 18 1 1 A 65 65 PHE HA H 65 4.440 4.802 -0.362 1
1 725 . 18 1 1 A 65 65 PHE CA C 65 55.650 54.483 1.167 1
1 726 . 18 1 1 A 65 65 PHE CB C 65 38.900 38.726 0.174 1
1 731 . 18 1 1 A 65 65 PHE N N 65 120.910 114.090 6.820 1
1 732 . 18 1 1 A 66 66 PRO C C 66 176.780 177.741 -0.961 1
1 733 . 18 1 1 A 67 67 GLY H H 67 9.970 8.558 1.412 1
1 734 . 18 1 1 A 67 67 GLY HA2 H 67 3.820 4.076 -0.256 1
1 735 . 18 1 1 A 67 67 GLY HA3 H 67 4.400 4.085 0.315 1
1 736 . 18 1 1 A 67 67 GLY C C 67 173.670 174.023 -0.353 1
1 737 . 18 1 1 A 67 67 GLY CA C 67 45.900 45.978 -0.078 1
1 738 . 18 1 1 A 67 67 GLY N N 67 111.550 111.562 -0.012 1
1 739 . 18 1 1 A 68 68 TYR H H 68 7.650 8.115 -0.465 1
1 740 . 18 1 1 A 68 68 TYR HA H 68 5.000 4.915 0.085 1
1 747 . 18 1 1 A 68 68 TYR C C 68 175.220 174.571 0.649 1
1 748 . 18 1 1 A 68 68 TYR CA C 68 57.940 57.035 0.905 1
1 753 . 18 1 1 A 68 68 TYR N N 68 118.800 118.898 -0.098 1
1 754 . 18 1 1 A 69 69 VAL H H 69 9.090 8.753 0.337 1
1 755 . 18 1 1 A 69 69 VAL HA H 69 4.330 4.897 -0.567 1
1 763 . 18 1 1 A 69 69 VAL C C 69 174.250 175.162 -0.912 1
1 764 . 18 1 1 A 69 69 VAL CA C 69 62.120 60.315 1.805 1
1 765 . 18 1 1 A 69 69 VAL CB C 69 35.240 35.790 -0.550 1
1 768 . 18 1 1 A 69 69 VAL N N 69 119.300 123.943 -4.643 1
1 769 . 18 1 1 A 70 70 LEU H H 70 9.190 8.895 0.295 1
1 770 . 18 1 1 A 70 70 LEU HA H 70 5.460 5.666 -0.206 1
1 780 . 18 1 1 A 70 70 LEU C C 70 176.130 176.361 -0.231 1
1 781 . 18 1 1 A 70 70 LEU CA C 70 54.120 53.736 0.384 1
1 782 . 18 1 1 A 70 70 LEU CB C 70 43.330 44.756 -1.426 1
1 786 . 18 1 1 A 70 70 LEU N N 70 126.710 126.766 -0.056 1
1 787 . 18 1 1 A 71 71 VAL H H 71 9.350 9.798 -0.448 1
1 788 . 18 1 1 A 71 71 VAL HA H 71 5.040 4.875 0.165 1
1 796 . 18 1 1 A 71 71 VAL C C 71 173.670 175.167 -1.497 1
1 797 . 18 1 1 A 71 71 VAL CA C 71 61.090 61.297 -0.207 1
1 798 . 18 1 1 A 71 71 VAL CB C 71 35.800 35.586 0.214 1
1 801 . 18 1 1 A 71 71 VAL N N 71 121.920 123.767 -1.847 1
1 802 . 18 1 1 A 72 72 GLN H H 72 8.390 8.883 -0.493 1
1 803 . 18 1 1 A 72 72 GLN HA H 72 4.610 3.962 0.648 1
1 810 . 18 1 1 A 72 72 GLN C C 72 175.920 174.381 1.539 1
1 811 . 18 1 1 A 72 72 GLN CA C 72 53.810 55.362 -1.552 1
1 812 . 18 1 1 A 72 72 GLN CB C 72 28.850 28.669 0.181 1
1 814 . 18 1 1 A 72 72 GLN N N 72 130.760 127.753 3.007 1
1 816 . 18 1 1 A 73 73 MET H H 73 9.750 8.369 1.381 1
1 817 . 18 1 1 A 73 73 MET HA H 73 5.060 5.240 -0.180 1
1 825 . 18 1 1 A 73 73 MET C C 73 175.500 174.046 1.454 1
1 826 . 18 1 1 A 73 73 MET CA C 73 55.520 54.626 0.894 1
1 827 . 18 1 1 A 73 73 MET CB C 73 35.350 35.683 -0.333 1
1 830 . 18 1 1 A 73 73 MET N N 73 121.070 123.344 -2.274 1
1 831 . 18 1 1 A 74 74 VAL H H 74 8.530 8.203 0.327 1
1 832 . 18 1 1 A 74 74 VAL HA H 74 3.970 4.432 -0.462 1
1 840 . 18 1 1 A 74 74 VAL C C 74 174.900 175.693 -0.793 1
1 841 . 18 1 1 A 74 74 VAL CA C 74 62.150 62.120 0.030 1
1 842 . 18 1 1 A 74 74 VAL CB C 74 32.480 33.019 -0.539 1
1 845 . 18 1 1 A 74 74 VAL N N 74 124.120 123.476 0.644 1
1 846 . 18 1 1 A 75 75 MET H H 75 8.600 8.497 0.103 1
1 847 . 18 1 1 A 75 75 MET HA H 75 4.360 4.499 -0.139 1
1 855 . 18 1 1 A 75 75 MET C C 75 173.480 175.738 -2.258 1
1 856 . 18 1 1 A 75 75 MET CA C 75 53.830 55.496 -1.666 1
1 857 . 18 1 1 A 75 75 MET CB C 75 29.960 33.025 -3.065 1
1 860 . 18 1 1 A 75 75 MET N N 75 128.250 128.283 -0.033 1
1 861 . 18 1 1 A 76 76 ASN H H 76 8.410 8.591 -0.181 1
1 862 . 18 1 1 A 76 76 ASN HA H 76 4.540 5.081 -0.541 1
1 867 . 18 1 1 A 76 76 ASN C C 76 173.950 174.814 -0.864 1
1 868 . 18 1 1 A 76 76 ASN CA C 76 51.720 51.795 -0.075 1
1 869 . 18 1 1 A 76 76 ASN CB C 76 38.430 41.026 -2.596 1
1 870 . 18 1 1 A 76 76 ASN N N 76 127.500 124.155 3.345 1
1 872 . 18 1 1 A 77 77 ASP H H 77 8.470 8.936 -0.466 1
1 873 . 18 1 1 A 77 77 ASP HA H 77 4.410 4.454 -0.044 1
1 876 . 18 1 1 A 77 77 ASP C C 77 178.530 178.053 0.477 1
1 877 . 18 1 1 A 77 77 ASP CA C 77 58.730 55.995 2.735 1
1 878 . 18 1 1 A 77 77 ASP CB C 77 40.940 40.937 0.003 1
1 879 . 18 1 1 A 77 77 ASP N N 77 117.090 118.616 -1.526 1
1 880 . 18 1 1 A 78 78 ALA H H 78 8.160 8.041 0.119 1
1 881 . 18 1 1 A 78 78 ALA HA H 78 4.350 4.203 0.147 1
1 885 . 18 1 1 A 78 78 ALA C C 78 181.250 179.722 1.528 1
1 886 . 18 1 1 A 78 78 ALA CA C 78 55.190 55.103 0.087 1
1 887 . 18 1 1 A 78 78 ALA CB C 78 18.260 18.962 -0.702 1
1 888 . 18 1 1 A 78 78 ALA N N 78 122.500 123.058 -0.558 1
1 889 . 18 1 1 A 79 79 SER H H 79 9.320 8.497 0.823 1
1 890 . 18 1 1 A 79 79 SER HA H 79 4.290 4.334 -0.044 1
1 893 . 18 1 1 A 79 79 SER C C 79 176.570 176.353 0.217 1
1 894 . 18 1 1 A 79 79 SER CA C 79 61.080 61.629 -0.549 1
1 895 . 18 1 1 A 79 79 SER CB C 79 62.200 62.544 -0.344 1
1 896 . 18 1 1 A 79 79 SER N N 79 119.280 112.594 6.686 1
1 897 . 18 1 1 A 80 80 TRP H H 80 8.900 7.740 1.160 1
1 898 . 18 1 1 A 80 80 TRP HA H 80 4.020 4.278 -0.258 1
1 907 . 18 1 1 A 80 80 TRP C C 80 178.210 178.386 -0.176 1
1 908 . 18 1 1 A 80 80 TRP CA C 80 62.490 61.423 1.067 1
1 909 . 18 1 1 A 80 80 TRP CB C 80 29.800 29.463 0.337 1
1 915 . 18 1 1 A 80 80 TRP N N 80 125.870 123.645 2.225 1
1 917 . 18 1 1 A 81 81 HIS H H 81 8.190 7.692 0.498 1
1 918 . 18 1 1 A 81 81 HIS HA H 81 3.930 4.437 -0.507 1
1 923 . 18 1 1 A 81 81 HIS C C 81 177.740 177.572 0.168 1
1 924 . 18 1 1 A 81 81 HIS CA C 81 61.020 59.559 1.461 1
1 925 . 18 1 1 A 81 81 HIS CB C 81 28.910 30.261 -1.351 1
1 927 . 18 1 1 A 81 81 HIS N N 81 114.080 115.867 -1.787 1
1 928 . 18 1 1 A 82 82 LEU H H 82 8.080 8.234 -0.154 1
1 929 . 18 1 1 A 82 82 LEU HA H 82 3.900 3.759 0.141 1
1 939 . 18 1 1 A 82 82 LEU C C 82 180.330 178.444 1.886 1
1 940 . 18 1 1 A 82 82 LEU CA C 82 58.590 58.128 0.462 1
1 941 . 18 1 1 A 82 82 LEU CB C 82 41.350 41.567 -0.217 1
1 945 . 18 1 1 A 82 82 LEU N N 82 121.320 121.490 -0.170 1
1 946 . 18 1 1 A 83 83 VAL H H 83 8.000 8.371 -0.371 1
1 947 . 18 1 1 A 83 83 VAL HA H 83 3.210 3.450 -0.240 1
1 955 . 18 1 1 A 83 83 VAL C C 83 177.060 178.051 -0.991 1
1 956 . 18 1 1 A 83 83 VAL CA C 83 67.430 66.205 1.225 1
1 957 . 18 1 1 A 83 83 VAL CB C 83 31.680 31.265 0.415 1
1 960 . 18 1 1 A 83 83 VAL N N 83 118.850 118.940 -0.090 1
1 961 . 18 1 1 A 84 84 ARG H H 84 7.540 7.535 0.005 1
1 962 . 18 1 1 A 84 84 ARG HA H 84 3.590 3.663 -0.073 1
1 969 . 18 1 1 A 84 84 ARG C C 84 177.240 178.648 -1.408 1
1 970 . 18 1 1 A 84 84 ARG CA C 84 56.050 59.611 -3.561 1
1 971 . 18 1 1 A 84 84 ARG CB C 84 28.190 29.684 -1.494 1
1 974 . 18 1 1 A 84 84 ARG N N 84 111.460 120.523 -9.063 1
1 975 . 18 1 1 A 85 85 SER H H 85 7.530 7.995 -0.465 1
1 976 . 18 1 1 A 85 85 SER HA H 85 4.280 4.234 0.046 1
1 979 . 18 1 1 A 85 85 SER C C 85 173.930 174.632 -0.702 1
1 980 . 18 1 1 A 85 85 SER CA C 85 59.220 60.875 -1.655 1
1 981 . 18 1 1 A 85 85 SER CB C 85 63.830 62.884 0.946 1
1 982 . 18 1 1 A 85 85 SER N N 85 113.660 114.224 -0.564 1
1 983 . 18 1 1 A 86 86 VAL H H 86 7.230 7.219 0.011 1
1 984 . 18 1 1 A 86 86 VAL HA H 86 3.480 3.977 -0.497 1
1 992 . 18 1 1 A 86 86 VAL CA C 86 61.300 60.958 0.342 1
1 993 . 18 1 1 A 86 86 VAL CB C 86 31.780 32.325 -0.545 1
1 996 . 18 1 1 A 86 86 VAL N N 86 128.120 124.928 3.192 1
1 997 . 18 1 1 A 87 87 PRO HA H 87 4.140 4.389 -0.249 1
1 1004 . 18 1 1 A 87 87 PRO C C 87 176.400 176.740 -0.340 1
1 1005 . 18 1 1 A 87 87 PRO CA C 87 64.100 63.102 0.998 1
1 1006 . 18 1 1 A 87 87 PRO CB C 87 31.710 32.390 -0.680 1
1 1009 . 18 1 1 A 88 88 ARG H H 88 8.320 8.749 -0.429 1
1 1010 . 18 1 1 A 88 88 ARG HA H 88 3.030 4.024 -0.994 1
1 1017 . 18 1 1 A 88 88 ARG C C 88 174.630 174.926 -0.296 1
1 1018 . 18 1 1 A 88 88 ARG CA C 88 57.620 57.340 0.280 1
1 1019 . 18 1 1 A 88 88 ARG CB C 88 26.960 27.886 -0.926 1
1 1022 . 18 1 1 A 88 88 ARG N N 88 111.360 116.218 -4.858 1
1 1023 . 18 1 1 A 89 89 VAL H H 89 7.390 7.776 -0.386 1
1 1024 . 18 1 1 A 89 89 VAL HA H 89 3.910 4.328 -0.418 1
1 1032 . 18 1 1 A 89 89 VAL C C 89 177.370 175.511 1.859 1
1 1033 . 18 1 1 A 89 89 VAL CA C 89 64.170 61.198 2.972 1
1 1034 . 18 1 1 A 89 89 VAL CB C 89 32.070 33.891 -1.821 1
1 1037 . 18 1 1 A 89 89 VAL N N 89 117.900 118.709 -0.809 1
1 1038 . 18 1 1 A 90 90 MET H H 90 9.290 8.657 0.633 1
1 1039 . 18 1 1 A 90 90 MET HA H 90 4.340 4.119 0.221 1
1 1047 . 18 1 1 A 90 90 MET C C 90 175.800 176.012 -0.212 1
1 1048 . 18 1 1 A 90 90 MET CA C 90 56.440 56.928 -0.488 1
1 1049 . 18 1 1 A 90 90 MET CB C 90 34.160 33.184 0.976 1
1 1052 . 18 1 1 A 90 90 MET N N 90 128.200 125.659 2.541 1
1 1053 . 18 1 1 A 91 91 GLY H H 91 7.130 7.160 -0.030 1
1 1054 . 18 1 1 A 91 91 GLY HA2 H 91 3.340 3.891 -0.551 1
1 1055 . 18 1 1 A 91 91 GLY HA3 H 91 4.410 3.985 0.425 1
1 1056 . 18 1 1 A 91 91 GLY C C 91 170.920 171.240 -0.320 1
1 1057 . 18 1 1 A 91 91 GLY CA C 91 44.440 45.753 -1.313 1
1 1058 . 18 1 1 A 91 91 GLY N N 91 104.320 103.622 0.698 1
1 1059 . 18 1 1 A 92 92 PHE H H 92 8.790 8.338 0.452 1
1 1060 . 18 1 1 A 92 92 PHE HA H 92 5.270 5.031 0.239 1
1 1068 . 18 1 1 A 92 92 PHE C C 92 176.230 175.180 1.050 1
1 1069 . 18 1 1 A 92 92 PHE CA C 92 57.480 57.237 0.243 1
1 1070 . 18 1 1 A 92 92 PHE CB C 92 42.190 42.508 -0.318 1
1 1075 . 18 1 1 A 92 92 PHE N N 92 118.770 119.241 -0.471 1
1 1076 . 18 1 1 A 93 93 ILE H H 93 8.800 8.369 0.431 1
1 1077 . 18 1 1 A 93 93 ILE HA H 93 4.310 5.116 -0.806 1
1 1087 . 18 1 1 A 93 93 ILE C C 93 176.380 175.850 0.530 1
1 1088 . 18 1 1 A 93 93 ILE CA C 93 60.480 59.825 0.655 1
1 1089 . 18 1 1 A 93 93 ILE CB C 93 38.010 41.123 -3.113 1
1 1093 . 18 1 1 A 93 93 ILE N N 93 122.300 121.689 0.611 1
1 1094 . 18 1 1 A 94 94 GLY H H 94 8.640 8.446 0.194 1
1 1095 . 18 1 1 A 94 94 GLY HA2 H 94 3.830 4.210 -0.380 1
1 1096 . 18 1 1 A 94 94 GLY HA3 H 94 4.600 4.242 0.358 1
1 1097 . 18 1 1 A 94 94 GLY C C 94 175.080 174.317 0.763 1
1 1098 . 18 1 1 A 94 94 GLY CA C 94 44.530 46.078 -1.548 1
1 1099 . 18 1 1 A 94 94 GLY N N 94 116.550 113.213 3.337 1
1 1100 . 18 1 1 A 95 95 GLY H H 95 8.900 8.759 0.141 1
1 1101 . 18 1 1 A 95 95 GLY HA2 H 95 3.970 3.870 0.100 1
1 1102 . 18 1 1 A 95 95 GLY HA3 H 95 4.370 3.879 0.491 1
1 1103 . 18 1 1 A 95 95 GLY C C 95 174.560 174.068 0.492 1
1 1104 . 18 1 1 A 95 95 GLY CA C 95 45.640 46.871 -1.231 1
1 1105 . 18 1 1 A 95 95 GLY N N 95 112.960 109.710 3.250 1
1 1106 . 18 1 1 A 96 96 THR H H 96 7.830 7.654 0.176 1
1 1107 . 18 1 1 A 96 96 THR HA H 96 4.720 4.817 -0.097 1
1 1112 . 18 1 1 A 96 96 THR C C 96 176.260 174.278 1.982 1
1 1113 . 18 1 1 A 96 96 THR CA C 96 60.360 59.407 0.953 1
1 1114 . 18 1 1 A 96 96 THR CB C 96 70.960 72.020 -1.060 1
1 1116 . 18 1 1 A 96 96 THR N N 96 113.350 110.795 2.555 1
1 1117 . 18 1 1 A 97 97 SER H H 97 8.850 8.858 -0.008 1
1 1118 . 18 1 1 A 97 97 SER HA H 97 4.310 4.559 -0.249 1
1 1121 . 18 1 1 A 97 97 SER C C 97 175.570 174.785 0.785 1
1 1122 . 18 1 1 A 97 97 SER CA C 97 60.850 59.611 1.239 1
1 1123 . 18 1 1 A 97 97 SER CB C 97 63.000 63.322 -0.322 1
1 1124 . 18 1 1 A 97 97 SER N N 97 116.420 116.242 0.178 1
1 1125 . 18 1 1 A 98 98 ASP H H 98 8.360 8.204 0.156 1
1 1126 . 18 1 1 A 98 98 ASP HA H 98 4.310 5.406 -1.096 1
1 1129 . 18 1 1 A 98 98 ASP C C 98 175.380 176.073 -0.693 1
1 1130 . 18 1 1 A 98 98 ASP CA C 98 54.190 53.708 0.482 1
1 1131 . 18 1 1 A 98 98 ASP CB C 98 40.740 43.028 -2.288 1
1 1132 . 18 1 1 A 98 98 ASP N N 98 116.320 119.228 -2.908 1
1 1133 . 18 1 1 A 99 99 ARG H H 99 7.450 7.651 -0.201 1
1 1134 . 18 1 1 A 99 99 ARG HA H 99 4.350 4.750 -0.400 1
1 1141 . 18 1 1 A 99 99 ARG CA C 99 52.920 53.503 -0.583 1
1 1142 . 18 1 1 A 99 99 ARG CB C 99 30.340 30.973 -0.633 1
1 1145 . 18 1 1 A 99 99 ARG N N 99 119.960 119.209 0.751 1
1 1146 . 18 1 1 A 100 100 PRO HA H 100 4.750 4.444 0.306 1
1 1153 . 18 1 1 A 100 100 PRO C C 100 175.220 176.806 -1.586 1
1 1154 . 18 1 1 A 100 100 PRO CA C 100 62.680 62.533 0.147 1
1 1155 . 18 1 1 A 100 100 PRO CB C 100 32.820 31.123 1.697 1
1 1158 . 18 1 1 A 101 101 ALA H H 101 7.210 8.233 -1.023 1
1 1159 . 18 1 1 A 101 101 ALA HA H 101 5.030 4.463 0.567 1
1 1163 . 18 1 1 A 101 101 ALA CA C 101 48.570 50.182 -1.612 1
1 1164 . 18 1 1 A 101 101 ALA CB C 101 19.660 17.363 2.297 1
1 1165 . 18 1 1 A 101 101 ALA N N 101 124.490 125.226 -0.736 1
1 1166 . 18 1 1 A 102 102 PRO HA H 102 4.440 4.989 -0.549 1
1 1173 . 18 1 1 A 102 102 PRO C C 102 177.200 176.576 0.624 1
1 1174 . 18 1 1 A 102 102 PRO CA C 102 62.190 62.882 -0.692 1
1 1175 . 18 1 1 A 102 102 PRO CB C 102 32.310 32.905 -0.595 1
1 1178 . 18 1 1 A 103 103 ILE H H 103 8.550 8.351 0.199 1
1 1179 . 18 1 1 A 103 103 ILE HA H 103 4.630 4.921 -0.291 1
1 1189 . 18 1 1 A 103 103 ILE C C 103 175.460 175.308 0.152 1
1 1190 . 18 1 1 A 103 103 ILE CA C 103 59.730 58.638 1.092 1
1 1191 . 18 1 1 A 103 103 ILE CB C 103 40.140 42.139 -1.999 1
1 1195 . 18 1 1 A 103 103 ILE N N 103 115.670 116.337 -0.667 1
1 1196 . 18 1 1 A 104 104 SER H H 104 8.730 8.610 0.120 1
1 1197 . 18 1 1 A 104 104 SER HA H 104 4.500 4.535 -0.035 1
1 1200 . 18 1 1 A 104 104 SER C C 104 174.840 175.428 -0.588 1
1 1201 . 18 1 1 A 104 104 SER CA C 104 58.010 58.974 -0.964 1
1 1202 . 18 1 1 A 104 104 SER CB C 104 65.470 63.575 1.895 1
1 1203 . 18 1 1 A 104 104 SER N N 104 119.170 119.805 -0.635 1
1 1204 . 18 1 1 A 105 105 ASP H H 105 8.830 9.086 -0.256 1
1 1205 . 18 1 1 A 105 105 ASP HA H 105 4.200 4.398 -0.198 1
1 1208 . 18 1 1 A 105 105 ASP C C 105 178.520 178.372 0.148 1
1 1209 . 18 1 1 A 105 105 ASP CA C 105 57.870 58.168 -0.298 1
1 1210 . 18 1 1 A 105 105 ASP CB C 105 40.040 40.535 -0.495 1
1 1211 . 18 1 1 A 105 105 ASP N N 105 121.640 125.111 -3.471 1
1 1212 . 18 1 1 A 106 106 LYS H H 106 8.130 8.050 0.080 1
1 1213 . 18 1 1 A 106 106 LYS HA H 106 4.100 3.919 0.181 1
1 1222 . 18 1 1 A 106 106 LYS C C 106 179.400 178.927 0.473 1
1 1223 . 18 1 1 A 106 106 LYS CA C 106 58.980 59.667 -0.687 1
1 1224 . 18 1 1 A 106 106 LYS CB C 106 32.330 32.244 0.086 1
1 1228 . 18 1 1 A 106 106 LYS N N 106 118.300 120.772 -2.472 1
1 1229 . 18 1 1 A 107 107 GLU H H 107 7.670 8.090 -0.420 1
1 1230 . 18 1 1 A 107 107 GLU HA H 107 4.020 4.009 0.011 1
1 1235 . 18 1 1 A 107 107 GLU C C 107 178.750 179.119 -0.369 1
1 1236 . 18 1 1 A 107 107 GLU CA C 107 59.210 59.320 -0.110 1
1 1237 . 18 1 1 A 107 107 GLU CB C 107 29.780 29.412 0.368 1
1 1239 . 18 1 1 A 107 107 GLU N N 107 121.270 118.807 2.463 1
1 1240 . 18 1 1 A 108 108 VAL H H 108 7.790 7.655 0.135 1
1 1241 . 18 1 1 A 108 108 VAL HA H 108 3.050 3.411 -0.361 1
1 1249 . 18 1 1 A 108 108 VAL C C 108 177.550 177.510 0.040 1
1 1250 . 18 1 1 A 108 108 VAL CA C 108 67.080 66.218 0.862 1
1 1251 . 18 1 1 A 108 108 VAL CB C 108 31.220 30.851 0.369 1
1 1254 . 18 1 1 A 108 108 VAL N N 108 120.940 119.791 1.149 1
1 1255 . 18 1 1 A 109 109 ASP H H 109 7.840 8.116 -0.276 1
1 1256 . 18 1 1 A 109 109 ASP HA H 109 4.110 4.242 -0.132 1
1 1259 . 18 1 1 A 109 109 ASP C C 109 178.190 178.407 -0.217 1
1 1260 . 18 1 1 A 109 109 ASP CA C 109 57.470 57.210 0.260 1
1 1261 . 18 1 1 A 109 109 ASP CB C 109 40.480 39.959 0.521 1
1 1262 . 18 1 1 A 109 109 ASP N N 109 118.780 120.931 -2.151 1
1 1263 . 18 1 1 A 110 110 ALA H H 110 7.520 7.420 0.100 1
1 1264 . 18 1 1 A 110 110 ALA HA H 110 4.110 4.067 0.043 1
1 1268 . 18 1 1 A 110 110 ALA C C 110 180.550 179.695 0.855 1
1 1269 . 18 1 1 A 110 110 ALA CA C 110 54.880 54.992 -0.112 1
1 1270 . 18 1 1 A 110 110 ALA CB C 110 18.440 18.132 0.308 1
1 1271 . 18 1 1 A 110 110 ALA N N 110 120.640 122.400 -1.760 1
1 1272 . 18 1 1 A 111 111 ILE H H 111 7.840 7.666 0.174 1
1 1273 . 18 1 1 A 111 111 ILE HA H 111 3.580 3.516 0.064 1
1 1281 . 18 1 1 A 111 111 ILE C C 111 177.470 177.971 -0.501 1
1 1282 . 18 1 1 A 111 111 ILE CA C 111 64.620 64.968 -0.348 1
1 1283 . 18 1 1 A 111 111 ILE CB C 111 38.600 37.690 0.910 1
1 1286 . 18 1 1 A 111 111 ILE N N 111 119.840 119.228 0.612 1
1 1287 . 18 1 1 A 112 112 MET H H 112 8.100 7.778 0.322 1
1 1288 . 18 1 1 A 112 112 MET HA H 112 4.400 4.276 0.124 1
1 1296 . 18 1 1 A 112 112 MET C C 112 177.710 178.360 -0.650 1
1 1297 . 18 1 1 A 112 112 MET CA C 112 55.300 58.754 -3.454 1
1 1298 . 18 1 1 A 112 112 MET CB C 112 30.510 32.774 -2.264 1
1 1301 . 18 1 1 A 112 112 MET N N 112 115.180 118.458 -3.278 1
1 1302 . 18 1 1 A 113 113 ASN H H 113 8.070 8.140 -0.070 1
1 1303 . 18 1 1 A 113 113 ASN HA H 113 4.570 4.396 0.174 1
1 1308 . 18 1 1 A 113 113 ASN C C 113 175.530 177.773 -2.243 1
1 1309 . 18 1 1 A 113 113 ASN CA C 113 54.420 56.446 -2.026 1
1 1310 . 18 1 1 A 113 113 ASN CB C 113 38.350 39.821 -1.471 1
1 1311 . 18 1 1 A 113 113 ASN N N 113 117.190 118.887 -1.697 1
1 1313 . 18 1 1 A 114 114 ARG H H 114 8.070 7.886 0.184 1
1 1314 . 18 1 1 A 114 114 ARG HA H 114 4.280 3.673 0.607 1
1 1321 . 18 1 1 A 114 114 ARG C C 114 176.620 178.432 -1.812 1
1 1322 . 18 1 1 A 114 114 ARG CA C 114 56.910 59.172 -2.262 1
1 1323 . 18 1 1 A 114 114 ARG CB C 114 30.370 29.943 0.427 1
1 1326 . 18 1 1 A 114 114 ARG N N 114 118.360 119.142 -0.782 1
1 1327 . 18 1 1 A 115 115 LEU H H 115 8.100 7.724 0.376 1
1 1328 . 18 1 1 A 115 115 LEU HA H 115 4.310 4.250 0.060 1
1 1338 . 18 1 1 A 115 115 LEU C C 115 177.440 178.382 -0.942 1
1 1339 . 18 1 1 A 115 115 LEU CA C 115 55.440 58.017 -2.577 1
1 1340 . 18 1 1 A 115 115 LEU CB C 115 42.250 41.716 0.534 1
1 1344 . 18 1 1 A 115 115 LEU N N 115 120.580 121.523 -0.943 1
1 1345 . 18 1 1 A 116 116 GLN H H 116 8.180 7.456 0.724 1
1 1346 . 18 1 1 A 116 116 GLN HA H 116 4.360 4.106 0.254 1
1 1353 . 18 1 1 A 116 116 GLN C C 116 175.890 176.672 -0.782 1
1 1354 . 18 1 1 A 116 116 GLN CA C 116 55.810 59.050 -3.240 1
1 1355 . 18 1 1 A 116 116 GLN CB C 116 29.500 28.367 1.133 1
1 1357 . 18 1 1 A 116 116 GLN N N 116 119.770 117.269 2.501 1
1 1358 . 18 1 1 A 117 117 GLN H H 117 8.350 8.070 0.280 1
1 1359 . 18 1 1 A 117 117 GLN HA H 117 4.380 4.313 0.067 1
1 1366 . 18 1 1 A 117 117 GLN C C 117 176.130 175.145 0.985 1
1 1367 . 18 1 1 A 117 117 GLN CA C 117 55.810 56.105 -0.295 1
1 1368 . 18 1 1 A 117 117 GLN CB C 117 29.500 29.382 0.118 1
1 1370 . 18 1 1 A 117 117 GLN N N 117 121.440 119.991 1.449 1
1 1371 . 18 1 1 A 118 118 VAL H H 118 8.240 8.818 -0.578 1
1 1372 . 18 1 1 A 118 118 VAL HA H 118 4.120 4.713 -0.593 1
1 1380 . 18 1 1 A 118 118 VAL C C 118 176.650 177.434 -0.784 1
1 1381 . 18 1 1 A 118 118 VAL CA C 118 62.720 60.808 1.912 1
1 1382 . 18 1 1 A 118 118 VAL CB C 118 32.730 34.979 -2.249 1
1 1385 . 18 1 1 A 118 118 VAL N N 118 121.250 126.600 -5.350 1
1 1386 . 18 1 1 A 119 119 GLY H H 119 8.460 8.787 -0.327 1
1 1387 . 18 1 1 A 119 119 GLY HA2 H 119 3.990 3.873 0.117 1
1 1388 . 18 1 1 A 119 119 GLY HA3 H 119 3.990 3.930 0.060 1
1 1389 . 18 1 1 A 119 119 GLY C C 119 173.770 174.042 -0.272 1
1 1390 . 18 1 1 A 119 119 GLY CA C 119 45.260 47.367 -2.107 1
1 1391 . 18 1 1 A 119 119 GLY N N 119 112.300 113.722 -1.422 1
1 1392 . 18 1 1 A 120 120 ASP H H 120 8.230 7.864 0.366 1
1 1393 . 18 1 1 A 120 120 ASP HA H 120 4.580 5.156 -0.576 1
1 1396 . 18 1 1 A 120 120 ASP C C 120 175.180 175.066 0.114 1
1 1397 . 18 1 1 A 120 120 ASP CA C 120 54.340 53.207 1.133 1
1 1398 . 18 1 1 A 120 120 ASP CB C 120 41.390 43.073 -1.683 1
1 1399 . 18 1 1 A 120 120 ASP N N 120 120.420 120.089 0.331 1
1 1400 . 18 1 1 A 121 121 LYS H H 121 7.950 8.586 -0.636 1
1 1401 . 18 1 1 A 121 121 LYS HA H 121 4.240 5.057 -0.817 1
1 1402 . 18 1 1 A 121 121 LYS CA C 121 53.620 53.620 0.000 1
1 1403 . 18 1 1 A 121 121 LYS N N 121 119.110 122.715 -3.605 1
1 1404 . 18 1 1 A 122 122 PRO HA H 122 4.410 4.648 -0.238 1
1 1405 . 18 1 1 A 122 122 PRO C C 122 176.560 177.737 -1.177 1
1 1406 . 18 1 1 A 122 122 PRO CA C 122 63.130 62.787 0.343 1
1 2 . 19 1 1 A 2 2 SER H H 2 7.890 8.361 -0.471 1
1 3 . 19 1 1 A 2 2 SER HA H 2 4.270 4.337 -0.067 1
1 4 . 19 1 1 A 2 2 SER C C 2 173.960 174.735 -0.775 1
1 5 . 19 1 1 A 2 2 SER CA C 2 60.800 60.852 -0.052 1
1 6 . 19 1 1 A 2 2 SER N N 2 111.940 113.379 -1.439 1
1 7 . 19 1 1 A 3 3 GLU H H 3 8.010 7.909 0.101 1
1 8 . 19 1 1 A 3 3 GLU HA H 3 4.360 4.836 -0.476 1
1 9 . 19 1 1 A 3 3 GLU C C 3 175.710 175.427 0.283 1
1 10 . 19 1 1 A 3 3 GLU CA C 3 56.310 54.779 1.531 1
1 11 . 19 1 1 A 3 3 GLU N N 3 121.280 121.015 0.265 1
1 12 . 19 1 1 A 4 4 ALA H H 4 8.540 8.717 -0.177 1
1 13 . 19 1 1 A 4 4 ALA HA H 4 4.560 5.023 -0.463 1
1 14 . 19 1 1 A 4 4 ALA CA C 4 50.630 49.639 0.991 1
1 15 . 19 1 1 A 4 4 ALA N N 4 127.840 123.569 4.271 1
1 16 . 19 1 1 A 5 5 PRO HA H 5 4.420 4.614 -0.194 1
1 17 . 19 1 1 A 5 5 PRO C C 5 174.240 175.809 -1.569 1
1 18 . 19 1 1 A 5 5 PRO CA C 5 62.840 62.672 0.168 1
1 19 . 19 1 1 A 6 6 LYS H H 6 8.320 8.500 -0.180 1
1 20 . 19 1 1 A 6 6 LYS HA H 6 4.290 4.955 -0.665 1
1 21 . 19 1 1 A 6 6 LYS C C 6 176.100 175.386 0.714 1
1 22 . 19 1 1 A 6 6 LYS CA C 6 55.540 54.919 0.621 1
1 23 . 19 1 1 A 6 6 LYS N N 6 121.910 121.120 0.790 1
1 24 . 19 1 1 A 7 7 LYS H H 7 8.450 8.877 -0.427 1
1 25 . 19 1 1 A 7 7 LYS HA H 7 3.940 5.101 -1.161 1
1 26 . 19 1 1 A 7 7 LYS C C 7 175.700 174.993 0.707 1
1 27 . 19 1 1 A 7 7 LYS CA C 7 56.440 54.606 1.834 1
1 28 . 19 1 1 A 7 7 LYS N N 7 122.250 123.200 -0.950 1
1 29 . 19 1 1 A 8 8 ARG H H 8 8.210 8.714 -0.504 1
1 30 . 19 1 1 A 8 8 ARG HA H 8 4.670 4.800 -0.130 1
1 31 . 19 1 1 A 8 8 ARG C C 8 173.760 174.440 -0.680 1
1 32 . 19 1 1 A 8 8 ARG CA C 8 53.420 53.979 -0.559 1
1 33 . 19 1 1 A 8 8 ARG N N 8 122.560 122.017 0.543 1
1 34 . 19 1 1 A 9 9 TRP H H 9 8.610 8.657 -0.047 1
1 35 . 19 1 1 A 9 9 TRP HA H 9 4.910 5.372 -0.462 1
1 44 . 19 1 1 A 9 9 TRP C C 9 174.610 175.190 -0.580 1
1 45 . 19 1 1 A 9 9 TRP CA C 9 57.630 55.496 2.134 1
1 46 . 19 1 1 A 9 9 TRP CB C 9 31.020 30.720 0.300 1
1 52 . 19 1 1 A 9 9 TRP N N 9 120.540 121.768 -1.228 1
1 54 . 19 1 1 A 10 10 TYR H H 10 9.260 8.811 0.449 1
1 55 . 19 1 1 A 10 10 TYR HA H 10 4.820 5.285 -0.465 1
1 62 . 19 1 1 A 10 10 TYR C C 10 174.340 174.957 -0.617 1
1 63 . 19 1 1 A 10 10 TYR CA C 10 57.050 56.385 0.665 1
1 64 . 19 1 1 A 10 10 TYR CB C 10 41.920 43.420 -1.500 1
1 69 . 19 1 1 A 10 10 TYR N N 10 118.990 121.165 -2.175 1
1 70 . 19 1 1 A 11 11 VAL H H 11 9.450 9.043 0.407 1
1 71 . 19 1 1 A 11 11 VAL HA H 11 4.470 4.777 -0.307 1
1 79 . 19 1 1 A 11 11 VAL C C 11 175.030 175.556 -0.526 1
1 80 . 19 1 1 A 11 11 VAL CA C 11 62.320 61.766 0.554 1
1 81 . 19 1 1 A 11 11 VAL CB C 11 32.400 33.426 -1.026 1
1 84 . 19 1 1 A 11 11 VAL N N 11 120.930 122.239 -1.309 1
1 85 . 19 1 1 A 12 12 VAL H H 12 9.320 10.053 -0.733 1
1 86 . 19 1 1 A 12 12 VAL HA H 12 3.940 4.331 -0.391 1
1 94 . 19 1 1 A 12 12 VAL C C 12 173.870 174.850 -0.980 1
1 95 . 19 1 1 A 12 12 VAL CA C 12 61.330 60.909 0.421 1
1 96 . 19 1 1 A 12 12 VAL CB C 12 33.500 34.047 -0.547 1
1 99 . 19 1 1 A 12 12 VAL N N 12 128.860 128.304 0.556 1
1 100 . 19 1 1 A 13 13 GLN H H 13 8.830 8.232 0.598 1
1 101 . 19 1 1 A 13 13 GLN HA H 13 4.710 5.211 -0.501 1
1 108 . 19 1 1 A 13 13 GLN C C 13 174.230 175.314 -1.084 1
1 109 . 19 1 1 A 13 13 GLN CA C 13 54.800 54.944 -0.144 1
1 110 . 19 1 1 A 13 13 GLN CB C 13 29.450 30.278 -0.828 1
1 111 . 19 1 1 A 13 13 GLN N N 13 126.050 126.406 -0.356 1
1 113 . 19 1 1 A 14 14 ALA H H 14 9.420 8.569 0.851 1
1 114 . 19 1 1 A 14 14 ALA HA H 14 5.150 4.696 0.454 1
1 118 . 19 1 1 A 14 14 ALA C C 14 176.400 176.161 0.239 1
1 119 . 19 1 1 A 14 14 ALA CA C 14 49.660 50.947 -1.287 1
1 120 . 19 1 1 A 14 14 ALA CB C 14 22.840 23.181 -0.341 1
1 121 . 19 1 1 A 14 14 ALA N N 14 131.620 122.631 8.989 1
1 122 . 19 1 1 A 15 15 PHE H H 15 8.070 8.700 -0.630 1
1 123 . 19 1 1 A 15 15 PHE HA H 15 4.410 4.686 -0.276 1
1 128 . 19 1 1 A 15 15 PHE C C 15 176.130 175.896 0.234 1
1 129 . 19 1 1 A 15 15 PHE CA C 15 58.550 59.037 -0.487 1
1 130 . 19 1 1 A 15 15 PHE CB C 15 39.780 39.584 0.196 1
1 133 . 19 1 1 A 15 15 PHE N N 15 119.680 119.035 0.645 1
1 134 . 19 1 1 A 16 16 SER H H 16 8.370 8.934 -0.564 1
1 135 . 19 1 1 A 16 16 SER HA H 16 4.140 4.151 -0.011 1
1 138 . 19 1 1 A 16 16 SER C C 16 175.820 175.652 0.168 1
1 139 . 19 1 1 A 16 16 SER CA C 16 60.570 60.577 -0.007 1
1 140 . 19 1 1 A 16 16 SER CB C 16 63.030 63.088 -0.058 1
1 141 . 19 1 1 A 16 16 SER N N 16 119.700 119.842 -0.142 1
1 142 . 19 1 1 A 17 17 GLY H H 17 9.130 8.796 0.334 1
1 143 . 19 1 1 A 17 17 GLY HA2 H 17 3.640 3.685 -0.045 1
1 144 . 19 1 1 A 17 17 GLY HA3 H 17 4.200 3.799 0.401 1
1 145 . 19 1 1 A 17 17 GLY C C 17 175.520 174.751 0.769 1
1 146 . 19 1 1 A 17 17 GLY CA C 17 45.260 45.302 -0.042 1
1 147 . 19 1 1 A 17 17 GLY N N 17 115.850 113.508 2.342 1
1 148 . 19 1 1 A 18 18 PHE H H 18 8.480 7.926 0.554 1
1 149 . 19 1 1 A 18 18 PHE HA H 18 4.740 4.633 0.107 1
1 154 . 19 1 1 A 18 18 PHE C C 18 175.430 176.411 -0.981 1
1 155 . 19 1 1 A 18 18 PHE CA C 18 58.240 57.732 0.508 1
1 156 . 19 1 1 A 18 18 PHE CB C 18 39.010 38.572 0.438 1
1 159 . 19 1 1 A 18 18 PHE N N 18 118.550 119.760 -1.210 1
1 160 . 19 1 1 A 19 19 GLU H H 19 10.690 8.280 2.410 1
1 161 . 19 1 1 A 19 19 GLU HA H 19 3.490 4.073 -0.583 1
1 166 . 19 1 1 A 19 19 GLU C C 19 177.650 179.075 -1.425 1
1 167 . 19 1 1 A 19 19 GLU CA C 19 62.280 59.769 2.511 1
1 168 . 19 1 1 A 19 19 GLU CB C 19 28.380 29.328 -0.948 1
1 170 . 19 1 1 A 19 19 GLU N N 19 123.470 123.153 0.317 1
1 171 . 19 1 1 A 20 20 GLY H H 20 8.740 8.206 0.534 1
1 172 . 19 1 1 A 20 20 GLY HA2 H 20 3.840 3.820 0.020 1
1 173 . 19 1 1 A 20 20 GLY HA3 H 20 3.940 3.830 0.110 1
1 174 . 19 1 1 A 20 20 GLY C C 20 176.860 175.597 1.263 1
1 175 . 19 1 1 A 20 20 GLY CA C 20 47.140 46.838 0.302 1
1 176 . 19 1 1 A 20 20 GLY N N 20 105.480 107.600 -2.120 1
1 177 . 19 1 1 A 21 21 ARG H H 21 7.690 8.218 -0.528 1
1 178 . 19 1 1 A 21 21 ARG HA H 21 4.180 4.130 0.050 1
1 185 . 19 1 1 A 21 21 ARG C C 21 179.490 178.871 0.619 1
1 186 . 19 1 1 A 21 21 ARG CA C 21 58.660 59.207 -0.547 1
1 187 . 19 1 1 A 21 21 ARG CB C 21 30.100 30.117 -0.017 1
1 190 . 19 1 1 A 21 21 ARG N N 21 123.120 122.051 1.069 1
1 191 . 19 1 1 A 22 22 VAL H H 22 8.980 8.377 0.603 1
1 192 . 19 1 1 A 22 22 VAL HA H 22 3.560 3.818 -0.258 1
1 200 . 19 1 1 A 22 22 VAL C C 22 177.320 178.377 -1.057 1
1 201 . 19 1 1 A 22 22 VAL CA C 22 66.960 66.355 0.605 1
1 202 . 19 1 1 A 22 22 VAL CB C 22 31.050 31.718 -0.668 1
1 205 . 19 1 1 A 22 22 VAL N N 22 122.760 120.121 2.639 1
1 206 . 19 1 1 A 23 23 ALA H H 23 8.280 8.391 -0.111 1
1 207 . 19 1 1 A 23 23 ALA HA H 23 3.850 4.037 -0.187 1
1 211 . 19 1 1 A 23 23 ALA C C 23 179.340 179.576 -0.236 1
1 212 . 19 1 1 A 23 23 ALA CA C 23 56.260 55.304 0.956 1
1 213 . 19 1 1 A 23 23 ALA CB C 23 18.260 18.228 0.032 1
1 214 . 19 1 1 A 23 23 ALA N N 23 122.120 121.805 0.315 1
1 215 . 19 1 1 A 24 24 THR H H 24 8.020 7.890 0.130 1
1 216 . 19 1 1 A 24 24 THR HA H 24 3.920 4.008 -0.088 1
1 221 . 19 1 1 A 24 24 THR C C 24 176.940 176.513 0.427 1
1 222 . 19 1 1 A 24 24 THR CA C 24 66.820 66.740 0.080 1
1 223 . 19 1 1 A 24 24 THR CB C 24 68.930 68.218 0.712 1
1 225 . 19 1 1 A 24 24 THR N N 24 113.410 115.170 -1.760 1
1 226 . 19 1 1 A 25 25 SER H H 25 8.570 8.346 0.224 1
1 227 . 19 1 1 A 25 25 SER HA H 25 4.400 4.083 0.317 1
1 230 . 19 1 1 A 25 25 SER C C 25 177.610 176.725 0.885 1
1 231 . 19 1 1 A 25 25 SER CA C 25 61.920 61.605 0.315 1
1 232 . 19 1 1 A 25 25 SER CB C 25 63.540 62.527 1.013 1
1 233 . 19 1 1 A 25 25 SER N N 25 118.260 115.837 2.423 1
1 234 . 19 1 1 A 26 26 LEU H H 26 9.430 8.229 1.201 1
1 235 . 19 1 1 A 26 26 LEU HA H 26 3.900 3.951 -0.051 1
1 245 . 19 1 1 A 26 26 LEU C C 26 177.710 178.733 -1.023 1
1 246 . 19 1 1 A 26 26 LEU CA C 26 58.910 58.013 0.897 1
1 247 . 19 1 1 A 26 26 LEU CB C 26 41.300 41.704 -0.404 1
1 251 . 19 1 1 A 26 26 LEU N N 26 124.120 123.189 0.931 1
1 252 . 19 1 1 A 27 27 ARG H H 27 7.790 7.653 0.137 1
1 253 . 19 1 1 A 27 27 ARG HA H 27 3.880 3.838 0.042 1
1 260 . 19 1 1 A 27 27 ARG C C 27 179.380 178.687 0.693 1
1 261 . 19 1 1 A 27 27 ARG CA C 27 60.510 59.579 0.931 1
1 262 . 19 1 1 A 27 27 ARG CB C 27 29.670 29.717 -0.047 1
1 265 . 19 1 1 A 27 27 ARG N N 27 116.710 118.707 -1.997 1
1 266 . 19 1 1 A 28 28 GLU H H 28 7.900 7.961 -0.061 1
1 267 . 19 1 1 A 28 28 GLU HA H 28 4.070 3.948 0.122 1
1 272 . 19 1 1 A 28 28 GLU C C 28 179.450 178.921 0.529 1
1 273 . 19 1 1 A 28 28 GLU CA C 28 59.450 59.068 0.382 1
1 274 . 19 1 1 A 28 28 GLU CB C 28 29.610 29.113 0.497 1
1 276 . 19 1 1 A 28 28 GLU N N 28 118.340 118.566 -0.226 1
1 277 . 19 1 1 A 29 29 HIS H H 29 8.940 7.800 1.140 1
1 278 . 19 1 1 A 29 29 HIS HA H 29 4.160 4.463 -0.303 1
1 283 . 19 1 1 A 29 29 HIS C C 29 177.750 177.918 -0.168 1
1 284 . 19 1 1 A 29 29 HIS CA C 29 61.260 60.028 1.232 1
1 285 . 19 1 1 A 29 29 HIS CB C 29 29.870 30.504 -0.634 1
1 287 . 19 1 1 A 29 29 HIS N N 29 120.440 117.515 2.925 1
1 288 . 19 1 1 A 30 30 ILE H H 30 8.580 7.964 0.616 1
1 289 . 19 1 1 A 30 30 ILE HA H 30 3.160 3.493 -0.333 1
1 299 . 19 1 1 A 30 30 ILE C C 30 177.230 177.811 -0.581 1
1 300 . 19 1 1 A 30 30 ILE CA C 30 66.460 65.135 1.325 1
1 301 . 19 1 1 A 30 30 ILE CB C 30 38.630 37.569 1.061 1
1 305 . 19 1 1 A 30 30 ILE N N 30 121.010 120.478 0.532 1
1 306 . 19 1 1 A 31 31 LYS H H 31 7.020 7.943 -0.923 1
1 307 . 19 1 1 A 31 31 LYS HA H 31 4.170 3.975 0.195 1
1 316 . 19 1 1 A 31 31 LYS C C 31 180.570 179.303 1.267 1
1 317 . 19 1 1 A 31 31 LYS CA C 31 58.920 59.803 -0.883 1
1 318 . 19 1 1 A 31 31 LYS CB C 31 32.490 32.233 0.257 1
1 322 . 19 1 1 A 31 31 LYS N N 31 117.400 119.676 -2.276 1
1 323 . 19 1 1 A 32 32 LEU H H 32 8.400 7.724 0.676 1
1 324 . 19 1 1 A 32 32 LEU HA H 32 3.990 3.935 0.055 1
1 334 . 19 1 1 A 32 32 LEU C C 32 178.230 178.306 -0.076 1
1 335 . 19 1 1 A 32 32 LEU CA C 32 57.700 57.774 -0.074 1
1 336 . 19 1 1 A 32 32 LEU CB C 32 42.540 41.866 0.674 1
1 340 . 19 1 1 A 32 32 LEU N N 32 121.180 119.932 1.248 1
1 341 . 19 1 1 A 33 33 HIS H H 33 7.620 8.051 -0.431 1
1 342 . 19 1 1 A 33 33 HIS HA H 33 4.600 4.650 -0.050 1
1 347 . 19 1 1 A 33 33 HIS C C 33 177.090 174.032 3.058 1
1 348 . 19 1 1 A 33 33 HIS CA C 33 55.840 55.483 0.357 1
1 349 . 19 1 1 A 33 33 HIS CB C 33 29.330 29.976 -0.646 1
1 351 . 19 1 1 A 33 33 HIS N N 33 112.220 115.299 -3.079 1
1 352 . 19 1 1 A 34 34 ASN H H 34 8.030 8.009 0.021 1
1 353 . 19 1 1 A 34 34 ASN HA H 34 4.890 4.352 0.538 1
1 358 . 19 1 1 A 34 34 ASN C C 34 175.910 175.520 0.390 1
1 359 . 19 1 1 A 34 34 ASN CA C 34 54.530 54.396 0.134 1
1 360 . 19 1 1 A 34 34 ASN CB C 34 37.380 36.758 0.622 1
1 361 . 19 1 1 A 34 34 ASN N N 34 117.600 114.815 2.785 1
1 363 . 19 1 1 A 35 35 MET H H 35 8.330 8.541 -0.211 1
1 364 . 19 1 1 A 35 35 MET HA H 35 4.940 4.849 0.091 1
1 372 . 19 1 1 A 35 35 MET C C 35 176.880 176.712 0.168 1
1 373 . 19 1 1 A 35 35 MET CA C 35 55.600 54.566 1.034 1
1 374 . 19 1 1 A 35 35 MET CB C 35 33.790 32.864 0.926 1
1 377 . 19 1 1 A 35 35 MET N N 35 116.190 116.336 -0.146 1
1 378 . 19 1 1 A 36 36 GLU H H 36 9.730 8.163 1.567 1
1 379 . 19 1 1 A 36 36 GLU HA H 36 3.850 4.085 -0.235 1
1 384 . 19 1 1 A 36 36 GLU C C 36 178.290 179.303 -1.013 1
1 385 . 19 1 1 A 36 36 GLU CA C 36 61.280 59.586 1.694 1
1 386 . 19 1 1 A 36 36 GLU CB C 36 29.270 29.164 0.106 1
1 388 . 19 1 1 A 36 36 GLU N N 36 121.630 120.801 0.829 1
1 389 . 19 1 1 A 37 37 ASP H H 37 8.850 8.041 0.809 1
1 390 . 19 1 1 A 37 37 ASP HA H 37 4.470 4.441 0.029 1
1 393 . 19 1 1 A 37 37 ASP C C 37 177.190 179.048 -1.858 1
1 394 . 19 1 1 A 37 37 ASP CA C 37 56.140 57.701 -1.561 1
1 395 . 19 1 1 A 37 37 ASP CB C 37 40.050 41.601 -1.551 1
1 396 . 19 1 1 A 37 37 ASP N N 37 114.390 120.032 -5.642 1
1 397 . 19 1 1 A 38 38 LEU H H 38 7.880 7.937 -0.057 1
1 398 . 19 1 1 A 38 38 LEU HA H 38 4.290 3.953 0.337 1
1 408 . 19 1 1 A 38 38 LEU C C 38 175.090 177.828 -2.738 1
1 409 . 19 1 1 A 38 38 LEU CA C 38 54.670 57.949 -3.279 1
1 410 . 19 1 1 A 38 38 LEU CB C 38 42.940 42.221 0.719 1
1 414 . 19 1 1 A 38 38 LEU N N 38 116.550 119.092 -2.542 1
1 415 . 19 1 1 A 39 39 PHE H H 39 7.500 8.016 -0.516 1
1 416 . 19 1 1 A 39 39 PHE HA H 39 4.970 4.813 0.157 1
1 424 . 19 1 1 A 39 39 PHE C C 39 175.380 175.860 -0.480 1
1 425 . 19 1 1 A 39 39 PHE CA C 39 57.580 58.584 -1.004 1
1 426 . 19 1 1 A 39 39 PHE CB C 39 44.990 39.643 5.347 1
1 432 . 19 1 1 A 39 39 PHE N N 39 115.370 117.322 -1.952 1
1 433 . 19 1 1 A 40 40 GLY H H 40 8.680 8.631 0.049 1
1 434 . 19 1 1 A 40 40 GLY HA2 H 40 3.370 3.893 -0.523 1
1 435 . 19 1 1 A 40 40 GLY HA3 H 40 4.550 4.017 0.533 1
1 436 . 19 1 1 A 40 40 GLY C C 40 173.090 173.700 -0.610 1
1 437 . 19 1 1 A 40 40 GLY CA C 40 44.180 46.416 -2.236 1
1 438 . 19 1 1 A 40 40 GLY N N 40 110.930 111.001 -0.071 1
1 439 . 19 1 1 A 41 41 GLU H H 41 8.320 7.634 0.686 1
1 440 . 19 1 1 A 41 41 GLU HA H 41 4.280 4.944 -0.664 1
1 445 . 19 1 1 A 41 41 GLU C C 41 173.900 175.196 -1.296 1
1 446 . 19 1 1 A 41 41 GLU CA C 41 56.900 54.620 2.280 1
1 447 . 19 1 1 A 41 41 GLU CB C 41 32.110 34.647 -2.537 1
1 449 . 19 1 1 A 41 41 GLU N N 41 126.730 116.869 9.861 1
1 450 . 19 1 1 A 42 42 VAL H H 42 8.100 8.502 -0.402 1
1 451 . 19 1 1 A 42 42 VAL HA H 42 5.160 5.106 0.054 1
1 459 . 19 1 1 A 42 42 VAL C C 42 176.340 174.899 1.441 1
1 460 . 19 1 1 A 42 42 VAL CA C 42 61.200 60.904 0.296 1
1 461 . 19 1 1 A 42 42 VAL CB C 42 34.770 34.510 0.260 1
1 464 . 19 1 1 A 42 42 VAL N N 42 119.360 121.370 -2.010 1
1 465 . 19 1 1 A 43 43 MET H H 43 9.870 9.345 0.525 1
1 466 . 19 1 1 A 43 43 MET HA H 43 5.070 5.445 -0.375 1
1 474 . 19 1 1 A 43 43 MET C C 43 173.890 174.878 -0.988 1
1 475 . 19 1 1 A 43 43 MET CA C 43 54.740 54.186 0.554 1
1 476 . 19 1 1 A 43 43 MET CB C 43 37.500 37.127 0.373 1
1 479 . 19 1 1 A 43 43 MET N N 43 125.720 124.824 0.896 1
1 480 . 19 1 1 A 44 44 VAL H H 44 8.800 8.881 -0.081 1
1 481 . 19 1 1 A 44 44 VAL HA H 44 4.720 4.639 0.081 1
1 489 . 19 1 1 A 44 44 VAL CA C 44 59.090 58.991 0.099 1
1 490 . 19 1 1 A 44 44 VAL CB C 44 33.710 35.570 -1.860 1
1 493 . 19 1 1 A 44 44 VAL N N 44 122.340 121.761 0.579 1
1 494 . 19 1 1 A 45 45 PRO HA H 45 4.480 4.552 -0.072 1
1 501 . 19 1 1 A 45 45 PRO C C 45 177.080 175.195 1.885 1
1 502 . 19 1 1 A 45 45 PRO CA C 45 63.240 64.000 -0.760 1
1 503 . 19 1 1 A 45 45 PRO CB C 45 32.170 31.665 0.505 1
1 506 . 19 1 1 A 46 46 THR H H 46 8.200 7.359 0.841 1
1 507 . 19 1 1 A 46 46 THR HA H 46 4.290 5.013 -0.723 1
1 512 . 19 1 1 A 46 46 THR C C 46 174.600 172.381 2.219 1
1 513 . 19 1 1 A 46 46 THR CA C 46 62.100 59.542 2.558 1
1 514 . 19 1 1 A 46 46 THR CB C 46 69.990 72.057 -2.067 1
1 516 . 19 1 1 A 46 46 THR N N 46 113.410 107.940 5.470 1
1 517 . 19 1 1 A 47 47 GLU H H 47 8.380 8.975 -0.595 1
1 518 . 19 1 1 A 47 47 GLU HA H 47 4.400 5.132 -0.732 1
1 521 . 19 1 1 A 47 47 GLU C C 47 175.970 175.817 0.153 1
1 522 . 19 1 1 A 47 47 GLU CA C 47 55.200 54.364 0.836 1
1 523 . 19 1 1 A 47 47 GLU CB C 47 32.300 33.372 -1.072 1
1 524 . 19 1 1 A 47 47 GLU N N 47 122.830 122.099 0.731 1
1 525 . 19 1 1 A 48 48 GLU H H 48 8.400 8.588 -0.188 1
1 526 . 19 1 1 A 48 48 GLU HA H 48 4.280 4.424 -0.144 1
1 531 . 19 1 1 A 48 48 GLU C C 48 175.750 176.641 -0.891 1
1 532 . 19 1 1 A 48 48 GLU CA C 48 55.190 57.052 -1.862 1
1 533 . 19 1 1 A 48 48 GLU CB C 48 31.980 30.080 1.900 1
1 535 . 19 1 1 A 48 48 GLU N N 48 121.950 125.331 -3.381 1
1 536 . 19 1 1 A 49 49 VAL H H 49 8.240 8.694 -0.454 1
1 537 . 19 1 1 A 49 49 VAL HA H 49 4.170 4.957 -0.787 1
1 542 . 19 1 1 A 49 49 VAL C C 49 174.610 174.895 -0.285 1
1 543 . 19 1 1 A 49 49 VAL CA C 49 62.280 59.586 2.694 1
1 544 . 19 1 1 A 49 49 VAL CB C 49 32.930 35.464 -2.534 1
1 546 . 19 1 1 A 49 49 VAL N N 49 123.990 117.290 6.700 1
1 547 . 19 1 1 A 50 50 VAL H H 50 8.230 8.657 -0.427 1
1 548 . 19 1 1 A 50 50 VAL HA H 50 4.220 4.421 -0.201 1
1 553 . 19 1 1 A 50 50 VAL C C 50 175.770 176.698 -0.928 1
1 554 . 19 1 1 A 50 50 VAL CA C 50 62.170 62.498 -0.328 1
1 555 . 19 1 1 A 50 50 VAL CB C 50 33.110 33.601 -0.491 1
1 557 . 19 1 1 A 50 50 VAL N N 50 123.960 120.035 3.925 1
1 558 . 19 1 1 A 51 51 GLU H H 51 8.570 8.536 0.034 1
1 559 . 19 1 1 A 51 51 GLU HA H 51 4.380 4.161 0.219 1
1 564 . 19 1 1 A 51 51 GLU C C 51 175.920 176.364 -0.444 1
1 565 . 19 1 1 A 51 51 GLU CA C 51 56.050 58.366 -2.316 1
1 566 . 19 1 1 A 51 51 GLU CB C 51 31.080 28.692 2.388 1
1 568 . 19 1 1 A 51 51 GLU N N 51 125.070 119.949 5.121 1
1 569 . 19 1 1 A 52 52 ILE H H 52 8.320 7.784 0.536 1
1 570 . 19 1 1 A 52 52 ILE HA H 52 4.290 4.448 -0.158 1
1 580 . 19 1 1 A 52 52 ILE C C 52 176.330 175.654 0.676 1
1 581 . 19 1 1 A 52 52 ILE CA C 52 60.940 60.447 0.493 1
1 582 . 19 1 1 A 52 52 ILE CB C 52 38.510 39.246 -0.736 1
1 586 . 19 1 1 A 52 52 ILE N N 52 122.760 119.960 2.800 1
1 587 . 19 1 1 A 53 53 ARG H H 53 8.500 8.987 -0.487 1
1 588 . 19 1 1 A 53 53 ARG HA H 53 4.430 4.060 0.370 1
1 595 . 19 1 1 A 53 53 ARG C C 53 176.950 176.943 0.007 1
1 596 . 19 1 1 A 53 53 ARG CA C 53 56.150 57.463 -1.313 1
1 597 . 19 1 1 A 53 53 ARG CB C 53 30.200 30.520 -0.320 1
1 600 . 19 1 1 A 53 53 ARG N N 53 125.250 129.702 -4.452 1
1 601 . 19 1 1 A 54 54 GLY H H 54 8.760 7.768 0.992 1
1 602 . 19 1 1 A 54 54 GLY HA2 H 54 3.920 4.042 -0.122 1
1 603 . 19 1 1 A 54 54 GLY HA3 H 54 4.010 4.044 -0.034 1
1 604 . 19 1 1 A 54 54 GLY C C 54 175.110 173.047 2.063 1
1 605 . 19 1 1 A 54 54 GLY CA C 54 46.030 44.347 1.683 1
1 606 . 19 1 1 A 54 54 GLY N N 54 112.510 105.999 6.511 1
1 607 . 19 1 1 A 55 55 GLY H H 55 8.350 8.251 0.099 1
1 608 . 19 1 1 A 55 55 GLY HA2 H 55 3.980 4.324 -0.344 1
1 609 . 19 1 1 A 55 55 GLY HA3 H 55 3.980 4.325 -0.345 1
1 610 . 19 1 1 A 55 55 GLY C C 55 173.920 174.842 -0.922 1
1 611 . 19 1 1 A 55 55 GLY CA C 55 45.200 44.590 0.610 1
1 612 . 19 1 1 A 55 55 GLY N N 55 107.940 108.888 -0.948 1
1 613 . 19 1 1 A 56 56 GLN H H 56 8.100 8.972 -0.872 1
1 614 . 19 1 1 A 56 56 GLN HA H 56 4.420 3.884 0.536 1
1 619 . 19 1 1 A 56 56 GLN C C 56 175.570 178.179 -2.609 1
1 620 . 19 1 1 A 56 56 GLN CA C 56 55.420 58.975 -3.555 1
1 621 . 19 1 1 A 56 56 GLN CB C 56 30.100 28.242 1.858 1
1 623 . 19 1 1 A 56 56 GLN N N 56 119.350 118.618 0.732 1
1 624 . 19 1 1 A 57 57 ARG H H 57 8.520 7.794 0.726 1
1 625 . 19 1 1 A 57 57 ARG HA H 57 4.400 4.062 0.338 1
1 632 . 19 1 1 A 57 57 ARG C C 57 176.210 175.536 0.674 1
1 633 . 19 1 1 A 57 57 ARG CA C 57 56.440 58.740 -2.300 1
1 634 . 19 1 1 A 57 57 ARG CB C 57 30.930 30.088 0.842 1
1 637 . 19 1 1 A 57 57 ARG N N 57 122.610 119.679 2.931 1
1 638 . 19 1 1 A 58 58 ARG H H 58 8.630 7.510 1.120 1
1 639 . 19 1 1 A 58 58 ARG HA H 58 4.430 4.806 -0.376 1
1 646 . 19 1 1 A 58 58 ARG C C 58 175.950 174.281 1.669 1
1 647 . 19 1 1 A 58 58 ARG CA C 58 55.450 54.691 0.759 1
1 648 . 19 1 1 A 58 58 ARG CB C 58 31.300 33.607 -2.307 1
1 651 . 19 1 1 A 58 58 ARG N N 58 123.320 117.552 5.768 1
1 652 . 19 1 1 A 59 59 LYS H H 59 8.560 8.611 -0.051 1
1 653 . 19 1 1 A 59 59 LYS HA H 59 4.410 4.797 -0.387 1
1 662 . 19 1 1 A 59 59 LYS C C 59 176.590 176.665 -0.075 1
1 663 . 19 1 1 A 59 59 LYS CA C 59 56.720 54.526 2.194 1
1 664 . 19 1 1 A 59 59 LYS CB C 59 33.150 35.865 -2.715 1
1 668 . 19 1 1 A 59 59 LYS N N 59 123.380 123.622 -0.242 1
1 669 . 19 1 1 A 60 60 SER H H 60 8.450 8.857 -0.407 1
1 670 . 19 1 1 A 60 60 SER HA H 60 4.480 4.071 0.409 1
1 673 . 19 1 1 A 60 60 SER C C 60 174.280 175.463 -1.183 1
1 674 . 19 1 1 A 60 60 SER CA C 60 58.140 62.209 -4.069 1
1 675 . 19 1 1 A 60 60 SER CB C 60 64.160 62.931 1.229 1
1 676 . 19 1 1 A 60 60 SER N N 60 117.320 119.472 -2.152 1
1 677 . 19 1 1 A 61 61 GLU H H 61 8.550 8.002 0.548 1
1 678 . 19 1 1 A 61 61 GLU HA H 61 4.400 4.420 -0.020 1
1 683 . 19 1 1 A 61 61 GLU C C 61 176.150 176.314 -0.164 1
1 684 . 19 1 1 A 61 61 GLU CA C 61 56.300 57.190 -0.890 1
1 685 . 19 1 1 A 61 61 GLU CB C 61 30.790 30.355 0.435 1
1 687 . 19 1 1 A 61 61 GLU N N 61 122.810 119.239 3.571 1
1 688 . 19 1 1 A 62 62 ARG H H 62 8.310 8.691 -0.381 1
1 689 . 19 1 1 A 62 62 ARG HA H 62 4.340 4.668 -0.328 1
1 692 . 19 1 1 A 62 62 ARG C C 62 176.140 176.136 0.004 1
1 693 . 19 1 1 A 62 62 ARG CA C 62 56.230 54.199 2.031 1
1 694 . 19 1 1 A 62 62 ARG CB C 62 30.780 32.449 -1.669 1
1 695 . 19 1 1 A 62 62 ARG N N 62 122.080 122.600 -0.520 1
1 696 . 19 1 1 A 63 63 LYS H H 63 8.470 8.356 0.114 1
1 697 . 19 1 1 A 63 63 LYS HA H 63 4.300 4.160 0.140 1
1 700 . 19 1 1 A 63 63 LYS C C 63 175.490 177.976 -2.486 1
1 701 . 19 1 1 A 63 63 LYS CA C 63 56.200 56.974 -0.774 1
1 702 . 19 1 1 A 63 63 LYS CB C 63 30.730 32.244 -1.514 1
1 703 . 19 1 1 A 63 63 LYS N N 63 123.450 123.472 -0.022 1
1 704 . 19 1 1 A 64 64 PHE H H 64 8.200 7.213 0.987 1
1 705 . 19 1 1 A 64 64 PHE HA H 64 4.450 3.943 0.507 1
1 710 . 19 1 1 A 64 64 PHE C C 64 174.250 175.644 -1.394 1
1 711 . 19 1 1 A 64 64 PHE CA C 64 57.430 59.166 -1.736 1
1 712 . 19 1 1 A 64 64 PHE CB C 64 40.330 37.681 2.649 1
1 715 . 19 1 1 A 64 64 PHE N N 64 121.740 117.970 3.770 1
1 716 . 19 1 1 A 65 65 PHE H H 65 8.130 7.581 0.549 1
1 717 . 19 1 1 A 65 65 PHE HA H 65 4.440 4.763 -0.323 1
1 725 . 19 1 1 A 65 65 PHE CA C 65 55.650 55.037 0.613 1
1 726 . 19 1 1 A 65 65 PHE CB C 65 38.900 38.626 0.274 1
1 731 . 19 1 1 A 65 65 PHE N N 65 120.910 114.895 6.015 1
1 732 . 19 1 1 A 66 66 PRO C C 66 176.780 177.780 -1.000 1
1 733 . 19 1 1 A 67 67 GLY H H 67 9.970 8.918 1.052 1
1 734 . 19 1 1 A 67 67 GLY HA2 H 67 3.820 4.029 -0.209 1
1 735 . 19 1 1 A 67 67 GLY HA3 H 67 4.400 4.061 0.339 1
1 736 . 19 1 1 A 67 67 GLY C C 67 173.670 173.688 -0.018 1
1 737 . 19 1 1 A 67 67 GLY CA C 67 45.900 45.653 0.247 1
1 738 . 19 1 1 A 67 67 GLY N N 67 111.550 111.191 0.359 1
1 739 . 19 1 1 A 68 68 TYR H H 68 7.650 8.045 -0.395 1
1 740 . 19 1 1 A 68 68 TYR HA H 68 5.000 4.801 0.199 1
1 747 . 19 1 1 A 68 68 TYR C C 68 175.220 174.712 0.508 1
1 748 . 19 1 1 A 68 68 TYR CA C 68 57.940 57.209 0.731 1
1 753 . 19 1 1 A 68 68 TYR N N 68 118.800 119.342 -0.542 1
1 754 . 19 1 1 A 69 69 VAL H H 69 9.090 9.043 0.047 1
1 755 . 19 1 1 A 69 69 VAL HA H 69 4.330 4.782 -0.452 1
1 763 . 19 1 1 A 69 69 VAL C C 69 174.250 174.848 -0.598 1
1 764 . 19 1 1 A 69 69 VAL CA C 69 62.120 60.301 1.819 1
1 765 . 19 1 1 A 69 69 VAL CB C 69 35.240 35.756 -0.516 1
1 768 . 19 1 1 A 69 69 VAL N N 69 119.300 122.841 -3.541 1
1 769 . 19 1 1 A 70 70 LEU H H 70 9.190 8.863 0.327 1
1 770 . 19 1 1 A 70 70 LEU HA H 70 5.460 5.436 0.024 1
1 780 . 19 1 1 A 70 70 LEU C C 70 176.130 176.237 -0.107 1
1 781 . 19 1 1 A 70 70 LEU CA C 70 54.120 53.353 0.767 1
1 782 . 19 1 1 A 70 70 LEU CB C 70 43.330 43.272 0.058 1
1 786 . 19 1 1 A 70 70 LEU N N 70 126.710 126.666 0.044 1
1 787 . 19 1 1 A 71 71 VAL H H 71 9.350 9.286 0.064 1
1 788 . 19 1 1 A 71 71 VAL HA H 71 5.040 4.998 0.042 1
1 796 . 19 1 1 A 71 71 VAL C C 71 173.670 174.738 -1.068 1
1 797 . 19 1 1 A 71 71 VAL CA C 71 61.090 61.285 -0.195 1
1 798 . 19 1 1 A 71 71 VAL CB C 71 35.800 35.587 0.213 1
1 801 . 19 1 1 A 71 71 VAL N N 71 121.920 124.660 -2.740 1
1 802 . 19 1 1 A 72 72 GLN H H 72 8.390 8.497 -0.107 1
1 803 . 19 1 1 A 72 72 GLN HA H 72 4.610 3.896 0.714 1
1 810 . 19 1 1 A 72 72 GLN C C 72 175.920 174.563 1.357 1
1 811 . 19 1 1 A 72 72 GLN CA C 72 53.810 55.534 -1.724 1
1 812 . 19 1 1 A 72 72 GLN CB C 72 28.850 28.703 0.147 1
1 814 . 19 1 1 A 72 72 GLN N N 72 130.760 127.342 3.418 1
1 816 . 19 1 1 A 73 73 MET H H 73 9.750 8.617 1.133 1
1 817 . 19 1 1 A 73 73 MET HA H 73 5.060 5.064 -0.004 1
1 825 . 19 1 1 A 73 73 MET C C 73 175.500 174.183 1.317 1
1 826 . 19 1 1 A 73 73 MET CA C 73 55.520 54.601 0.919 1
1 827 . 19 1 1 A 73 73 MET CB C 73 35.350 35.339 0.011 1
1 830 . 19 1 1 A 73 73 MET N N 73 121.070 123.344 -2.274 1
1 831 . 19 1 1 A 74 74 VAL H H 74 8.530 8.435 0.095 1
1 832 . 19 1 1 A 74 74 VAL HA H 74 3.970 4.903 -0.933 1
1 840 . 19 1 1 A 74 74 VAL C C 74 174.900 174.644 0.256 1
1 841 . 19 1 1 A 74 74 VAL CA C 74 62.150 59.874 2.276 1
1 842 . 19 1 1 A 74 74 VAL CB C 74 32.480 33.894 -1.414 1
1 845 . 19 1 1 A 74 74 VAL N N 74 124.120 119.166 4.954 1
1 846 . 19 1 1 A 75 75 MET H H 75 8.600 8.655 -0.055 1
1 847 . 19 1 1 A 75 75 MET HA H 75 4.360 4.965 -0.605 1
1 855 . 19 1 1 A 75 75 MET C C 75 173.480 175.065 -1.585 1
1 856 . 19 1 1 A 75 75 MET CA C 75 53.830 54.155 -0.325 1
1 857 . 19 1 1 A 75 75 MET CB C 75 29.960 33.513 -3.553 1
1 860 . 19 1 1 A 75 75 MET N N 75 128.250 121.917 6.333 1
1 861 . 19 1 1 A 76 76 ASN H H 76 8.410 8.946 -0.536 1
1 862 . 19 1 1 A 76 76 ASN HA H 76 4.540 5.024 -0.484 1
1 867 . 19 1 1 A 76 76 ASN C C 76 173.950 174.452 -0.502 1
1 868 . 19 1 1 A 76 76 ASN CA C 76 51.720 52.114 -0.394 1
1 869 . 19 1 1 A 76 76 ASN CB C 76 38.430 39.806 -1.376 1
1 870 . 19 1 1 A 76 76 ASN N N 76 127.500 121.054 6.446 1
1 872 . 19 1 1 A 77 77 ASP H H 77 8.470 8.654 -0.184 1
1 873 . 19 1 1 A 77 77 ASP HA H 77 4.410 5.031 -0.621 1
1 876 . 19 1 1 A 77 77 ASP C C 77 178.530 176.738 1.792 1
1 877 . 19 1 1 A 77 77 ASP CA C 77 58.730 53.941 4.789 1
1 878 . 19 1 1 A 77 77 ASP CB C 77 40.940 41.068 -0.128 1
1 879 . 19 1 1 A 77 77 ASP N N 77 117.090 116.204 0.886 1
1 880 . 19 1 1 A 78 78 ALA H H 78 8.160 8.036 0.124 1
1 881 . 19 1 1 A 78 78 ALA HA H 78 4.350 4.670 -0.320 1
1 885 . 19 1 1 A 78 78 ALA C C 78 181.250 178.623 2.627 1
1 886 . 19 1 1 A 78 78 ALA CA C 78 55.190 53.584 1.606 1
1 887 . 19 1 1 A 78 78 ALA CB C 78 18.260 20.862 -2.602 1
1 888 . 19 1 1 A 78 78 ALA N N 78 122.500 122.944 -0.444 1
1 889 . 19 1 1 A 79 79 SER H H 79 9.320 9.216 0.104 1
1 890 . 19 1 1 A 79 79 SER HA H 79 4.290 4.417 -0.127 1
1 893 . 19 1 1 A 79 79 SER C C 79 176.570 176.862 -0.292 1
1 894 . 19 1 1 A 79 79 SER CA C 79 61.080 61.342 -0.262 1
1 895 . 19 1 1 A 79 79 SER CB C 79 62.200 62.634 -0.434 1
1 896 . 19 1 1 A 79 79 SER N N 79 119.280 113.640 5.640 1
1 897 . 19 1 1 A 80 80 TRP H H 80 8.900 7.747 1.153 1
1 898 . 19 1 1 A 80 80 TRP HA H 80 4.020 4.320 -0.300 1
1 907 . 19 1 1 A 80 80 TRP C C 80 178.210 178.366 -0.156 1
1 908 . 19 1 1 A 80 80 TRP CA C 80 62.490 61.255 1.235 1
1 909 . 19 1 1 A 80 80 TRP CB C 80 29.800 29.352 0.448 1
1 915 . 19 1 1 A 80 80 TRP N N 80 125.870 124.822 1.048 1
1 917 . 19 1 1 A 81 81 HIS H H 81 8.190 8.420 -0.230 1
1 918 . 19 1 1 A 81 81 HIS HA H 81 3.930 4.296 -0.366 1
1 923 . 19 1 1 A 81 81 HIS C C 81 177.740 177.856 -0.116 1
1 924 . 19 1 1 A 81 81 HIS CA C 81 61.020 59.767 1.253 1
1 925 . 19 1 1 A 81 81 HIS CB C 81 28.910 30.659 -1.749 1
1 927 . 19 1 1 A 81 81 HIS N N 81 114.080 117.257 -3.177 1
1 928 . 19 1 1 A 82 82 LEU H H 82 8.080 8.127 -0.047 1
1 929 . 19 1 1 A 82 82 LEU HA H 82 3.900 3.728 0.172 1
1 939 . 19 1 1 A 82 82 LEU C C 82 180.330 178.386 1.944 1
1 940 . 19 1 1 A 82 82 LEU CA C 82 58.590 58.110 0.480 1
1 941 . 19 1 1 A 82 82 LEU CB C 82 41.350 41.426 -0.076 1
1 945 . 19 1 1 A 82 82 LEU N N 82 121.320 121.143 0.177 1
1 946 . 19 1 1 A 83 83 VAL H H 83 8.000 8.102 -0.102 1
1 947 . 19 1 1 A 83 83 VAL HA H 83 3.210 3.538 -0.328 1
1 955 . 19 1 1 A 83 83 VAL C C 83 177.060 178.386 -1.326 1
1 956 . 19 1 1 A 83 83 VAL CA C 83 67.430 66.325 1.105 1
1 957 . 19 1 1 A 83 83 VAL CB C 83 31.680 31.588 0.092 1
1 960 . 19 1 1 A 83 83 VAL N N 83 118.850 118.687 0.163 1
1 961 . 19 1 1 A 84 84 ARG H H 84 7.540 7.653 -0.113 1
1 962 . 19 1 1 A 84 84 ARG HA H 84 3.590 3.688 -0.098 1
1 969 . 19 1 1 A 84 84 ARG C C 84 177.240 178.777 -1.537 1
1 970 . 19 1 1 A 84 84 ARG CA C 84 56.050 59.642 -3.592 1
1 971 . 19 1 1 A 84 84 ARG CB C 84 28.190 29.556 -1.366 1
1 974 . 19 1 1 A 84 84 ARG N N 84 111.460 120.705 -9.245 1
1 975 . 19 1 1 A 85 85 SER H H 85 7.530 7.687 -0.157 1
1 976 . 19 1 1 A 85 85 SER HA H 85 4.280 4.227 0.053 1
1 979 . 19 1 1 A 85 85 SER C C 85 173.930 174.769 -0.839 1
1 980 . 19 1 1 A 85 85 SER CA C 85 59.220 60.554 -1.334 1
1 981 . 19 1 1 A 85 85 SER CB C 85 63.830 62.831 0.999 1
1 982 . 19 1 1 A 85 85 SER N N 85 113.660 113.958 -0.298 1
1 983 . 19 1 1 A 86 86 VAL H H 86 7.230 7.399 -0.169 1
1 984 . 19 1 1 A 86 86 VAL HA H 86 3.480 3.992 -0.512 1
1 992 . 19 1 1 A 86 86 VAL CA C 86 61.300 61.219 0.081 1
1 993 . 19 1 1 A 86 86 VAL CB C 86 31.780 32.343 -0.563 1
1 996 . 19 1 1 A 86 86 VAL N N 86 128.120 125.475 2.645 1
1 997 . 19 1 1 A 87 87 PRO HA H 87 4.140 4.405 -0.265 1
1 1004 . 19 1 1 A 87 87 PRO C C 87 176.400 176.754 -0.354 1
1 1005 . 19 1 1 A 87 87 PRO CA C 87 64.100 63.151 0.949 1
1 1006 . 19 1 1 A 87 87 PRO CB C 87 31.710 32.370 -0.660 1
1 1009 . 19 1 1 A 88 88 ARG H H 88 8.320 8.759 -0.439 1
1 1010 . 19 1 1 A 88 88 ARG HA H 88 3.030 3.956 -0.926 1
1 1017 . 19 1 1 A 88 88 ARG C C 88 174.630 174.562 0.068 1
1 1018 . 19 1 1 A 88 88 ARG CA C 88 57.620 57.430 0.190 1
1 1019 . 19 1 1 A 88 88 ARG CB C 88 26.960 28.003 -1.043 1
1 1022 . 19 1 1 A 88 88 ARG N N 88 111.360 116.059 -4.699 1
1 1023 . 19 1 1 A 89 89 VAL H H 89 7.390 7.855 -0.465 1
1 1024 . 19 1 1 A 89 89 VAL HA H 89 3.910 4.419 -0.509 1
1 1032 . 19 1 1 A 89 89 VAL C C 89 177.370 175.847 1.523 1
1 1033 . 19 1 1 A 89 89 VAL CA C 89 64.170 59.531 4.639 1
1 1034 . 19 1 1 A 89 89 VAL CB C 89 32.070 34.010 -1.940 1
1 1037 . 19 1 1 A 89 89 VAL N N 89 117.900 118.603 -0.703 1
1 1038 . 19 1 1 A 90 90 MET H H 90 9.290 8.984 0.306 1
1 1039 . 19 1 1 A 90 90 MET HA H 90 4.340 4.046 0.294 1
1 1047 . 19 1 1 A 90 90 MET C C 90 175.800 175.911 -0.111 1
1 1048 . 19 1 1 A 90 90 MET CA C 90 56.440 56.726 -0.286 1
1 1049 . 19 1 1 A 90 90 MET CB C 90 34.160 33.012 1.148 1
1 1052 . 19 1 1 A 90 90 MET N N 90 128.200 126.427 1.773 1
1 1053 . 19 1 1 A 91 91 GLY H H 91 7.130 6.703 0.427 1
1 1054 . 19 1 1 A 91 91 GLY HA2 H 91 3.340 3.924 -0.584 1
1 1055 . 19 1 1 A 91 91 GLY HA3 H 91 4.410 4.025 0.385 1
1 1056 . 19 1 1 A 91 91 GLY C C 91 170.920 171.624 -0.704 1
1 1057 . 19 1 1 A 91 91 GLY CA C 91 44.440 45.409 -0.969 1
1 1058 . 19 1 1 A 91 91 GLY N N 91 104.320 103.893 0.427 1
1 1059 . 19 1 1 A 92 92 PHE H H 92 8.790 8.444 0.346 1
1 1060 . 19 1 1 A 92 92 PHE HA H 92 5.270 5.100 0.170 1
1 1068 . 19 1 1 A 92 92 PHE C C 92 176.230 175.250 0.980 1
1 1069 . 19 1 1 A 92 92 PHE CA C 92 57.480 57.078 0.402 1
1 1070 . 19 1 1 A 92 92 PHE CB C 92 42.190 42.455 -0.265 1
1 1075 . 19 1 1 A 92 92 PHE N N 92 118.770 120.100 -1.330 1
1 1076 . 19 1 1 A 93 93 ILE H H 93 8.800 8.553 0.247 1
1 1077 . 19 1 1 A 93 93 ILE HA H 93 4.310 5.036 -0.726 1
1 1087 . 19 1 1 A 93 93 ILE C C 93 176.380 175.576 0.804 1
1 1088 . 19 1 1 A 93 93 ILE CA C 93 60.480 60.031 0.449 1
1 1089 . 19 1 1 A 93 93 ILE CB C 93 38.010 40.788 -2.778 1
1 1093 . 19 1 1 A 93 93 ILE N N 93 122.300 120.956 1.344 1
1 1094 . 19 1 1 A 94 94 GLY H H 94 8.640 8.496 0.144 1
1 1095 . 19 1 1 A 94 94 GLY HA2 H 94 3.830 4.230 -0.400 1
1 1096 . 19 1 1 A 94 94 GLY HA3 H 94 4.600 4.248 0.352 1
1 1097 . 19 1 1 A 94 94 GLY C C 94 175.080 174.599 0.481 1
1 1098 . 19 1 1 A 94 94 GLY CA C 94 44.530 44.605 -0.075 1
1 1099 . 19 1 1 A 94 94 GLY N N 94 116.550 112.628 3.922 1
1 1100 . 19 1 1 A 95 95 GLY H H 95 8.900 8.735 0.165 1
1 1101 . 19 1 1 A 95 95 GLY HA2 H 95 3.970 3.851 0.119 1
1 1102 . 19 1 1 A 95 95 GLY HA3 H 95 4.370 3.856 0.514 1
1 1103 . 19 1 1 A 95 95 GLY C C 95 174.560 173.562 0.998 1
1 1104 . 19 1 1 A 95 95 GLY CA C 95 45.640 47.517 -1.877 1
1 1105 . 19 1 1 A 95 95 GLY N N 95 112.960 112.056 0.904 1
1 1106 . 19 1 1 A 96 96 THR H H 96 7.830 7.726 0.104 1
1 1107 . 19 1 1 A 96 96 THR HA H 96 4.720 4.639 0.081 1
1 1112 . 19 1 1 A 96 96 THR C C 96 176.260 173.490 2.770 1
1 1113 . 19 1 1 A 96 96 THR CA C 96 60.360 59.882 0.478 1
1 1114 . 19 1 1 A 96 96 THR CB C 96 70.960 70.631 0.329 1
1 1116 . 19 1 1 A 96 96 THR N N 96 113.350 118.557 -5.207 1
1 1117 . 19 1 1 A 97 97 SER H H 97 8.850 8.857 -0.007 1
1 1118 . 19 1 1 A 97 97 SER HA H 97 4.310 4.714 -0.404 1
1 1121 . 19 1 1 A 97 97 SER C C 97 175.570 174.719 0.851 1
1 1122 . 19 1 1 A 97 97 SER CA C 97 60.850 59.039 1.811 1
1 1123 . 19 1 1 A 97 97 SER CB C 97 63.000 63.252 -0.252 1
1 1124 . 19 1 1 A 97 97 SER N N 97 116.420 118.738 -2.318 1
1 1125 . 19 1 1 A 98 98 ASP H H 98 8.360 8.688 -0.328 1
1 1126 . 19 1 1 A 98 98 ASP HA H 98 4.310 5.268 -0.958 1
1 1129 . 19 1 1 A 98 98 ASP C C 98 175.380 175.619 -0.239 1
1 1130 . 19 1 1 A 98 98 ASP CA C 98 54.190 55.254 -1.064 1
1 1131 . 19 1 1 A 98 98 ASP CB C 98 40.740 43.602 -2.862 1
1 1132 . 19 1 1 A 98 98 ASP N N 98 116.320 120.677 -4.357 1
1 1133 . 19 1 1 A 99 99 ARG H H 99 7.450 7.765 -0.315 1
1 1134 . 19 1 1 A 99 99 ARG HA H 99 4.350 4.633 -0.283 1
1 1141 . 19 1 1 A 99 99 ARG CA C 99 52.920 53.475 -0.555 1
1 1142 . 19 1 1 A 99 99 ARG CB C 99 30.340 30.907 -0.567 1
1 1145 . 19 1 1 A 99 99 ARG N N 99 119.960 117.613 2.347 1
1 1146 . 19 1 1 A 100 100 PRO HA H 100 4.750 4.705 0.045 1
1 1153 . 19 1 1 A 100 100 PRO C C 100 175.220 177.123 -1.903 1
1 1154 . 19 1 1 A 100 100 PRO CA C 100 62.680 62.645 0.035 1
1 1155 . 19 1 1 A 100 100 PRO CB C 100 32.820 31.803 1.017 1
1 1158 . 19 1 1 A 101 101 ALA H H 101 7.210 8.423 -1.213 1
1 1159 . 19 1 1 A 101 101 ALA HA H 101 5.030 4.650 0.380 1
1 1163 . 19 1 1 A 101 101 ALA CA C 101 48.570 50.130 -1.560 1
1 1164 . 19 1 1 A 101 101 ALA CB C 101 19.660 16.937 2.723 1
1 1165 . 19 1 1 A 101 101 ALA N N 101 124.490 124.643 -0.153 1
1 1166 . 19 1 1 A 102 102 PRO HA H 102 4.440 4.286 0.154 1
1 1173 . 19 1 1 A 102 102 PRO C C 102 177.200 176.378 0.822 1
1 1174 . 19 1 1 A 102 102 PRO CA C 102 62.190 62.668 -0.478 1
1 1175 . 19 1 1 A 102 102 PRO CB C 102 32.310 32.585 -0.275 1
1 1178 . 19 1 1 A 103 103 ILE H H 103 8.550 7.770 0.780 1
1 1179 . 19 1 1 A 103 103 ILE HA H 103 4.630 4.824 -0.194 1
1 1189 . 19 1 1 A 103 103 ILE C C 103 175.460 175.413 0.047 1
1 1190 . 19 1 1 A 103 103 ILE CA C 103 59.730 58.473 1.257 1
1 1191 . 19 1 1 A 103 103 ILE CB C 103 40.140 41.644 -1.504 1
1 1195 . 19 1 1 A 103 103 ILE N N 103 115.670 116.110 -0.440 1
1 1196 . 19 1 1 A 104 104 SER H H 104 8.730 8.593 0.137 1
1 1197 . 19 1 1 A 104 104 SER HA H 104 4.500 4.537 -0.037 1
1 1200 . 19 1 1 A 104 104 SER C C 104 174.840 175.268 -0.428 1
1 1201 . 19 1 1 A 104 104 SER CA C 104 58.010 58.725 -0.715 1
1 1202 . 19 1 1 A 104 104 SER CB C 104 65.470 63.669 1.801 1
1 1203 . 19 1 1 A 104 104 SER N N 104 119.170 120.092 -0.922 1
1 1204 . 19 1 1 A 105 105 ASP H H 105 8.830 8.995 -0.165 1
1 1205 . 19 1 1 A 105 105 ASP HA H 105 4.200 4.234 -0.034 1
1 1208 . 19 1 1 A 105 105 ASP C C 105 178.520 178.330 0.190 1
1 1209 . 19 1 1 A 105 105 ASP CA C 105 57.870 57.814 0.056 1
1 1210 . 19 1 1 A 105 105 ASP CB C 105 40.040 40.285 -0.245 1
1 1211 . 19 1 1 A 105 105 ASP N N 105 121.640 125.311 -3.671 1
1 1212 . 19 1 1 A 106 106 LYS H H 106 8.130 8.030 0.100 1
1 1213 . 19 1 1 A 106 106 LYS HA H 106 4.100 3.885 0.215 1
1 1222 . 19 1 1 A 106 106 LYS C C 106 179.400 178.647 0.753 1
1 1223 . 19 1 1 A 106 106 LYS CA C 106 58.980 59.520 -0.540 1
1 1224 . 19 1 1 A 106 106 LYS CB C 106 32.330 32.118 0.212 1
1 1228 . 19 1 1 A 106 106 LYS N N 106 118.300 120.814 -2.514 1
1 1229 . 19 1 1 A 107 107 GLU H H 107 7.670 7.913 -0.243 1
1 1230 . 19 1 1 A 107 107 GLU HA H 107 4.020 4.064 -0.044 1
1 1235 . 19 1 1 A 107 107 GLU C C 107 178.750 179.575 -0.825 1
1 1236 . 19 1 1 A 107 107 GLU CA C 107 59.210 59.148 0.062 1
1 1237 . 19 1 1 A 107 107 GLU CB C 107 29.780 29.501 0.279 1
1 1239 . 19 1 1 A 107 107 GLU N N 107 121.270 119.105 2.165 1
1 1240 . 19 1 1 A 108 108 VAL H H 108 7.790 7.674 0.116 1
1 1241 . 19 1 1 A 108 108 VAL HA H 108 3.050 3.402 -0.352 1
1 1249 . 19 1 1 A 108 108 VAL C C 108 177.550 177.270 0.280 1
1 1250 . 19 1 1 A 108 108 VAL CA C 108 67.080 66.280 0.800 1
1 1251 . 19 1 1 A 108 108 VAL CB C 108 31.220 31.019 0.201 1
1 1254 . 19 1 1 A 108 108 VAL N N 108 120.940 121.355 -0.415 1
1 1255 . 19 1 1 A 109 109 ASP H H 109 7.840 8.029 -0.189 1
1 1256 . 19 1 1 A 109 109 ASP HA H 109 4.110 4.232 -0.122 1
1 1259 . 19 1 1 A 109 109 ASP C C 109 178.190 178.747 -0.557 1
1 1260 . 19 1 1 A 109 109 ASP CA C 109 57.470 57.098 0.372 1
1 1261 . 19 1 1 A 109 109 ASP CB C 109 40.480 39.842 0.638 1
1 1262 . 19 1 1 A 109 109 ASP N N 109 118.780 120.318 -1.538 1
1 1263 . 19 1 1 A 110 110 ALA H H 110 7.520 8.172 -0.652 1
1 1264 . 19 1 1 A 110 110 ALA HA H 110 4.110 4.065 0.045 1
1 1268 . 19 1 1 A 110 110 ALA C C 110 180.550 179.954 0.596 1
1 1269 . 19 1 1 A 110 110 ALA CA C 110 54.880 55.136 -0.256 1
1 1270 . 19 1 1 A 110 110 ALA CB C 110 18.440 18.396 0.044 1
1 1271 . 19 1 1 A 110 110 ALA N N 110 120.640 122.397 -1.757 1
1 1272 . 19 1 1 A 111 111 ILE H H 111 7.840 7.832 0.008 1
1 1273 . 19 1 1 A 111 111 ILE HA H 111 3.580 3.850 -0.270 1
1 1281 . 19 1 1 A 111 111 ILE C C 111 177.470 177.992 -0.522 1
1 1282 . 19 1 1 A 111 111 ILE CA C 111 64.620 65.190 -0.570 1
1 1283 . 19 1 1 A 111 111 ILE CB C 111 38.600 37.781 0.819 1
1 1286 . 19 1 1 A 111 111 ILE N N 111 119.840 118.090 1.750 1
1 1287 . 19 1 1 A 112 112 MET H H 112 8.100 7.869 0.231 1
1 1288 . 19 1 1 A 112 112 MET HA H 112 4.400 4.160 0.240 1
1 1296 . 19 1 1 A 112 112 MET C C 112 177.710 178.312 -0.602 1
1 1297 . 19 1 1 A 112 112 MET CA C 112 55.300 58.991 -3.691 1
1 1298 . 19 1 1 A 112 112 MET CB C 112 30.510 32.989 -2.479 1
1 1301 . 19 1 1 A 112 112 MET N N 112 115.180 118.389 -3.209 1
1 1302 . 19 1 1 A 113 113 ASN H H 113 8.070 8.856 -0.786 1
1 1303 . 19 1 1 A 113 113 ASN HA H 113 4.570 4.376 0.194 1
1 1308 . 19 1 1 A 113 113 ASN C C 113 175.530 177.689 -2.159 1
1 1309 . 19 1 1 A 113 113 ASN CA C 113 54.420 56.685 -2.265 1
1 1310 . 19 1 1 A 113 113 ASN CB C 113 38.350 39.426 -1.076 1
1 1311 . 19 1 1 A 113 113 ASN N N 113 117.190 118.912 -1.722 1
1 1313 . 19 1 1 A 114 114 ARG H H 114 8.070 7.874 0.196 1
1 1314 . 19 1 1 A 114 114 ARG HA H 114 4.280 3.789 0.491 1
1 1321 . 19 1 1 A 114 114 ARG C C 114 176.620 178.409 -1.789 1
1 1322 . 19 1 1 A 114 114 ARG CA C 114 56.910 58.987 -2.077 1
1 1323 . 19 1 1 A 114 114 ARG CB C 114 30.370 29.781 0.589 1
1 1326 . 19 1 1 A 114 114 ARG N N 114 118.360 118.891 -0.531 1
1 1327 . 19 1 1 A 115 115 LEU H H 115 8.100 7.782 0.318 1
1 1328 . 19 1 1 A 115 115 LEU HA H 115 4.310 4.023 0.287 1
1 1338 . 19 1 1 A 115 115 LEU C C 115 177.440 178.323 -0.883 1
1 1339 . 19 1 1 A 115 115 LEU CA C 115 55.440 57.880 -2.440 1
1 1340 . 19 1 1 A 115 115 LEU CB C 115 42.250 41.633 0.617 1
1 1344 . 19 1 1 A 115 115 LEU N N 115 120.580 121.429 -0.849 1
1 1345 . 19 1 1 A 116 116 GLN H H 116 8.180 7.716 0.464 1
1 1346 . 19 1 1 A 116 116 GLN HA H 116 4.360 4.069 0.291 1
1 1353 . 19 1 1 A 116 116 GLN C C 116 175.890 176.658 -0.768 1
1 1354 . 19 1 1 A 116 116 GLN CA C 116 55.810 59.041 -3.231 1
1 1355 . 19 1 1 A 116 116 GLN CB C 116 29.500 28.206 1.294 1
1 1357 . 19 1 1 A 116 116 GLN N N 116 119.770 117.866 1.904 1
1 1358 . 19 1 1 A 117 117 GLN H H 117 8.350 7.972 0.378 1
1 1359 . 19 1 1 A 117 117 GLN HA H 117 4.380 4.317 0.063 1
1 1366 . 19 1 1 A 117 117 GLN C C 117 176.130 174.970 1.160 1
1 1367 . 19 1 1 A 117 117 GLN CA C 117 55.810 55.911 -0.101 1
1 1368 . 19 1 1 A 117 117 GLN CB C 117 29.500 29.503 -0.003 1
1 1370 . 19 1 1 A 117 117 GLN N N 117 121.440 119.889 1.551 1
1 1371 . 19 1 1 A 118 118 VAL H H 118 8.240 8.647 -0.407 1
1 1372 . 19 1 1 A 118 118 VAL HA H 118 4.120 4.582 -0.462 1
1 1380 . 19 1 1 A 118 118 VAL C C 118 176.650 177.370 -0.720 1
1 1381 . 19 1 1 A 118 118 VAL CA C 118 62.720 60.641 2.079 1
1 1382 . 19 1 1 A 118 118 VAL CB C 118 32.730 35.274 -2.544 1
1 1385 . 19 1 1 A 118 118 VAL N N 118 121.250 126.725 -5.475 1
1 1386 . 19 1 1 A 119 119 GLY H H 119 8.460 8.707 -0.247 1
1 1387 . 19 1 1 A 119 119 GLY HA2 H 119 3.990 3.849 0.141 1
1 1388 . 19 1 1 A 119 119 GLY HA3 H 119 3.990 3.860 0.130 1
1 1389 . 19 1 1 A 119 119 GLY C C 119 173.770 174.237 -0.467 1
1 1390 . 19 1 1 A 119 119 GLY CA C 119 45.260 47.089 -1.829 1
1 1391 . 19 1 1 A 119 119 GLY N N 119 112.300 113.650 -1.350 1
1 1392 . 19 1 1 A 120 120 ASP H H 120 8.230 7.852 0.378 1
1 1393 . 19 1 1 A 120 120 ASP HA H 120 4.580 4.777 -0.197 1
1 1396 . 19 1 1 A 120 120 ASP C C 120 175.180 176.095 -0.915 1
1 1397 . 19 1 1 A 120 120 ASP CA C 120 54.340 53.797 0.543 1
1 1398 . 19 1 1 A 120 120 ASP CB C 120 41.390 41.890 -0.500 1
1 1399 . 19 1 1 A 120 120 ASP N N 120 120.420 120.806 -0.386 1
1 1400 . 19 1 1 A 121 121 LYS H H 121 7.950 8.544 -0.594 1
1 1401 . 19 1 1 A 121 121 LYS HA H 121 4.240 4.910 -0.670 1
1 1402 . 19 1 1 A 121 121 LYS CA C 121 53.620 53.158 0.462 1
1 1403 . 19 1 1 A 121 121 LYS N N 121 119.110 123.354 -4.244 1
1 1404 . 19 1 1 A 122 122 PRO HA H 122 4.410 4.310 0.100 1
1 1405 . 19 1 1 A 122 122 PRO C C 122 176.560 176.833 -0.273 1
1 1406 . 19 1 1 A 122 122 PRO CA C 122 63.130 64.264 -1.134 1
1 2 . 20 1 1 A 2 2 SER H H 2 7.890 8.619 -0.729 1
1 3 . 20 1 1 A 2 2 SER HA H 2 4.270 5.331 -1.061 1
1 4 . 20 1 1 A 2 2 SER C C 2 173.960 172.593 1.367 1
1 5 . 20 1 1 A 2 2 SER CA C 2 60.800 56.902 3.898 1
1 6 . 20 1 1 A 2 2 SER N N 2 111.940 115.983 -4.043 1
1 7 . 20 1 1 A 3 3 GLU H H 3 8.010 8.882 -0.872 1
1 8 . 20 1 1 A 3 3 GLU HA H 3 4.360 5.165 -0.805 1
1 9 . 20 1 1 A 3 3 GLU C C 3 175.710 176.136 -0.426 1
1 10 . 20 1 1 A 3 3 GLU CA C 3 56.310 54.985 1.325 1
1 11 . 20 1 1 A 3 3 GLU N N 3 121.280 125.273 -3.993 1
1 12 . 20 1 1 A 4 4 ALA H H 4 8.540 8.752 -0.212 1
1 13 . 20 1 1 A 4 4 ALA HA H 4 4.560 4.764 -0.204 1
1 14 . 20 1 1 A 4 4 ALA CA C 4 50.630 50.272 0.358 1
1 15 . 20 1 1 A 4 4 ALA N N 4 127.840 128.312 -0.472 1
1 16 . 20 1 1 A 5 5 PRO HA H 5 4.420 4.601 -0.181 1
1 17 . 20 1 1 A 5 5 PRO C C 5 174.240 176.087 -1.847 1
1 18 . 20 1 1 A 5 5 PRO CA C 5 62.840 62.760 0.080 1
1 19 . 20 1 1 A 6 6 LYS H H 6 8.320 8.485 -0.165 1
1 20 . 20 1 1 A 6 6 LYS HA H 6 4.290 4.827 -0.537 1
1 21 . 20 1 1 A 6 6 LYS C C 6 176.100 175.688 0.412 1
1 22 . 20 1 1 A 6 6 LYS CA C 6 55.540 54.601 0.939 1
1 23 . 20 1 1 A 6 6 LYS N N 6 121.910 121.536 0.374 1
1 24 . 20 1 1 A 7 7 LYS H H 7 8.450 8.359 0.091 1
1 25 . 20 1 1 A 7 7 LYS HA H 7 3.940 4.424 -0.484 1
1 26 . 20 1 1 A 7 7 LYS C C 7 175.700 176.209 -0.509 1
1 27 . 20 1 1 A 7 7 LYS CA C 7 56.440 56.287 0.153 1
1 28 . 20 1 1 A 7 7 LYS N N 7 122.250 121.836 0.414 1
1 29 . 20 1 1 A 8 8 ARG H H 8 8.210 8.136 0.074 1
1 30 . 20 1 1 A 8 8 ARG HA H 8 4.670 4.818 -0.148 1
1 31 . 20 1 1 A 8 8 ARG C C 8 173.760 174.936 -1.176 1
1 32 . 20 1 1 A 8 8 ARG CA C 8 53.420 53.849 -0.429 1
1 33 . 20 1 1 A 8 8 ARG N N 8 122.560 122.778 -0.218 1
1 34 . 20 1 1 A 9 9 TRP H H 9 8.610 8.864 -0.254 1
1 35 . 20 1 1 A 9 9 TRP HA H 9 4.910 4.927 -0.017 1
1 44 . 20 1 1 A 9 9 TRP C C 9 174.610 175.650 -1.040 1
1 45 . 20 1 1 A 9 9 TRP CA C 9 57.630 56.221 1.409 1
1 46 . 20 1 1 A 9 9 TRP CB C 9 31.020 30.687 0.333 1
1 52 . 20 1 1 A 9 9 TRP N N 9 120.540 121.028 -0.488 1
1 54 . 20 1 1 A 10 10 TYR H H 10 9.260 8.946 0.314 1
1 55 . 20 1 1 A 10 10 TYR HA H 10 4.820 5.323 -0.503 1
1 62 . 20 1 1 A 10 10 TYR C C 10 174.340 175.615 -1.275 1
1 63 . 20 1 1 A 10 10 TYR CA C 10 57.050 56.559 0.491 1
1 64 . 20 1 1 A 10 10 TYR CB C 10 41.920 42.314 -0.394 1
1 69 . 20 1 1 A 10 10 TYR N N 10 118.990 121.875 -2.885 1
1 70 . 20 1 1 A 11 11 VAL H H 11 9.450 8.905 0.545 1
1 71 . 20 1 1 A 11 11 VAL HA H 11 4.470 4.703 -0.233 1
1 79 . 20 1 1 A 11 11 VAL C C 11 175.030 175.523 -0.493 1
1 80 . 20 1 1 A 11 11 VAL CA C 11 62.320 61.704 0.616 1
1 81 . 20 1 1 A 11 11 VAL CB C 11 32.400 33.329 -0.929 1
1 84 . 20 1 1 A 11 11 VAL N N 11 120.930 121.872 -0.942 1
1 85 . 20 1 1 A 12 12 VAL H H 12 9.320 9.048 0.272 1
1 86 . 20 1 1 A 12 12 VAL HA H 12 3.940 4.549 -0.609 1
1 94 . 20 1 1 A 12 12 VAL C C 12 173.870 173.619 0.251 1
1 95 . 20 1 1 A 12 12 VAL CA C 12 61.330 60.995 0.335 1
1 96 . 20 1 1 A 12 12 VAL CB C 12 33.500 34.888 -1.388 1
1 99 . 20 1 1 A 12 12 VAL N N 12 128.860 127.125 1.735 1
1 100 . 20 1 1 A 13 13 GLN H H 13 8.830 9.026 -0.196 1
1 101 . 20 1 1 A 13 13 GLN HA H 13 4.710 5.087 -0.377 1
1 108 . 20 1 1 A 13 13 GLN C C 13 174.230 174.752 -0.522 1
1 109 . 20 1 1 A 13 13 GLN CA C 13 54.800 54.772 0.028 1
1 110 . 20 1 1 A 13 13 GLN CB C 13 29.450 29.707 -0.257 1
1 111 . 20 1 1 A 13 13 GLN N N 13 126.050 128.210 -2.160 1
1 113 . 20 1 1 A 14 14 ALA H H 14 9.420 8.577 0.843 1
1 114 . 20 1 1 A 14 14 ALA HA H 14 5.150 4.674 0.476 1
1 118 . 20 1 1 A 14 14 ALA C C 14 176.400 176.180 0.220 1
1 119 . 20 1 1 A 14 14 ALA CA C 14 49.660 51.118 -1.458 1
1 120 . 20 1 1 A 14 14 ALA CB C 14 22.840 22.814 0.026 1
1 121 . 20 1 1 A 14 14 ALA N N 14 131.620 127.895 3.725 1
1 122 . 20 1 1 A 15 15 PHE H H 15 8.070 8.583 -0.513 1
1 123 . 20 1 1 A 15 15 PHE HA H 15 4.410 4.627 -0.217 1
1 128 . 20 1 1 A 15 15 PHE C C 15 176.130 175.927 0.203 1
1 129 . 20 1 1 A 15 15 PHE CA C 15 58.550 59.202 -0.652 1
1 130 . 20 1 1 A 15 15 PHE CB C 15 39.780 39.733 0.047 1
1 133 . 20 1 1 A 15 15 PHE N N 15 119.680 119.486 0.194 1
1 134 . 20 1 1 A 16 16 SER H H 16 8.370 8.854 -0.484 1
1 135 . 20 1 1 A 16 16 SER HA H 16 4.140 4.443 -0.303 1
1 138 . 20 1 1 A 16 16 SER C C 16 175.820 174.847 0.973 1
1 139 . 20 1 1 A 16 16 SER CA C 16 60.570 59.289 1.281 1
1 140 . 20 1 1 A 16 16 SER CB C 16 63.030 63.329 -0.299 1
1 141 . 20 1 1 A 16 16 SER N N 16 119.700 117.678 2.022 1
1 142 . 20 1 1 A 17 17 GLY H H 17 9.130 8.706 0.424 1
1 143 . 20 1 1 A 17 17 GLY HA2 H 17 3.640 3.543 0.097 1
1 144 . 20 1 1 A 17 17 GLY HA3 H 17 4.200 3.763 0.437 1
1 145 . 20 1 1 A 17 17 GLY C C 17 175.520 174.281 1.239 1
1 146 . 20 1 1 A 17 17 GLY CA C 17 45.260 45.292 -0.032 1
1 147 . 20 1 1 A 17 17 GLY N N 17 115.850 112.206 3.644 1
1 148 . 20 1 1 A 18 18 PHE H H 18 8.480 7.604 0.876 1
1 149 . 20 1 1 A 18 18 PHE HA H 18 4.740 4.777 -0.037 1
1 154 . 20 1 1 A 18 18 PHE C C 18 175.430 176.265 -0.835 1
1 155 . 20 1 1 A 18 18 PHE CA C 18 58.240 57.774 0.466 1
1 156 . 20 1 1 A 18 18 PHE CB C 18 39.010 39.262 -0.252 1
1 159 . 20 1 1 A 18 18 PHE N N 18 118.550 119.715 -1.165 1
1 160 . 20 1 1 A 19 19 GLU H H 19 10.690 8.449 2.241 1
1 161 . 20 1 1 A 19 19 GLU HA H 19 3.490 4.200 -0.710 1
1 166 . 20 1 1 A 19 19 GLU C C 19 177.650 179.193 -1.543 1
1 167 . 20 1 1 A 19 19 GLU CA C 19 62.280 59.128 3.152 1
1 168 . 20 1 1 A 19 19 GLU CB C 19 28.380 29.264 -0.884 1
1 170 . 20 1 1 A 19 19 GLU N N 19 123.470 119.862 3.608 1
1 171 . 20 1 1 A 20 20 GLY H H 20 8.740 8.471 0.269 1
1 172 . 20 1 1 A 20 20 GLY HA2 H 20 3.840 3.821 0.019 1
1 173 . 20 1 1 A 20 20 GLY HA3 H 20 3.940 3.825 0.115 1
1 174 . 20 1 1 A 20 20 GLY C C 20 176.860 175.546 1.314 1
1 175 . 20 1 1 A 20 20 GLY CA C 20 47.140 47.502 -0.362 1
1 176 . 20 1 1 A 20 20 GLY N N 20 105.480 109.873 -4.393 1
1 177 . 20 1 1 A 21 21 ARG H H 21 7.690 8.263 -0.573 1
1 178 . 20 1 1 A 21 21 ARG HA H 21 4.180 4.123 0.057 1
1 185 . 20 1 1 A 21 21 ARG C C 21 179.490 178.918 0.572 1
1 186 . 20 1 1 A 21 21 ARG CA C 21 58.660 59.454 -0.794 1
1 187 . 20 1 1 A 21 21 ARG CB C 21 30.100 29.802 0.298 1
1 190 . 20 1 1 A 21 21 ARG N N 21 123.120 122.008 1.112 1
1 191 . 20 1 1 A 22 22 VAL H H 22 8.980 8.035 0.945 1
1 192 . 20 1 1 A 22 22 VAL HA H 22 3.560 3.864 -0.304 1
1 200 . 20 1 1 A 22 22 VAL C C 22 177.320 178.267 -0.947 1
1 201 . 20 1 1 A 22 22 VAL CA C 22 66.960 66.181 0.779 1
1 202 . 20 1 1 A 22 22 VAL CB C 22 31.050 31.611 -0.561 1
1 205 . 20 1 1 A 22 22 VAL N N 22 122.760 120.062 2.698 1
1 206 . 20 1 1 A 23 23 ALA H H 23 8.280 8.059 0.221 1
1 207 . 20 1 1 A 23 23 ALA HA H 23 3.850 4.052 -0.202 1
1 211 . 20 1 1 A 23 23 ALA C C 23 179.340 179.749 -0.409 1
1 212 . 20 1 1 A 23 23 ALA CA C 23 56.260 55.295 0.965 1
1 213 . 20 1 1 A 23 23 ALA CB C 23 18.260 18.179 0.081 1
1 214 . 20 1 1 A 23 23 ALA N N 23 122.120 121.690 0.430 1
1 215 . 20 1 1 A 24 24 THR H H 24 8.020 7.818 0.202 1
1 216 . 20 1 1 A 24 24 THR HA H 24 3.920 3.859 0.061 1
1 221 . 20 1 1 A 24 24 THR C C 24 176.940 176.798 0.142 1
1 222 . 20 1 1 A 24 24 THR CA C 24 66.820 66.941 -0.121 1
1 223 . 20 1 1 A 24 24 THR CB C 24 68.930 68.749 0.181 1
1 225 . 20 1 1 A 24 24 THR N N 24 113.410 115.576 -2.166 1
1 226 . 20 1 1 A 25 25 SER H H 25 8.570 8.579 -0.009 1
1 227 . 20 1 1 A 25 25 SER HA H 25 4.400 4.085 0.315 1
1 230 . 20 1 1 A 25 25 SER C C 25 177.610 176.889 0.721 1
1 231 . 20 1 1 A 25 25 SER CA C 25 61.920 61.755 0.165 1
1 232 . 20 1 1 A 25 25 SER CB C 25 63.540 62.381 1.159 1
1 233 . 20 1 1 A 25 25 SER N N 25 118.260 114.496 3.764 1
1 234 . 20 1 1 A 26 26 LEU H H 26 9.430 8.402 1.028 1
1 235 . 20 1 1 A 26 26 LEU HA H 26 3.900 4.190 -0.290 1
1 245 . 20 1 1 A 26 26 LEU C C 26 177.710 178.411 -0.701 1
1 246 . 20 1 1 A 26 26 LEU CA C 26 58.910 58.292 0.618 1
1 247 . 20 1 1 A 26 26 LEU CB C 26 41.300 41.491 -0.191 1
1 251 . 20 1 1 A 26 26 LEU N N 26 124.120 124.578 -0.458 1
1 252 . 20 1 1 A 27 27 ARG H H 27 7.790 7.837 -0.047 1
1 253 . 20 1 1 A 27 27 ARG HA H 27 3.880 3.806 0.074 1
1 260 . 20 1 1 A 27 27 ARG C C 27 179.380 178.688 0.692 1
1 261 . 20 1 1 A 27 27 ARG CA C 27 60.510 59.732 0.778 1
1 262 . 20 1 1 A 27 27 ARG CB C 27 29.670 29.922 -0.252 1
1 265 . 20 1 1 A 27 27 ARG N N 27 116.710 119.428 -2.718 1
1 266 . 20 1 1 A 28 28 GLU H H 28 7.900 7.924 -0.024 1
1 267 . 20 1 1 A 28 28 GLU HA H 28 4.070 3.945 0.125 1
1 272 . 20 1 1 A 28 28 GLU C C 28 179.450 179.461 -0.011 1
1 273 . 20 1 1 A 28 28 GLU CA C 28 59.450 59.297 0.153 1
1 274 . 20 1 1 A 28 28 GLU CB C 28 29.610 29.393 0.217 1
1 276 . 20 1 1 A 28 28 GLU N N 28 118.340 117.801 0.539 1
1 277 . 20 1 1 A 29 29 HIS H H 29 8.940 7.410 1.530 1
1 278 . 20 1 1 A 29 29 HIS HA H 29 4.160 4.516 -0.356 1
1 283 . 20 1 1 A 29 29 HIS C C 29 177.750 177.912 -0.162 1
1 284 . 20 1 1 A 29 29 HIS CA C 29 61.260 59.749 1.511 1
1 285 . 20 1 1 A 29 29 HIS CB C 29 29.870 29.620 0.250 1
1 287 . 20 1 1 A 29 29 HIS N N 29 120.440 118.699 1.741 1
1 288 . 20 1 1 A 30 30 ILE H H 30 8.580 8.073 0.507 1
1 289 . 20 1 1 A 30 30 ILE HA H 30 3.160 3.499 -0.339 1
1 299 . 20 1 1 A 30 30 ILE C C 30 177.230 177.920 -0.690 1
1 300 . 20 1 1 A 30 30 ILE CA C 30 66.460 65.378 1.082 1
1 301 . 20 1 1 A 30 30 ILE CB C 30 38.630 37.712 0.918 1
1 305 . 20 1 1 A 30 30 ILE N N 30 121.010 120.334 0.676 1
1 306 . 20 1 1 A 31 31 LYS H H 31 7.020 7.794 -0.774 1
1 307 . 20 1 1 A 31 31 LYS HA H 31 4.170 3.991 0.179 1
1 316 . 20 1 1 A 31 31 LYS C C 31 180.570 179.070 1.500 1
1 317 . 20 1 1 A 31 31 LYS CA C 31 58.920 59.937 -1.017 1
1 318 . 20 1 1 A 31 31 LYS CB C 31 32.490 32.204 0.286 1
1 322 . 20 1 1 A 31 31 LYS N N 31 117.400 119.316 -1.916 1
1 323 . 20 1 1 A 32 32 LEU H H 32 8.400 8.485 -0.085 1
1 324 . 20 1 1 A 32 32 LEU HA H 32 3.990 3.879 0.111 1
1 334 . 20 1 1 A 32 32 LEU C C 32 178.230 178.551 -0.321 1
1 335 . 20 1 1 A 32 32 LEU CA C 32 57.700 57.961 -0.261 1
1 336 . 20 1 1 A 32 32 LEU CB C 32 42.540 41.721 0.819 1
1 340 . 20 1 1 A 32 32 LEU N N 32 121.180 119.908 1.272 1
1 341 . 20 1 1 A 33 33 HIS H H 33 7.620 8.080 -0.460 1
1 342 . 20 1 1 A 33 33 HIS HA H 33 4.600 4.668 -0.068 1
1 347 . 20 1 1 A 33 33 HIS C C 33 177.090 174.063 3.027 1
1 348 . 20 1 1 A 33 33 HIS CA C 33 55.840 55.441 0.399 1
1 349 . 20 1 1 A 33 33 HIS CB C 33 29.330 30.108 -0.778 1
1 351 . 20 1 1 A 33 33 HIS N N 33 112.220 115.169 -2.949 1
1 352 . 20 1 1 A 34 34 ASN H H 34 8.030 8.084 -0.054 1
1 353 . 20 1 1 A 34 34 ASN HA H 34 4.890 4.350 0.540 1
1 358 . 20 1 1 A 34 34 ASN C C 34 175.910 175.507 0.403 1
1 359 . 20 1 1 A 34 34 ASN CA C 34 54.530 54.441 0.089 1
1 360 . 20 1 1 A 34 34 ASN CB C 34 37.380 36.468 0.912 1
1 361 . 20 1 1 A 34 34 ASN N N 34 117.600 114.710 2.890 1
1 363 . 20 1 1 A 35 35 MET H H 35 8.330 8.707 -0.377 1
1 364 . 20 1 1 A 35 35 MET HA H 35 4.940 4.884 0.056 1
1 372 . 20 1 1 A 35 35 MET C C 35 176.880 176.732 0.148 1
1 373 . 20 1 1 A 35 35 MET CA C 35 55.600 54.570 1.030 1
1 374 . 20 1 1 A 35 35 MET CB C 35 33.790 33.252 0.538 1
1 377 . 20 1 1 A 35 35 MET N N 35 116.190 116.253 -0.063 1
1 378 . 20 1 1 A 36 36 GLU H H 36 9.730 8.233 1.497 1
1 379 . 20 1 1 A 36 36 GLU HA H 36 3.850 4.142 -0.292 1
1 384 . 20 1 1 A 36 36 GLU C C 36 178.290 179.273 -0.983 1
1 385 . 20 1 1 A 36 36 GLU CA C 36 61.280 59.595 1.685 1
1 386 . 20 1 1 A 36 36 GLU CB C 36 29.270 29.106 0.164 1
1 388 . 20 1 1 A 36 36 GLU N N 36 121.630 120.866 0.764 1
1 389 . 20 1 1 A 37 37 ASP H H 37 8.850 8.065 0.785 1
1 390 . 20 1 1 A 37 37 ASP HA H 37 4.470 4.484 -0.014 1
1 393 . 20 1 1 A 37 37 ASP C C 37 177.190 178.889 -1.699 1
1 394 . 20 1 1 A 37 37 ASP CA C 37 56.140 57.303 -1.163 1
1 395 . 20 1 1 A 37 37 ASP CB C 37 40.050 40.900 -0.850 1
1 396 . 20 1 1 A 37 37 ASP N N 37 114.390 119.878 -5.488 1
1 397 . 20 1 1 A 38 38 LEU H H 38 7.880 7.725 0.155 1
1 398 . 20 1 1 A 38 38 LEU HA H 38 4.290 4.072 0.218 1
1 408 . 20 1 1 A 38 38 LEU C C 38 175.090 177.588 -2.498 1
1 409 . 20 1 1 A 38 38 LEU CA C 38 54.670 57.694 -3.024 1
1 410 . 20 1 1 A 38 38 LEU CB C 38 42.940 41.991 0.949 1
1 414 . 20 1 1 A 38 38 LEU N N 38 116.550 119.285 -2.735 1
1 415 . 20 1 1 A 39 39 PHE H H 39 7.500 7.951 -0.451 1
1 416 . 20 1 1 A 39 39 PHE HA H 39 4.970 4.484 0.486 1
1 424 . 20 1 1 A 39 39 PHE C C 39 175.380 175.623 -0.243 1
1 425 . 20 1 1 A 39 39 PHE CA C 39 57.580 58.204 -0.624 1
1 426 . 20 1 1 A 39 39 PHE CB C 39 44.990 39.628 5.362 1
1 432 . 20 1 1 A 39 39 PHE N N 39 115.370 116.962 -1.592 1
1 433 . 20 1 1 A 40 40 GLY H H 40 8.680 8.610 0.070 1
1 434 . 20 1 1 A 40 40 GLY HA2 H 40 3.370 3.976 -0.606 1
1 435 . 20 1 1 A 40 40 GLY HA3 H 40 4.550 4.065 0.485 1
1 436 . 20 1 1 A 40 40 GLY C C 40 173.090 173.994 -0.904 1
1 437 . 20 1 1 A 40 40 GLY CA C 40 44.180 46.236 -2.056 1
1 438 . 20 1 1 A 40 40 GLY N N 40 110.930 111.328 -0.398 1
1 439 . 20 1 1 A 41 41 GLU H H 41 8.320 7.807 0.513 1
1 440 . 20 1 1 A 41 41 GLU HA H 41 4.280 4.942 -0.662 1
1 445 . 20 1 1 A 41 41 GLU C C 41 173.900 174.616 -0.716 1
1 446 . 20 1 1 A 41 41 GLU CA C 41 56.900 54.866 2.034 1
1 447 . 20 1 1 A 41 41 GLU CB C 41 32.110 33.377 -1.267 1
1 449 . 20 1 1 A 41 41 GLU N N 41 126.730 120.207 6.523 1
1 450 . 20 1 1 A 42 42 VAL H H 42 8.100 8.562 -0.462 1
1 451 . 20 1 1 A 42 42 VAL HA H 42 5.160 5.036 0.124 1
1 459 . 20 1 1 A 42 42 VAL C C 42 176.340 175.097 1.243 1
1 460 . 20 1 1 A 42 42 VAL CA C 42 61.200 60.494 0.706 1
1 461 . 20 1 1 A 42 42 VAL CB C 42 34.770 35.208 -0.438 1
1 464 . 20 1 1 A 42 42 VAL N N 42 119.360 124.189 -4.829 1
1 465 . 20 1 1 A 43 43 MET H H 43 9.870 9.389 0.481 1
1 466 . 20 1 1 A 43 43 MET HA H 43 5.070 5.483 -0.413 1
1 474 . 20 1 1 A 43 43 MET C C 43 173.890 174.904 -1.014 1
1 475 . 20 1 1 A 43 43 MET CA C 43 54.740 54.335 0.405 1
1 476 . 20 1 1 A 43 43 MET CB C 43 37.500 37.080 0.420 1
1 479 . 20 1 1 A 43 43 MET N N 43 125.720 124.723 0.997 1
1 480 . 20 1 1 A 44 44 VAL H H 44 8.800 8.901 -0.101 1
1 481 . 20 1 1 A 44 44 VAL HA H 44 4.720 4.622 0.098 1
1 489 . 20 1 1 A 44 44 VAL CA C 44 59.090 58.917 0.173 1
1 490 . 20 1 1 A 44 44 VAL CB C 44 33.710 35.616 -1.906 1
1 493 . 20 1 1 A 44 44 VAL N N 44 122.340 122.271 0.069 1
1 494 . 20 1 1 A 45 45 PRO HA H 45 4.480 4.255 0.225 1
1 501 . 20 1 1 A 45 45 PRO C C 45 177.080 174.633 2.447 1
1 502 . 20 1 1 A 45 45 PRO CA C 45 63.240 63.638 -0.398 1
1 503 . 20 1 1 A 45 45 PRO CB C 45 32.170 31.012 1.158 1
1 506 . 20 1 1 A 46 46 THR H H 46 8.200 7.067 1.133 1
1 507 . 20 1 1 A 46 46 THR HA H 46 4.290 4.585 -0.295 1
1 512 . 20 1 1 A 46 46 THR C C 46 174.600 173.114 1.486 1
1 513 . 20 1 1 A 46 46 THR CA C 46 62.100 59.168 2.932 1
1 514 . 20 1 1 A 46 46 THR CB C 46 69.990 71.834 -1.844 1
1 516 . 20 1 1 A 46 46 THR N N 46 113.410 107.953 5.457 1
1 517 . 20 1 1 A 47 47 GLU H H 47 8.380 8.677 -0.297 1
1 518 . 20 1 1 A 47 47 GLU HA H 47 4.400 4.812 -0.412 1
1 521 . 20 1 1 A 47 47 GLU C C 47 175.970 174.579 1.391 1
1 522 . 20 1 1 A 47 47 GLU CA C 47 55.200 54.511 0.689 1
1 523 . 20 1 1 A 47 47 GLU CB C 47 32.300 32.691 -0.391 1
1 524 . 20 1 1 A 47 47 GLU N N 47 122.830 120.170 2.660 1
1 525 . 20 1 1 A 48 48 GLU H H 48 8.400 8.752 -0.352 1
1 526 . 20 1 1 A 48 48 GLU HA H 48 4.280 4.937 -0.657 1
1 531 . 20 1 1 A 48 48 GLU C C 48 175.750 175.123 0.627 1
1 532 . 20 1 1 A 48 48 GLU CA C 48 55.190 55.358 -0.168 1
1 533 . 20 1 1 A 48 48 GLU CB C 48 31.980 32.000 -0.020 1
1 535 . 20 1 1 A 48 48 GLU N N 48 121.950 123.095 -1.145 1
1 536 . 20 1 1 A 49 49 VAL H H 49 8.240 8.772 -0.532 1
1 537 . 20 1 1 A 49 49 VAL HA H 49 4.170 4.536 -0.366 1
1 542 . 20 1 1 A 49 49 VAL C C 49 174.610 176.792 -2.182 1
1 543 . 20 1 1 A 49 49 VAL CA C 49 62.280 60.603 1.677 1
1 544 . 20 1 1 A 49 49 VAL CB C 49 32.930 34.868 -1.938 1
1 546 . 20 1 1 A 49 49 VAL N N 49 123.990 126.676 -2.686 1
1 547 . 20 1 1 A 50 50 VAL H H 50 8.230 8.720 -0.490 1
1 548 . 20 1 1 A 50 50 VAL HA H 50 4.220 3.902 0.318 1
1 553 . 20 1 1 A 50 50 VAL C C 50 175.770 175.359 0.411 1
1 554 . 20 1 1 A 50 50 VAL CA C 50 62.170 64.717 -2.547 1
1 555 . 20 1 1 A 50 50 VAL CB C 50 33.110 31.899 1.211 1
1 557 . 20 1 1 A 50 50 VAL N N 50 123.960 124.308 -0.348 1
1 558 . 20 1 1 A 51 51 GLU H H 51 8.570 7.895 0.675 1
1 559 . 20 1 1 A 51 51 GLU HA H 51 4.380 4.612 -0.232 1
1 564 . 20 1 1 A 51 51 GLU C C 51 175.920 176.838 -0.918 1
1 565 . 20 1 1 A 51 51 GLU CA C 51 56.050 55.155 0.895 1
1 566 . 20 1 1 A 51 51 GLU CB C 51 31.080 31.928 -0.848 1
1 568 . 20 1 1 A 51 51 GLU N N 51 125.070 120.914 4.156 1
1 569 . 20 1 1 A 52 52 ILE H H 52 8.320 8.662 -0.342 1
1 570 . 20 1 1 A 52 52 ILE HA H 52 4.290 3.715 0.575 1
1 580 . 20 1 1 A 52 52 ILE C C 52 176.330 177.461 -1.131 1
1 581 . 20 1 1 A 52 52 ILE CA C 52 60.940 65.085 -4.145 1
1 582 . 20 1 1 A 52 52 ILE CB C 52 38.510 37.719 0.791 1
1 586 . 20 1 1 A 52 52 ILE N N 52 122.760 126.663 -3.903 1
1 587 . 20 1 1 A 53 53 ARG H H 53 8.500 7.734 0.766 1
1 588 . 20 1 1 A 53 53 ARG HA H 53 4.430 4.052 0.378 1
1 595 . 20 1 1 A 53 53 ARG C C 53 176.950 177.250 -0.300 1
1 596 . 20 1 1 A 53 53 ARG CA C 53 56.150 57.719 -1.569 1
1 597 . 20 1 1 A 53 53 ARG CB C 53 30.200 30.382 -0.182 1
1 600 . 20 1 1 A 53 53 ARG N N 53 125.250 119.071 6.179 1
1 601 . 20 1 1 A 54 54 GLY H H 54 8.760 7.947 0.813 1
1 602 . 20 1 1 A 54 54 GLY HA2 H 54 3.920 4.009 -0.089 1
1 603 . 20 1 1 A 54 54 GLY HA3 H 54 4.010 4.009 0.001 1
1 604 . 20 1 1 A 54 54 GLY C C 54 175.110 175.613 -0.503 1
1 605 . 20 1 1 A 54 54 GLY CA C 54 46.030 44.989 1.041 1
1 606 . 20 1 1 A 54 54 GLY N N 54 112.510 107.436 5.074 1
1 607 . 20 1 1 A 55 55 GLY H H 55 8.350 8.770 -0.420 1
1 608 . 20 1 1 A 55 55 GLY HA2 H 55 3.980 3.879 0.101 1
1 609 . 20 1 1 A 55 55 GLY HA3 H 55 3.980 3.879 0.101 1
1 610 . 20 1 1 A 55 55 GLY C C 55 173.920 173.909 0.011 1
1 611 . 20 1 1 A 55 55 GLY CA C 55 45.200 45.397 -0.197 1
1 612 . 20 1 1 A 55 55 GLY N N 55 107.940 110.027 -2.087 1
1 613 . 20 1 1 A 56 56 GLN H H 56 8.100 7.521 0.579 1
1 614 . 20 1 1 A 56 56 GLN HA H 56 4.420 4.634 -0.214 1
1 619 . 20 1 1 A 56 56 GLN C C 56 175.570 176.659 -1.089 1
1 620 . 20 1 1 A 56 56 GLN CA C 56 55.420 53.971 1.449 1
1 621 . 20 1 1 A 56 56 GLN CB C 56 30.100 31.319 -1.219 1
1 623 . 20 1 1 A 56 56 GLN N N 56 119.350 119.103 0.247 1
1 624 . 20 1 1 A 57 57 ARG H H 57 8.520 8.561 -0.041 1
1 625 . 20 1 1 A 57 57 ARG HA H 57 4.400 4.097 0.303 1
1 632 . 20 1 1 A 57 57 ARG C C 57 176.210 176.378 -0.168 1
1 633 . 20 1 1 A 57 57 ARG CA C 57 56.440 58.735 -2.295 1
1 634 . 20 1 1 A 57 57 ARG CB C 57 30.930 30.467 0.463 1
1 637 . 20 1 1 A 57 57 ARG N N 57 122.610 122.930 -0.320 1
1 638 . 20 1 1 A 58 58 ARG H H 58 8.630 7.702 0.928 1
1 639 . 20 1 1 A 58 58 ARG HA H 58 4.430 4.844 -0.414 1
1 646 . 20 1 1 A 58 58 ARG C C 58 175.950 174.212 1.738 1
1 647 . 20 1 1 A 58 58 ARG CA C 58 55.450 54.387 1.063 1
1 648 . 20 1 1 A 58 58 ARG CB C 58 31.300 33.752 -2.452 1
1 651 . 20 1 1 A 58 58 ARG N N 58 123.320 117.491 5.829 1
1 652 . 20 1 1 A 59 59 LYS H H 59 8.560 8.474 0.086 1
1 653 . 20 1 1 A 59 59 LYS HA H 59 4.410 4.647 -0.237 1
1 662 . 20 1 1 A 59 59 LYS C C 59 176.590 176.366 0.224 1
1 663 . 20 1 1 A 59 59 LYS CA C 59 56.720 56.307 0.413 1
1 664 . 20 1 1 A 59 59 LYS CB C 59 33.150 33.567 -0.417 1
1 668 . 20 1 1 A 59 59 LYS N N 59 123.380 123.312 0.068 1
1 669 . 20 1 1 A 60 60 SER H H 60 8.450 8.791 -0.341 1
1 670 . 20 1 1 A 60 60 SER HA H 60 4.480 5.476 -0.996 1
1 673 . 20 1 1 A 60 60 SER C C 60 174.280 173.419 0.861 1
1 674 . 20 1 1 A 60 60 SER CA C 60 58.140 55.804 2.336 1
1 675 . 20 1 1 A 60 60 SER CB C 60 64.160 66.135 -1.975 1
1 676 . 20 1 1 A 60 60 SER N N 60 117.320 118.441 -1.121 1
1 677 . 20 1 1 A 61 61 GLU H H 61 8.550 8.555 -0.005 1
1 678 . 20 1 1 A 61 61 GLU HA H 61 4.400 5.003 -0.603 1
1 683 . 20 1 1 A 61 61 GLU C C 61 176.150 175.323 0.827 1
1 684 . 20 1 1 A 61 61 GLU CA C 61 56.300 55.262 1.038 1
1 685 . 20 1 1 A 61 61 GLU CB C 61 30.790 32.617 -1.827 1
1 687 . 20 1 1 A 61 61 GLU N N 61 122.810 120.788 2.022 1
1 688 . 20 1 1 A 62 62 ARG H H 62 8.310 8.716 -0.406 1
1 689 . 20 1 1 A 62 62 ARG HA H 62 4.340 5.052 -0.712 1
1 692 . 20 1 1 A 62 62 ARG C C 62 176.140 174.930 1.210 1
1 693 . 20 1 1 A 62 62 ARG CA C 62 56.230 54.361 1.869 1
1 694 . 20 1 1 A 62 62 ARG CB C 62 30.780 33.621 -2.841 1
1 695 . 20 1 1 A 62 62 ARG N N 62 122.080 120.996 1.084 1
1 696 . 20 1 1 A 63 63 LYS H H 63 8.470 8.596 -0.126 1
1 697 . 20 1 1 A 63 63 LYS HA H 63 4.300 4.929 -0.629 1
1 700 . 20 1 1 A 63 63 LYS C C 63 175.490 176.025 -0.535 1
1 701 . 20 1 1 A 63 63 LYS CA C 63 56.200 55.304 0.896 1
1 702 . 20 1 1 A 63 63 LYS CB C 63 30.730 34.357 -3.627 1
1 703 . 20 1 1 A 63 63 LYS N N 63 123.450 121.652 1.798 1
1 704 . 20 1 1 A 64 64 PHE H H 64 8.200 8.771 -0.571 1
1 705 . 20 1 1 A 64 64 PHE HA H 64 4.450 4.989 -0.539 1
1 710 . 20 1 1 A 64 64 PHE C C 64 174.250 173.939 0.311 1
1 711 . 20 1 1 A 64 64 PHE CA C 64 57.430 55.705 1.725 1
1 712 . 20 1 1 A 64 64 PHE CB C 64 40.330 41.206 -0.876 1
1 715 . 20 1 1 A 64 64 PHE N N 64 121.740 119.431 2.309 1
1 716 . 20 1 1 A 65 65 PHE H H 65 8.130 8.771 -0.641 1
1 717 . 20 1 1 A 65 65 PHE HA H 65 4.440 4.338 0.102 1
1 725 . 20 1 1 A 65 65 PHE CA C 65 55.650 56.115 -0.465 1
1 726 . 20 1 1 A 65 65 PHE CB C 65 38.900 39.015 -0.115 1
1 731 . 20 1 1 A 65 65 PHE N N 65 120.910 118.391 2.519 1
1 732 . 20 1 1 A 66 66 PRO C C 66 176.780 177.458 -0.678 1
1 733 . 20 1 1 A 67 67 GLY H H 67 9.970 8.807 1.163 1
1 734 . 20 1 1 A 67 67 GLY HA2 H 67 3.820 4.032 -0.212 1
1 735 . 20 1 1 A 67 67 GLY HA3 H 67 4.400 4.069 0.331 1
1 736 . 20 1 1 A 67 67 GLY C C 67 173.670 173.486 0.184 1
1 737 . 20 1 1 A 67 67 GLY CA C 67 45.900 45.620 0.280 1
1 738 . 20 1 1 A 67 67 GLY N N 67 111.550 111.374 0.176 1
1 739 . 20 1 1 A 68 68 TYR H H 68 7.650 8.322 -0.672 1
1 740 . 20 1 1 A 68 68 TYR HA H 68 5.000 5.198 -0.198 1
1 747 . 20 1 1 A 68 68 TYR C C 68 175.220 174.853 0.367 1
1 748 . 20 1 1 A 68 68 TYR CA C 68 57.940 56.366 1.574 1
1 753 . 20 1 1 A 68 68 TYR N N 68 118.800 118.560 0.240 1
1 754 . 20 1 1 A 69 69 VAL H H 69 9.090 8.772 0.318 1
1 755 . 20 1 1 A 69 69 VAL HA H 69 4.330 4.890 -0.560 1
1 763 . 20 1 1 A 69 69 VAL C C 69 174.250 175.080 -0.830 1
1 764 . 20 1 1 A 69 69 VAL CA C 69 62.120 60.360 1.760 1
1 765 . 20 1 1 A 69 69 VAL CB C 69 35.240 35.714 -0.474 1
1 768 . 20 1 1 A 69 69 VAL N N 69 119.300 123.119 -3.819 1
1 769 . 20 1 1 A 70 70 LEU H H 70 9.190 8.960 0.230 1
1 770 . 20 1 1 A 70 70 LEU HA H 70 5.460 5.434 0.026 1
1 780 . 20 1 1 A 70 70 LEU C C 70 176.130 176.175 -0.045 1
1 781 . 20 1 1 A 70 70 LEU CA C 70 54.120 53.244 0.876 1
1 782 . 20 1 1 A 70 70 LEU CB C 70 43.330 43.546 -0.216 1
1 786 . 20 1 1 A 70 70 LEU N N 70 126.710 126.874 -0.164 1
1 787 . 20 1 1 A 71 71 VAL H H 71 9.350 9.126 0.224 1
1 788 . 20 1 1 A 71 71 VAL HA H 71 5.040 4.823 0.217 1
1 796 . 20 1 1 A 71 71 VAL C C 71 173.670 174.442 -0.772 1
1 797 . 20 1 1 A 71 71 VAL CA C 71 61.090 61.264 -0.174 1
1 798 . 20 1 1 A 71 71 VAL CB C 71 35.800 35.615 0.185 1
1 801 . 20 1 1 A 71 71 VAL N N 71 121.920 124.308 -2.388 1
1 802 . 20 1 1 A 72 72 GLN H H 72 8.390 8.866 -0.476 1
1 803 . 20 1 1 A 72 72 GLN HA H 72 4.610 4.163 0.447 1
1 810 . 20 1 1 A 72 72 GLN C C 72 175.920 174.382 1.538 1
1 811 . 20 1 1 A 72 72 GLN CA C 72 53.810 55.010 -1.200 1
1 812 . 20 1 1 A 72 72 GLN CB C 72 28.850 28.597 0.253 1
1 814 . 20 1 1 A 72 72 GLN N N 72 130.760 127.857 2.903 1
1 816 . 20 1 1 A 73 73 MET H H 73 9.750 8.279 1.471 1
1 817 . 20 1 1 A 73 73 MET HA H 73 5.060 5.180 -0.120 1
1 825 . 20 1 1 A 73 73 MET C C 73 175.500 174.714 0.786 1
1 826 . 20 1 1 A 73 73 MET CA C 73 55.520 54.108 1.412 1
1 827 . 20 1 1 A 73 73 MET CB C 73 35.350 35.839 -0.489 1
1 830 . 20 1 1 A 73 73 MET N N 73 121.070 124.682 -3.612 1
1 831 . 20 1 1 A 74 74 VAL H H 74 8.530 8.470 0.060 1
1 832 . 20 1 1 A 74 74 VAL HA H 74 3.970 4.313 -0.343 1
1 840 . 20 1 1 A 74 74 VAL C C 74 174.900 175.262 -0.362 1
1 841 . 20 1 1 A 74 74 VAL CA C 74 62.150 62.372 -0.222 1
1 842 . 20 1 1 A 74 74 VAL CB C 74 32.480 32.195 0.285 1
1 845 . 20 1 1 A 74 74 VAL N N 74 124.120 122.748 1.372 1
1 846 . 20 1 1 A 75 75 MET H H 75 8.600 8.927 -0.327 1
1 847 . 20 1 1 A 75 75 MET HA H 75 4.360 4.644 -0.284 1
1 855 . 20 1 1 A 75 75 MET C C 75 173.480 175.506 -2.026 1
1 856 . 20 1 1 A 75 75 MET CA C 75 53.830 54.808 -0.978 1
1 857 . 20 1 1 A 75 75 MET CB C 75 29.960 32.955 -2.995 1
1 860 . 20 1 1 A 75 75 MET N N 75 128.250 126.865 1.385 1
1 861 . 20 1 1 A 76 76 ASN H H 76 8.410 8.513 -0.103 1
1 862 . 20 1 1 A 76 76 ASN HA H 76 4.540 5.019 -0.479 1
1 867 . 20 1 1 A 76 76 ASN C C 76 173.950 174.944 -0.994 1
1 868 . 20 1 1 A 76 76 ASN CA C 76 51.720 51.787 -0.067 1
1 869 . 20 1 1 A 76 76 ASN CB C 76 38.430 41.793 -3.363 1
1 870 . 20 1 1 A 76 76 ASN N N 76 127.500 123.888 3.612 1
1 872 . 20 1 1 A 77 77 ASP H H 77 8.470 9.057 -0.587 1
1 873 . 20 1 1 A 77 77 ASP HA H 77 4.410 4.205 0.205 1
1 876 . 20 1 1 A 77 77 ASP C C 77 178.530 178.283 0.247 1
1 877 . 20 1 1 A 77 77 ASP CA C 77 58.730 56.897 1.833 1
1 878 . 20 1 1 A 77 77 ASP CB C 77 40.940 40.605 0.335 1
1 879 . 20 1 1 A 77 77 ASP N N 77 117.090 120.964 -3.874 1
1 880 . 20 1 1 A 78 78 ALA H H 78 8.160 8.076 0.084 1
1 881 . 20 1 1 A 78 78 ALA HA H 78 4.350 4.219 0.131 1
1 885 . 20 1 1 A 78 78 ALA C C 78 181.250 179.983 1.267 1
1 886 . 20 1 1 A 78 78 ALA CA C 78 55.190 55.336 -0.146 1
1 887 . 20 1 1 A 78 78 ALA CB C 78 18.260 18.572 -0.312 1
1 888 . 20 1 1 A 78 78 ALA N N 78 122.500 123.813 -1.313 1
1 889 . 20 1 1 A 79 79 SER H H 79 9.320 8.419 0.901 1
1 890 . 20 1 1 A 79 79 SER HA H 79 4.290 4.307 -0.017 1
1 893 . 20 1 1 A 79 79 SER C C 79 176.570 176.349 0.221 1
1 894 . 20 1 1 A 79 79 SER CA C 79 61.080 61.426 -0.346 1
1 895 . 20 1 1 A 79 79 SER CB C 79 62.200 62.289 -0.089 1
1 896 . 20 1 1 A 79 79 SER N N 79 119.280 112.561 6.719 1
1 897 . 20 1 1 A 80 80 TRP H H 80 8.900 7.814 1.086 1
1 898 . 20 1 1 A 80 80 TRP HA H 80 4.020 4.227 -0.207 1
1 907 . 20 1 1 A 80 80 TRP C C 80 178.210 178.456 -0.246 1
1 908 . 20 1 1 A 80 80 TRP CA C 80 62.490 61.151 1.339 1
1 909 . 20 1 1 A 80 80 TRP CB C 80 29.800 29.491 0.309 1
1 915 . 20 1 1 A 80 80 TRP N N 80 125.870 123.967 1.903 1
1 917 . 20 1 1 A 81 81 HIS H H 81 8.190 7.721 0.469 1
1 918 . 20 1 1 A 81 81 HIS HA H 81 3.930 4.151 -0.221 1
1 923 . 20 1 1 A 81 81 HIS C C 81 177.740 177.790 -0.050 1
1 924 . 20 1 1 A 81 81 HIS CA C 81 61.020 59.516 1.504 1
1 925 . 20 1 1 A 81 81 HIS CB C 81 28.910 29.585 -0.675 1
1 927 . 20 1 1 A 81 81 HIS N N 81 114.080 116.963 -2.883 1
1 928 . 20 1 1 A 82 82 LEU H H 82 8.080 7.970 0.110 1
1 929 . 20 1 1 A 82 82 LEU HA H 82 3.900 3.688 0.212 1
1 939 . 20 1 1 A 82 82 LEU C C 82 180.330 178.442 1.888 1
1 940 . 20 1 1 A 82 82 LEU CA C 82 58.590 58.160 0.430 1
1 941 . 20 1 1 A 82 82 LEU CB C 82 41.350 41.532 -0.182 1
1 945 . 20 1 1 A 82 82 LEU N N 82 121.320 121.216 0.104 1
1 946 . 20 1 1 A 83 83 VAL H H 83 8.000 8.402 -0.402 1
1 947 . 20 1 1 A 83 83 VAL HA H 83 3.210 3.480 -0.270 1
1 955 . 20 1 1 A 83 83 VAL C C 83 177.060 177.572 -0.512 1
1 956 . 20 1 1 A 83 83 VAL CA C 83 67.430 66.593 0.837 1
1 957 . 20 1 1 A 83 83 VAL CB C 83 31.680 31.110 0.570 1
1 960 . 20 1 1 A 83 83 VAL N N 83 118.850 118.828 0.022 1
1 961 . 20 1 1 A 84 84 ARG H H 84 7.540 7.940 -0.400 1
1 962 . 20 1 1 A 84 84 ARG HA H 84 3.590 3.754 -0.164 1
1 969 . 20 1 1 A 84 84 ARG C C 84 177.240 179.605 -2.365 1
1 970 . 20 1 1 A 84 84 ARG CA C 84 56.050 59.755 -3.705 1
1 971 . 20 1 1 A 84 84 ARG CB C 84 28.190 29.866 -1.676 1
1 974 . 20 1 1 A 84 84 ARG N N 84 111.460 120.087 -8.627 1
1 975 . 20 1 1 A 85 85 SER H H 85 7.530 7.571 -0.041 1
1 976 . 20 1 1 A 85 85 SER HA H 85 4.280 4.150 0.130 1
1 979 . 20 1 1 A 85 85 SER C C 85 173.930 174.642 -0.712 1
1 980 . 20 1 1 A 85 85 SER CA C 85 59.220 61.105 -1.885 1
1 981 . 20 1 1 A 85 85 SER CB C 85 63.830 62.937 0.893 1
1 982 . 20 1 1 A 85 85 SER N N 85 113.660 115.659 -1.999 1
1 983 . 20 1 1 A 86 86 VAL H H 86 7.230 7.461 -0.231 1
1 984 . 20 1 1 A 86 86 VAL HA H 86 3.480 4.440 -0.960 1
1 992 . 20 1 1 A 86 86 VAL CA C 86 61.300 61.347 -0.047 1
1 993 . 20 1 1 A 86 86 VAL CB C 86 31.780 32.277 -0.497 1
1 996 . 20 1 1 A 86 86 VAL N N 86 128.120 121.871 6.249 1
1 997 . 20 1 1 A 87 87 PRO HA H 87 4.140 4.415 -0.275 1
1 1004 . 20 1 1 A 87 87 PRO C C 87 176.400 176.829 -0.429 1
1 1005 . 20 1 1 A 87 87 PRO CA C 87 64.100 63.596 0.504 1
1 1006 . 20 1 1 A 87 87 PRO CB C 87 31.710 32.290 -0.580 1
1 1009 . 20 1 1 A 88 88 ARG H H 88 8.320 8.792 -0.472 1
1 1010 . 20 1 1 A 88 88 ARG HA H 88 3.030 4.005 -0.975 1
1 1017 . 20 1 1 A 88 88 ARG C C 88 174.630 174.614 0.016 1
1 1018 . 20 1 1 A 88 88 ARG CA C 88 57.620 57.409 0.211 1
1 1019 . 20 1 1 A 88 88 ARG CB C 88 26.960 27.857 -0.897 1
1 1022 . 20 1 1 A 88 88 ARG N N 88 111.360 116.269 -4.909 1
1 1023 . 20 1 1 A 89 89 VAL H H 89 7.390 7.868 -0.478 1
1 1024 . 20 1 1 A 89 89 VAL HA H 89 3.910 4.484 -0.574 1
1 1032 . 20 1 1 A 89 89 VAL C C 89 177.370 175.573 1.797 1
1 1033 . 20 1 1 A 89 89 VAL CA C 89 64.170 59.723 4.447 1
1 1034 . 20 1 1 A 89 89 VAL CB C 89 32.070 34.024 -1.954 1
1 1037 . 20 1 1 A 89 89 VAL N N 89 117.900 118.204 -0.304 1
1 1038 . 20 1 1 A 90 90 MET H H 90 9.290 8.964 0.326 1
1 1039 . 20 1 1 A 90 90 MET HA H 90 4.340 4.123 0.217 1
1 1047 . 20 1 1 A 90 90 MET C C 90 175.800 176.092 -0.292 1
1 1048 . 20 1 1 A 90 90 MET CA C 90 56.440 57.066 -0.626 1
1 1049 . 20 1 1 A 90 90 MET CB C 90 34.160 33.245 0.915 1
1 1052 . 20 1 1 A 90 90 MET N N 90 128.200 127.464 0.736 1
1 1053 . 20 1 1 A 91 91 GLY H H 91 7.130 6.873 0.257 1
1 1054 . 20 1 1 A 91 91 GLY HA2 H 91 3.340 3.846 -0.506 1
1 1055 . 20 1 1 A 91 91 GLY HA3 H 91 4.410 4.019 0.391 1
1 1056 . 20 1 1 A 91 91 GLY C C 91 170.920 171.551 -0.631 1
1 1057 . 20 1 1 A 91 91 GLY CA C 91 44.440 45.708 -1.268 1
1 1058 . 20 1 1 A 91 91 GLY N N 91 104.320 103.714 0.606 1
1 1059 . 20 1 1 A 92 92 PHE H H 92 8.790 8.582 0.208 1
1 1060 . 20 1 1 A 92 92 PHE HA H 92 5.270 4.988 0.282 1
1 1068 . 20 1 1 A 92 92 PHE C C 92 176.230 175.301 0.929 1
1 1069 . 20 1 1 A 92 92 PHE CA C 92 57.480 57.497 -0.017 1
1 1070 . 20 1 1 A 92 92 PHE CB C 92 42.190 42.091 0.099 1
1 1075 . 20 1 1 A 92 92 PHE N N 92 118.770 120.157 -1.387 1
1 1076 . 20 1 1 A 93 93 ILE H H 93 8.800 8.878 -0.078 1
1 1077 . 20 1 1 A 93 93 ILE HA H 93 4.310 4.943 -0.633 1
1 1087 . 20 1 1 A 93 93 ILE C C 93 176.380 175.559 0.821 1
1 1088 . 20 1 1 A 93 93 ILE CA C 93 60.480 59.985 0.495 1
1 1089 . 20 1 1 A 93 93 ILE CB C 93 38.010 40.624 -2.614 1
1 1093 . 20 1 1 A 93 93 ILE N N 93 122.300 121.132 1.168 1
1 1094 . 20 1 1 A 94 94 GLY H H 94 8.640 8.518 0.122 1
1 1095 . 20 1 1 A 94 94 GLY HA2 H 94 3.830 4.228 -0.398 1
1 1096 . 20 1 1 A 94 94 GLY HA3 H 94 4.600 4.232 0.368 1
1 1097 . 20 1 1 A 94 94 GLY C C 94 175.080 174.441 0.639 1
1 1098 . 20 1 1 A 94 94 GLY CA C 94 44.530 44.460 0.070 1
1 1099 . 20 1 1 A 94 94 GLY N N 94 116.550 112.648 3.902 1
1 1100 . 20 1 1 A 95 95 GLY H H 95 8.900 8.633 0.267 1
1 1101 . 20 1 1 A 95 95 GLY HA2 H 95 3.970 3.823 0.147 1
1 1102 . 20 1 1 A 95 95 GLY HA3 H 95 4.370 3.831 0.539 1
1 1103 . 20 1 1 A 95 95 GLY C C 95 174.560 173.897 0.663 1
1 1104 . 20 1 1 A 95 95 GLY CA C 95 45.640 47.502 -1.862 1
1 1105 . 20 1 1 A 95 95 GLY N N 95 112.960 109.723 3.237 1
1 1106 . 20 1 1 A 96 96 THR H H 96 7.830 7.731 0.099 1
1 1107 . 20 1 1 A 96 96 THR HA H 96 4.720 4.972 -0.252 1
1 1112 . 20 1 1 A 96 96 THR C C 96 176.260 174.381 1.879 1
1 1113 . 20 1 1 A 96 96 THR CA C 96 60.360 60.237 0.123 1
1 1114 . 20 1 1 A 96 96 THR CB C 96 70.960 71.928 -0.968 1
1 1116 . 20 1 1 A 96 96 THR N N 96 113.350 115.176 -1.826 1
1 1117 . 20 1 1 A 97 97 SER H H 97 8.850 8.848 0.002 1
1 1118 . 20 1 1 A 97 97 SER HA H 97 4.310 4.814 -0.504 1
1 1121 . 20 1 1 A 97 97 SER C C 97 175.570 174.208 1.362 1
1 1122 . 20 1 1 A 97 97 SER CA C 97 60.850 58.474 2.376 1
1 1123 . 20 1 1 A 97 97 SER CB C 97 63.000 63.499 -0.499 1
1 1124 . 20 1 1 A 97 97 SER N N 97 116.420 116.140 0.280 1
1 1125 . 20 1 1 A 98 98 ASP H H 98 8.360 7.798 0.562 1
1 1126 . 20 1 1 A 98 98 ASP HA H 98 4.310 4.981 -0.671 1
1 1129 . 20 1 1 A 98 98 ASP C C 98 175.380 175.771 -0.391 1
1 1130 . 20 1 1 A 98 98 ASP CA C 98 54.190 54.887 -0.697 1
1 1131 . 20 1 1 A 98 98 ASP CB C 98 40.740 43.712 -2.972 1
1 1132 . 20 1 1 A 98 98 ASP N N 98 116.320 119.338 -3.018 1
1 1133 . 20 1 1 A 99 99 ARG H H 99 7.450 7.105 0.345 1
1 1134 . 20 1 1 A 99 99 ARG HA H 99 4.350 4.415 -0.065 1
1 1141 . 20 1 1 A 99 99 ARG CA C 99 52.920 52.907 0.013 1
1 1142 . 20 1 1 A 99 99 ARG CB C 99 30.340 31.634 -1.294 1
1 1145 . 20 1 1 A 99 99 ARG N N 99 119.960 117.634 2.326 1
1 1146 . 20 1 1 A 100 100 PRO HA H 100 4.750 4.542 0.208 1
1 1153 . 20 1 1 A 100 100 PRO C C 100 175.220 176.853 -1.633 1
1 1154 . 20 1 1 A 100 100 PRO CA C 100 62.680 62.589 0.091 1
1 1155 . 20 1 1 A 100 100 PRO CB C 100 32.820 31.533 1.287 1
1 1158 . 20 1 1 A 101 101 ALA H H 101 7.210 8.267 -1.057 1
1 1159 . 20 1 1 A 101 101 ALA HA H 101 5.030 4.419 0.611 1
1 1163 . 20 1 1 A 101 101 ALA CA C 101 48.570 50.395 -1.825 1
1 1164 . 20 1 1 A 101 101 ALA CB C 101 19.660 17.564 2.096 1
1 1165 . 20 1 1 A 101 101 ALA N N 101 124.490 124.898 -0.408 1
1 1166 . 20 1 1 A 102 102 PRO HA H 102 4.440 4.970 -0.530 1
1 1173 . 20 1 1 A 102 102 PRO C C 102 177.200 176.639 0.561 1
1 1174 . 20 1 1 A 102 102 PRO CA C 102 62.190 62.940 -0.750 1
1 1175 . 20 1 1 A 102 102 PRO CB C 102 32.310 32.967 -0.657 1
1 1178 . 20 1 1 A 103 103 ILE H H 103 8.550 8.432 0.118 1
1 1179 . 20 1 1 A 103 103 ILE HA H 103 4.630 5.000 -0.370 1
1 1189 . 20 1 1 A 103 103 ILE C C 103 175.460 175.166 0.294 1
1 1190 . 20 1 1 A 103 103 ILE CA C 103 59.730 58.591 1.139 1
1 1191 . 20 1 1 A 103 103 ILE CB C 103 40.140 42.136 -1.996 1
1 1195 . 20 1 1 A 103 103 ILE N N 103 115.670 116.716 -1.046 1
1 1196 . 20 1 1 A 104 104 SER H H 104 8.730 8.739 -0.009 1
1 1197 . 20 1 1 A 104 104 SER HA H 104 4.500 4.653 -0.153 1
1 1200 . 20 1 1 A 104 104 SER C C 104 174.840 175.393 -0.553 1
1 1201 . 20 1 1 A 104 104 SER CA C 104 58.010 57.656 0.354 1
1 1202 . 20 1 1 A 104 104 SER CB C 104 65.470 64.734 0.736 1
1 1203 . 20 1 1 A 104 104 SER N N 104 119.170 117.510 1.660 1
1 1204 . 20 1 1 A 105 105 ASP H H 105 8.830 9.070 -0.240 1
1 1205 . 20 1 1 A 105 105 ASP HA H 105 4.200 4.287 -0.087 1
1 1208 . 20 1 1 A 105 105 ASP C C 105 178.520 178.317 0.203 1
1 1209 . 20 1 1 A 105 105 ASP CA C 105 57.870 57.823 0.047 1
1 1210 . 20 1 1 A 105 105 ASP CB C 105 40.040 40.369 -0.329 1
1 1211 . 20 1 1 A 105 105 ASP N N 105 121.640 122.087 -0.447 1
1 1212 . 20 1 1 A 106 106 LYS H H 106 8.130 8.049 0.081 1
1 1213 . 20 1 1 A 106 106 LYS HA H 106 4.100 3.938 0.162 1
1 1222 . 20 1 1 A 106 106 LYS C C 106 179.400 178.738 0.662 1
1 1223 . 20 1 1 A 106 106 LYS CA C 106 58.980 59.535 -0.555 1
1 1224 . 20 1 1 A 106 106 LYS CB C 106 32.330 32.172 0.158 1
1 1228 . 20 1 1 A 106 106 LYS N N 106 118.300 121.504 -3.204 1
1 1229 . 20 1 1 A 107 107 GLU H H 107 7.670 7.738 -0.068 1
1 1230 . 20 1 1 A 107 107 GLU HA H 107 4.020 4.025 -0.005 1
1 1235 . 20 1 1 A 107 107 GLU C C 107 178.750 179.066 -0.316 1
1 1236 . 20 1 1 A 107 107 GLU CA C 107 59.210 59.198 0.012 1
1 1237 . 20 1 1 A 107 107 GLU CB C 107 29.780 29.525 0.255 1
1 1239 . 20 1 1 A 107 107 GLU N N 107 121.270 119.071 2.199 1
1 1240 . 20 1 1 A 108 108 VAL H H 108 7.790 7.789 0.001 1
1 1241 . 20 1 1 A 108 108 VAL HA H 108 3.050 3.416 -0.366 1
1 1249 . 20 1 1 A 108 108 VAL C C 108 177.550 177.289 0.261 1
1 1250 . 20 1 1 A 108 108 VAL CA C 108 67.080 66.175 0.905 1
1 1251 . 20 1 1 A 108 108 VAL CB C 108 31.220 31.005 0.215 1
1 1254 . 20 1 1 A 108 108 VAL N N 108 120.940 120.175 0.765 1
1 1255 . 20 1 1 A 109 109 ASP H H 109 7.840 7.835 0.005 1
1 1256 . 20 1 1 A 109 109 ASP HA H 109 4.110 4.236 -0.126 1
1 1259 . 20 1 1 A 109 109 ASP C C 109 178.190 178.450 -0.260 1
1 1260 . 20 1 1 A 109 109 ASP CA C 109 57.470 57.242 0.228 1
1 1261 . 20 1 1 A 109 109 ASP CB C 109 40.480 40.049 0.431 1
1 1262 . 20 1 1 A 109 109 ASP N N 109 118.780 120.455 -1.675 1
1 1263 . 20 1 1 A 110 110 ALA H H 110 7.520 7.385 0.135 1
1 1264 . 20 1 1 A 110 110 ALA HA H 110 4.110 4.126 -0.016 1
1 1268 . 20 1 1 A 110 110 ALA C C 110 180.550 179.655 0.895 1
1 1269 . 20 1 1 A 110 110 ALA CA C 110 54.880 55.017 -0.137 1
1 1270 . 20 1 1 A 110 110 ALA CB C 110 18.440 18.323 0.117 1
1 1271 . 20 1 1 A 110 110 ALA N N 110 120.640 122.572 -1.932 1
1 1272 . 20 1 1 A 111 111 ILE H H 111 7.840 7.983 -0.143 1
1 1273 . 20 1 1 A 111 111 ILE HA H 111 3.580 3.516 0.064 1
1 1281 . 20 1 1 A 111 111 ILE C C 111 177.470 178.106 -0.636 1
1 1282 . 20 1 1 A 111 111 ILE CA C 111 64.620 64.917 -0.297 1
1 1283 . 20 1 1 A 111 111 ILE CB C 111 38.600 37.670 0.930 1
1 1286 . 20 1 1 A 111 111 ILE N N 111 119.840 119.189 0.651 1
1 1287 . 20 1 1 A 112 112 MET H H 112 8.100 7.964 0.136 1
1 1288 . 20 1 1 A 112 112 MET HA H 112 4.400 4.239 0.161 1
1 1296 . 20 1 1 A 112 112 MET C C 112 177.710 178.928 -1.218 1
1 1297 . 20 1 1 A 112 112 MET CA C 112 55.300 58.761 -3.461 1
1 1298 . 20 1 1 A 112 112 MET CB C 112 30.510 32.823 -2.313 1
1 1301 . 20 1 1 A 112 112 MET N N 112 115.180 118.649 -3.469 1
1 1302 . 20 1 1 A 113 113 ASN H H 113 8.070 7.900 0.170 1
1 1303 . 20 1 1 A 113 113 ASN HA H 113 4.570 4.476 0.094 1
1 1308 . 20 1 1 A 113 113 ASN C C 113 175.530 177.828 -2.298 1
1 1309 . 20 1 1 A 113 113 ASN CA C 113 54.420 56.126 -1.706 1
1 1310 . 20 1 1 A 113 113 ASN CB C 113 38.350 37.918 0.432 1
1 1311 . 20 1 1 A 113 113 ASN N N 113 117.190 117.345 -0.155 1
1 1313 . 20 1 1 A 114 114 ARG H H 114 8.070 7.610 0.460 1
1 1314 . 20 1 1 A 114 114 ARG HA H 114 4.280 4.129 0.151 1
1 1321 . 20 1 1 A 114 114 ARG C C 114 176.620 178.079 -1.459 1
1 1322 . 20 1 1 A 114 114 ARG CA C 114 56.910 59.185 -2.275 1
1 1323 . 20 1 1 A 114 114 ARG CB C 114 30.370 29.835 0.535 1
1 1326 . 20 1 1 A 114 114 ARG N N 114 118.360 120.629 -2.269 1
1 1327 . 20 1 1 A 115 115 LEU H H 115 8.100 8.026 0.074 1
1 1328 . 20 1 1 A 115 115 LEU HA H 115 4.310 4.138 0.172 1
1 1338 . 20 1 1 A 115 115 LEU C C 115 177.440 178.550 -1.110 1
1 1339 . 20 1 1 A 115 115 LEU CA C 115 55.440 57.950 -2.510 1
1 1340 . 20 1 1 A 115 115 LEU CB C 115 42.250 41.721 0.529 1
1 1344 . 20 1 1 A 115 115 LEU N N 115 120.580 120.657 -0.077 1
1 1345 . 20 1 1 A 116 116 GLN H H 116 8.180 7.995 0.185 1
1 1346 . 20 1 1 A 116 116 GLN HA H 116 4.360 3.976 0.384 1
1 1353 . 20 1 1 A 116 116 GLN C C 116 175.890 178.303 -2.413 1
1 1354 . 20 1 1 A 116 116 GLN CA C 116 55.810 58.905 -3.095 1
1 1355 . 20 1 1 A 116 116 GLN CB C 116 29.500 28.697 0.803 1
1 1357 . 20 1 1 A 116 116 GLN N N 116 119.770 117.817 1.953 1
1 1358 . 20 1 1 A 117 117 GLN H H 117 8.350 8.308 0.042 1
1 1359 . 20 1 1 A 117 117 GLN HA H 117 4.380 4.083 0.297 1
1 1366 . 20 1 1 A 117 117 GLN C C 117 176.130 176.772 -0.642 1
1 1367 . 20 1 1 A 117 117 GLN CA C 117 55.810 58.816 -3.006 1
1 1368 . 20 1 1 A 117 117 GLN CB C 117 29.500 28.134 1.366 1
1 1370 . 20 1 1 A 117 117 GLN N N 117 121.440 119.243 2.197 1
1 1371 . 20 1 1 A 118 118 VAL H H 118 8.240 7.222 1.018 1
1 1372 . 20 1 1 A 118 118 VAL HA H 118 4.120 4.048 0.072 1
1 1380 . 20 1 1 A 118 118 VAL C C 118 176.650 176.005 0.645 1
1 1381 . 20 1 1 A 118 118 VAL CA C 118 62.720 62.901 -0.181 1
1 1382 . 20 1 1 A 118 118 VAL CB C 118 32.730 32.078 0.652 1
1 1385 . 20 1 1 A 118 118 VAL N N 118 121.250 118.755 2.495 1
1 1386 . 20 1 1 A 119 119 GLY H H 119 8.460 8.711 -0.251 1
1 1387 . 20 1 1 A 119 119 GLY HA2 H 119 3.990 4.007 -0.017 1
1 1388 . 20 1 1 A 119 119 GLY HA3 H 119 3.990 4.008 -0.018 1
1 1389 . 20 1 1 A 119 119 GLY C C 119 173.770 174.566 -0.796 1
1 1390 . 20 1 1 A 119 119 GLY CA C 119 45.260 46.175 -0.915 1
1 1391 . 20 1 1 A 119 119 GLY N N 119 112.300 115.180 -2.880 1
1 1392 . 20 1 1 A 120 120 ASP H H 120 8.230 8.657 -0.427 1
1 1393 . 20 1 1 A 120 120 ASP HA H 120 4.580 4.342 0.238 1
1 1396 . 20 1 1 A 120 120 ASP C C 120 175.180 176.772 -1.592 1
1 1397 . 20 1 1 A 120 120 ASP CA C 120 54.340 56.769 -2.429 1
1 1398 . 20 1 1 A 120 120 ASP CB C 120 41.390 40.949 0.441 1
1 1399 . 20 1 1 A 120 120 ASP N N 120 120.420 125.697 -5.277 1
1 1400 . 20 1 1 A 121 121 LYS H H 121 7.950 7.941 0.009 1
1 1401 . 20 1 1 A 121 121 LYS HA H 121 4.240 4.656 -0.416 1
1 1402 . 20 1 1 A 121 121 LYS CA C 121 53.620 53.356 0.264 1
1 1403 . 20 1 1 A 121 121 LYS N N 121 119.110 118.954 0.156 1
1 1404 . 20 1 1 A 122 122 PRO HA H 122 4.410 4.711 -0.301 1
1 1405 . 20 1 1 A 122 122 PRO C C 122 176.560 176.585 -0.025 1
1 1406 . 20 1 1 A 122 122 PRO CA C 122 63.130 64.159 -1.029 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 114 1.168 1
2 1 1 1 "RMS(OBS, PRED)" CA 120 1.536 1
3 1 1 1 "RMS(OBS, PRED)" CB 100 1.263 1
4 1 1 1 "RMS(OBS, PRED)" H 114 0.563 1
5 1 1 1 "RMS(OBS, PRED)" HA 130 0.344 1
6 1 1 1 "RMS(OBS, PRED)" N 114 3.062 1
7 1 2 1 "RMS(OBS, PRED)" C 114 1.128 1
8 1 2 1 "RMS(OBS, PRED)" CA 120 1.603 1
9 1 2 1 "RMS(OBS, PRED)" CB 100 1.442 1
10 1 2 1 "RMS(OBS, PRED)" H 114 0.592 1
11 1 2 1 "RMS(OBS, PRED)" HA 130 0.374 1
12 1 2 1 "RMS(OBS, PRED)" N 114 3.143 1
13 1 3 1 "RMS(OBS, PRED)" C 114 1.046 1
14 1 3 1 "RMS(OBS, PRED)" CA 120 1.454 1
15 1 3 1 "RMS(OBS, PRED)" CB 100 1.244 1
16 1 3 1 "RMS(OBS, PRED)" H 114 0.591 1
17 1 3 1 "RMS(OBS, PRED)" HA 130 0.349 1
18 1 3 1 "RMS(OBS, PRED)" N 114 3.058 1
19 1 4 1 "RMS(OBS, PRED)" C 114 1.178 1
20 1 4 1 "RMS(OBS, PRED)" CA 120 1.640 1
21 1 4 1 "RMS(OBS, PRED)" CB 100 1.378 1
22 1 4 1 "RMS(OBS, PRED)" H 114 0.541 1
23 1 4 1 "RMS(OBS, PRED)" HA 130 0.369 1
24 1 4 1 "RMS(OBS, PRED)" N 114 2.957 1
25 1 5 1 "RMS(OBS, PRED)" C 114 1.069 1
26 1 5 1 "RMS(OBS, PRED)" CA 120 1.426 1
27 1 5 1 "RMS(OBS, PRED)" CB 100 1.406 1
28 1 5 1 "RMS(OBS, PRED)" H 114 0.575 1
29 1 5 1 "RMS(OBS, PRED)" HA 130 0.350 1
30 1 5 1 "RMS(OBS, PRED)" N 114 2.933 1
31 1 6 1 "RMS(OBS, PRED)" C 114 1.087 1
32 1 6 1 "RMS(OBS, PRED)" CA 120 1.482 1
33 1 6 1 "RMS(OBS, PRED)" CB 100 1.316 1
34 1 6 1 "RMS(OBS, PRED)" H 114 0.582 1
35 1 6 1 "RMS(OBS, PRED)" HA 130 0.334 1
36 1 6 1 "RMS(OBS, PRED)" N 114 3.087 1
37 1 7 1 "RMS(OBS, PRED)" C 114 1.181 1
38 1 7 1 "RMS(OBS, PRED)" CA 120 1.611 1
39 1 7 1 "RMS(OBS, PRED)" CB 100 1.430 1
40 1 7 1 "RMS(OBS, PRED)" H 114 0.575 1
41 1 7 1 "RMS(OBS, PRED)" HA 130 0.372 1
42 1 7 1 "RMS(OBS, PRED)" N 114 3.005 1
43 1 8 1 "RMS(OBS, PRED)" C 114 1.071 1
44 1 8 1 "RMS(OBS, PRED)" CA 120 1.351 1
45 1 8 1 "RMS(OBS, PRED)" CB 100 1.252 1
46 1 8 1 "RMS(OBS, PRED)" H 114 0.544 1
47 1 8 1 "RMS(OBS, PRED)" HA 130 0.346 1
48 1 8 1 "RMS(OBS, PRED)" N 114 2.811 1
49 1 9 1 "RMS(OBS, PRED)" C 114 1.172 1
50 1 9 1 "RMS(OBS, PRED)" CA 120 1.533 1
51 1 9 1 "RMS(OBS, PRED)" CB 100 1.338 1
52 1 9 1 "RMS(OBS, PRED)" H 114 0.606 1
53 1 9 1 "RMS(OBS, PRED)" HA 130 0.347 1
54 1 9 1 "RMS(OBS, PRED)" N 114 3.054 1
55 1 10 1 "RMS(OBS, PRED)" C 114 1.082 1
56 1 10 1 "RMS(OBS, PRED)" CA 120 1.601 1
57 1 10 1 "RMS(OBS, PRED)" CB 100 1.420 1
58 1 10 1 "RMS(OBS, PRED)" H 114 0.607 1
59 1 10 1 "RMS(OBS, PRED)" HA 130 0.361 1
60 1 10 1 "RMS(OBS, PRED)" N 114 3.239 1
61 1 11 1 "RMS(OBS, PRED)" C 114 1.139 1
62 1 11 1 "RMS(OBS, PRED)" CA 120 1.772 1
63 1 11 1 "RMS(OBS, PRED)" CB 100 1.268 1
64 1 11 1 "RMS(OBS, PRED)" H 114 0.583 1
65 1 11 1 "RMS(OBS, PRED)" HA 130 0.349 1
66 1 11 1 "RMS(OBS, PRED)" N 114 3.331 1
67 1 12 1 "RMS(OBS, PRED)" C 114 1.171 1
68 1 12 1 "RMS(OBS, PRED)" CA 120 1.611 1
69 1 12 1 "RMS(OBS, PRED)" CB 100 1.401 1
70 1 12 1 "RMS(OBS, PRED)" H 114 0.564 1
71 1 12 1 "RMS(OBS, PRED)" HA 130 0.343 1
72 1 12 1 "RMS(OBS, PRED)" N 114 2.961 1
73 1 13 1 "RMS(OBS, PRED)" C 114 1.095 1
74 1 13 1 "RMS(OBS, PRED)" CA 120 1.535 1
75 1 13 1 "RMS(OBS, PRED)" CB 100 1.512 1
76 1 13 1 "RMS(OBS, PRED)" H 114 0.562 1
77 1 13 1 "RMS(OBS, PRED)" HA 130 0.397 1
78 1 13 1 "RMS(OBS, PRED)" N 114 3.015 1
79 1 14 1 "RMS(OBS, PRED)" C 114 1.178 1
80 1 14 1 "RMS(OBS, PRED)" CA 120 1.488 1
81 1 14 1 "RMS(OBS, PRED)" CB 100 1.229 1
82 1 14 1 "RMS(OBS, PRED)" H 114 0.540 1
83 1 14 1 "RMS(OBS, PRED)" HA 130 0.339 1
84 1 14 1 "RMS(OBS, PRED)" N 114 3.001 1
85 1 15 1 "RMS(OBS, PRED)" C 114 1.139 1
86 1 15 1 "RMS(OBS, PRED)" CA 120 1.478 1
87 1 15 1 "RMS(OBS, PRED)" CB 100 1.331 1
88 1 15 1 "RMS(OBS, PRED)" H 114 0.555 1
89 1 15 1 "RMS(OBS, PRED)" HA 130 0.376 1
90 1 15 1 "RMS(OBS, PRED)" N 114 2.955 1
91 1 16 1 "RMS(OBS, PRED)" C 114 1.181 1
92 1 16 1 "RMS(OBS, PRED)" CA 120 1.514 1
93 1 16 1 "RMS(OBS, PRED)" CB 100 1.366 1
94 1 16 1 "RMS(OBS, PRED)" H 114 0.574 1
95 1 16 1 "RMS(OBS, PRED)" HA 130 0.359 1
96 1 16 1 "RMS(OBS, PRED)" N 114 2.698 1
97 1 17 1 "RMS(OBS, PRED)" C 114 1.128 1
98 1 17 1 "RMS(OBS, PRED)" CA 120 1.493 1
99 1 17 1 "RMS(OBS, PRED)" CB 100 1.405 1
100 1 17 1 "RMS(OBS, PRED)" H 114 0.602 1
101 1 17 1 "RMS(OBS, PRED)" HA 130 0.348 1
102 1 17 1 "RMS(OBS, PRED)" N 114 3.094 1
103 1 18 1 "RMS(OBS, PRED)" C 114 1.088 1
104 1 18 1 "RMS(OBS, PRED)" CA 120 1.507 1
105 1 18 1 "RMS(OBS, PRED)" CB 100 1.401 1
106 1 18 1 "RMS(OBS, PRED)" H 114 0.597 1
107 1 18 1 "RMS(OBS, PRED)" HA 130 0.371 1
108 1 18 1 "RMS(OBS, PRED)" N 114 3.107 1
109 1 19 1 "RMS(OBS, PRED)" C 114 1.127 1
110 1 19 1 "RMS(OBS, PRED)" CA 120 1.539 1
111 1 19 1 "RMS(OBS, PRED)" CB 100 1.391 1
112 1 19 1 "RMS(OBS, PRED)" H 114 0.574 1
113 1 19 1 "RMS(OBS, PRED)" HA 130 0.384 1
114 1 19 1 "RMS(OBS, PRED)" N 114 3.149 1
115 1 20 1 "RMS(OBS, PRED)" C 114 1.079 1
116 1 20 1 "RMS(OBS, PRED)" CA 120 1.472 1
117 1 20 1 "RMS(OBS, PRED)" CB 100 1.294 1
118 1 20 1 "RMS(OBS, PRED)" H 114 0.570 1
119 1 20 1 "RMS(OBS, PRED)" HA 130 0.385 1
120 1 20 1 "RMS(OBS, PRED)" N 114 2.827 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 2 . 1 1 A 2 2 SER H H 2 7.890 8.295 -0.405 2
1 3 . 1 1 A 2 2 SER HA H 2 4.270 4.411 -0.141 2
1 4 . 1 1 A 2 2 SER C C 2 173.960 175.079 -1.119 2
1 5 . 1 1 A 2 2 SER CA C 2 60.800 60.065 0.735 2
1 6 . 1 1 A 2 2 SER N N 2 111.940 116.074 -4.134 2
1 7 . 1 1 A 3 3 GLU H H 3 8.010 8.225 -0.215 2
1 8 . 1 1 A 3 3 GLU HA H 3 4.360 4.386 -0.026 2
1 9 . 1 1 A 3 3 GLU C C 3 175.710 176.286 -0.576 2
1 10 . 1 1 A 3 3 GLU CA C 3 56.310 57.364 -1.054 2
1 11 . 1 1 A 3 3 GLU N N 3 121.280 121.744 -0.464 2
1 12 . 1 1 A 4 4 ALA H H 4 8.540 8.178 0.362 2
1 13 . 1 1 A 4 4 ALA HA H 4 4.560 4.481 0.079 2
1 14 . 1 1 A 4 4 ALA CA C 4 50.630 50.816 -0.186 2
1 15 . 1 1 A 4 4 ALA N N 4 127.840 123.200 4.640 2
1 16 . 1 1 A 5 5 PRO HA H 5 4.420 4.573 -0.153 2
1 17 . 1 1 A 5 5 PRO C C 5 174.240 176.294 -2.054 2
1 18 . 1 1 A 5 5 PRO CA C 5 62.840 62.914 -0.074 2
1 19 . 1 1 A 6 6 LYS H H 6 8.320 8.357 -0.037 2
1 20 . 1 1 A 6 6 LYS HA H 6 4.290 4.573 -0.283 2
1 21 . 1 1 A 6 6 LYS C C 6 176.100 175.731 0.369 2
1 22 . 1 1 A 6 6 LYS CA C 6 55.540 55.548 -0.009 2
1 23 . 1 1 A 6 6 LYS N N 6 121.910 120.806 1.104 2
1 24 . 1 1 A 7 7 LYS H H 7 8.450 8.370 0.080 2
1 25 . 1 1 A 7 7 LYS HA H 7 3.940 4.583 -0.643 2
1 26 . 1 1 A 7 7 LYS C C 7 175.700 175.649 0.051 2
1 27 . 1 1 A 7 7 LYS CA C 7 56.440 55.455 0.985 2
1 28 . 1 1 A 7 7 LYS N N 7 122.250 121.474 0.776 2
1 29 . 1 1 A 8 8 ARG H H 8 8.210 8.636 -0.426 2
1 30 . 1 1 A 8 8 ARG HA H 8 4.670 4.772 -0.102 2
1 31 . 1 1 A 8 8 ARG C C 8 173.760 174.734 -0.974 2
1 32 . 1 1 A 8 8 ARG CA C 8 53.420 54.037 -0.617 2
1 33 . 1 1 A 8 8 ARG N N 8 122.560 122.358 0.202 2
1 34 . 1 1 A 9 9 TRP H H 9 8.610 8.686 -0.076 2
1 35 . 1 1 A 9 9 TRP HA H 9 4.910 5.266 -0.356 2
1 44 . 1 1 A 9 9 TRP C C 9 174.610 175.394 -0.784 2
1 45 . 1 1 A 9 9 TRP CA C 9 57.630 55.752 1.878 2
1 46 . 1 1 A 9 9 TRP CB C 9 31.020 30.783 0.237 2
1 52 . 1 1 A 9 9 TRP N N 9 120.540 121.119 -0.579 2
1 54 . 1 1 A 10 10 TYR H H 10 9.260 9.006 0.254 2
1 55 . 1 1 A 10 10 TYR HA H 10 4.820 5.240 -0.420 2
1 62 . 1 1 A 10 10 TYR C C 10 174.340 175.229 -0.889 2
1 63 . 1 1 A 10 10 TYR CA C 10 57.050 56.493 0.557 2
1 64 . 1 1 A 10 10 TYR CB C 10 41.920 42.708 -0.788 2
1 69 . 1 1 A 10 10 TYR N N 10 118.990 121.799 -2.809 2
1 70 . 1 1 A 11 11 VAL H H 11 9.450 8.939 0.511 2
1 71 . 1 1 A 11 11 VAL HA H 11 4.470 4.744 -0.274 2
1 79 . 1 1 A 11 11 VAL C C 11 175.030 175.446 -0.416 2
1 80 . 1 1 A 11 11 VAL CA C 11 62.320 61.796 0.524 2
1 81 . 1 1 A 11 11 VAL CB C 11 32.400 33.100 -0.700 2
1 84 . 1 1 A 11 11 VAL N N 11 120.930 122.621 -1.691 2
1 85 . 1 1 A 12 12 VAL H H 12 9.320 9.379 -0.059 2
1 86 . 1 1 A 12 12 VAL HA H 12 3.940 4.305 -0.365 2
1 94 . 1 1 A 12 12 VAL C C 12 173.870 174.271 -0.401 2
1 95 . 1 1 A 12 12 VAL CA C 12 61.330 60.895 0.435 2
1 96 . 1 1 A 12 12 VAL CB C 12 33.500 34.550 -1.050 2
1 99 . 1 1 A 12 12 VAL N N 12 128.860 127.299 1.561 2
1 100 . 1 1 A 13 13 GLN H H 13 8.830 8.609 0.221 2
1 101 . 1 1 A 13 13 GLN HA H 13 4.710 4.848 -0.138 2
1 108 . 1 1 A 13 13 GLN C C 13 174.230 175.156 -0.926 2
1 109 . 1 1 A 13 13 GLN CA C 13 54.800 55.350 -0.550 2
1 110 . 1 1 A 13 13 GLN CB C 13 29.450 29.736 -0.286 2
1 111 . 1 1 A 13 13 GLN N N 13 126.050 127.425 -1.375 2
1 113 . 1 1 A 14 14 ALA H H 14 9.420 8.638 0.782 2
1 114 . 1 1 A 14 14 ALA HA H 14 5.150 4.702 0.448 2
1 118 . 1 1 A 14 14 ALA C C 14 176.400 176.051 0.349 2
1 119 . 1 1 A 14 14 ALA CA C 14 49.660 51.114 -1.454 2
1 120 . 1 1 A 14 14 ALA CB C 14 22.840 22.549 0.291 2
1 121 . 1 1 A 14 14 ALA N N 14 131.620 125.397 6.223 2
1 122 . 1 1 A 15 15 PHE H H 15 8.070 8.610 -0.540 2
1 123 . 1 1 A 15 15 PHE HA H 15 4.410 4.778 -0.368 2
1 128 . 1 1 A 15 15 PHE C C 15 176.130 175.840 0.290 2
1 129 . 1 1 A 15 15 PHE CA C 15 58.550 58.468 0.082 2
1 130 . 1 1 A 15 15 PHE CB C 15 39.780 39.994 -0.214 2
1 133 . 1 1 A 15 15 PHE N N 15 119.680 119.092 0.588 2
1 134 . 1 1 A 16 16 SER H H 16 8.370 8.779 -0.409 2
1 135 . 1 1 A 16 16 SER HA H 16 4.140 4.239 -0.099 2
1 138 . 1 1 A 16 16 SER C C 16 175.820 175.272 0.548 2
1 139 . 1 1 A 16 16 SER CA C 16 60.570 60.018 0.552 2
1 140 . 1 1 A 16 16 SER CB C 16 63.030 63.034 -0.004 2
1 141 . 1 1 A 16 16 SER N N 16 119.700 118.972 0.728 2
1 142 . 1 1 A 17 17 GLY H H 17 9.130 8.791 0.339 2
1 143 . 1 1 A 17 17 GLY HA2 H 17 3.640 3.684 -0.044 2
1 144 . 1 1 A 17 17 GLY HA3 H 17 4.200 3.825 0.375 2
1 145 . 1 1 A 17 17 GLY C C 17 175.520 174.843 0.677 2
1 146 . 1 1 A 17 17 GLY CA C 17 45.260 45.302 -0.042 2
1 147 . 1 1 A 17 17 GLY N N 17 115.850 113.825 2.025 2
1 148 . 1 1 A 18 18 PHE H H 18 8.480 7.803 0.677 2
1 149 . 1 1 A 18 18 PHE HA H 18 4.740 4.614 0.126 2
1 154 . 1 1 A 18 18 PHE C C 18 175.430 176.407 -0.977 2
1 155 . 1 1 A 18 18 PHE CA C 18 58.240 58.134 0.106 2
1 156 . 1 1 A 18 18 PHE CB C 18 39.010 38.738 0.272 2
1 159 . 1 1 A 18 18 PHE N N 18 118.550 119.821 -1.271 2
1 160 . 1 1 A 19 19 GLU H H 19 10.690 8.349 2.341 2
1 161 . 1 1 A 19 19 GLU HA H 19 3.490 4.109 -0.619 2
1 166 . 1 1 A 19 19 GLU C C 19 177.650 179.246 -1.596 2
1 167 . 1 1 A 19 19 GLU CA C 19 62.280 59.492 2.788 2
1 168 . 1 1 A 19 19 GLU CB C 19 28.380 29.339 -0.959 2
1 170 . 1 1 A 19 19 GLU N N 19 123.470 121.739 1.732 2
1 171 . 1 1 A 20 20 GLY H H 20 8.740 8.288 0.452 2
1 172 . 1 1 A 20 20 GLY HA2 H 20 3.840 3.812 0.028 2
1 173 . 1 1 A 20 20 GLY HA3 H 20 3.940 3.823 0.117 2
1 174 . 1 1 A 20 20 GLY C C 20 176.860 175.612 1.248 2
1 175 . 1 1 A 20 20 GLY CA C 20 47.140 47.123 0.017 2
1 176 . 1 1 A 20 20 GLY N N 20 105.480 108.340 -2.860 2
1 177 . 1 1 A 21 21 ARG H H 21 7.690 8.248 -0.558 2
1 178 . 1 1 A 21 21 ARG HA H 21 4.180 4.125 0.055 2
1 185 . 1 1 A 21 21 ARG C C 21 179.490 178.648 0.842 2
1 186 . 1 1 A 21 21 ARG CA C 21 58.660 59.218 -0.558 2
1 187 . 1 1 A 21 21 ARG CB C 21 30.100 29.879 0.221 2
1 190 . 1 1 A 21 21 ARG N N 21 123.120 122.045 1.075 2
1 191 . 1 1 A 22 22 VAL H H 22 8.980 8.618 0.362 2
1 192 . 1 1 A 22 22 VAL HA H 22 3.560 3.711 -0.151 2
1 200 . 1 1 A 22 22 VAL C C 22 177.320 178.296 -0.976 2
1 201 . 1 1 A 22 22 VAL CA C 22 66.960 66.336 0.624 2
1 202 . 1 1 A 22 22 VAL CB C 22 31.050 31.584 -0.534 2
1 205 . 1 1 A 22 22 VAL N N 22 122.760 119.942 2.818 2
1 206 . 1 1 A 23 23 ALA H H 23 8.280 8.009 0.271 2
1 207 . 1 1 A 23 23 ALA HA H 23 3.850 4.045 -0.195 2
1 211 . 1 1 A 23 23 ALA C C 23 179.340 179.662 -0.322 2
1 212 . 1 1 A 23 23 ALA CA C 23 56.260 55.272 0.988 2
1 213 . 1 1 A 23 23 ALA CB C 23 18.260 18.262 -0.002 2
1 214 . 1 1 A 23 23 ALA N N 23 122.120 121.758 0.362 2
1 215 . 1 1 A 24 24 THR H H 24 8.020 7.679 0.341 2
1 216 . 1 1 A 24 24 THR HA H 24 3.920 3.931 -0.011 2
1 221 . 1 1 A 24 24 THR C C 24 176.940 176.468 0.472 2
1 222 . 1 1 A 24 24 THR CA C 24 66.820 66.681 0.139 2
1 223 . 1 1 A 24 24 THR CB C 24 68.930 68.408 0.522 2
1 225 . 1 1 A 24 24 THR N N 24 113.410 115.251 -1.841 2
1 226 . 1 1 A 25 25 SER H H 25 8.570 8.186 0.384 2
1 227 . 1 1 A 25 25 SER HA H 25 4.400 4.028 0.372 2
1 230 . 1 1 A 25 25 SER C C 25 177.610 176.393 1.217 2
1 231 . 1 1 A 25 25 SER CA C 25 61.920 62.112 -0.192 2
1 232 . 1 1 A 25 25 SER CB C 25 63.540 62.906 0.634 2
1 233 . 1 1 A 25 25 SER N N 25 118.260 117.156 1.104 2
1 234 . 1 1 A 26 26 LEU H H 26 9.430 8.212 1.218 2
1 235 . 1 1 A 26 26 LEU HA H 26 3.900 4.059 -0.159 2
1 245 . 1 1 A 26 26 LEU C C 26 177.710 178.635 -0.925 2
1 246 . 1 1 A 26 26 LEU CA C 26 58.910 58.094 0.816 2
1 247 . 1 1 A 26 26 LEU CB C 26 41.300 41.552 -0.252 2
1 251 . 1 1 A 26 26 LEU N N 26 124.120 122.154 1.966 2
1 252 . 1 1 A 27 27 ARG H H 27 7.790 7.724 0.066 2
1 253 . 1 1 A 27 27 ARG HA H 27 3.880 3.746 0.134 2
1 260 . 1 1 A 27 27 ARG C C 27 179.380 178.597 0.783 2
1 261 . 1 1 A 27 27 ARG CA C 27 60.510 59.507 1.003 2
1 262 . 1 1 A 27 27 ARG CB C 27 29.670 29.781 -0.111 2
1 265 . 1 1 A 27 27 ARG N N 27 116.710 119.131 -2.421 2
1 266 . 1 1 A 28 28 GLU H H 28 7.900 7.837 0.063 2
1 267 . 1 1 A 28 28 GLU HA H 28 4.070 3.941 0.129 2
1 272 . 1 1 A 28 28 GLU C C 28 179.450 179.115 0.335 2
1 273 . 1 1 A 28 28 GLU CA C 28 59.450 59.085 0.365 2
1 274 . 1 1 A 28 28 GLU CB C 28 29.610 29.317 0.293 2
1 276 . 1 1 A 28 28 GLU N N 28 118.340 118.690 -0.350 2
1 277 . 1 1 A 29 29 HIS H H 29 8.940 7.614 1.325 2
1 278 . 1 1 A 29 29 HIS HA H 29 4.160 4.470 -0.310 2
1 283 . 1 1 A 29 29 HIS C C 29 177.750 177.878 -0.128 2
1 284 . 1 1 A 29 29 HIS CA C 29 61.260 59.533 1.727 2
1 285 . 1 1 A 29 29 HIS CB C 29 29.870 30.102 -0.232 2
1 287 . 1 1 A 29 29 HIS N N 29 120.440 118.318 2.122 2
1 288 . 1 1 A 30 30 ILE H H 30 8.580 8.450 0.130 2
1 289 . 1 1 A 30 30 ILE HA H 30 3.160 3.613 -0.453 2
1 299 . 1 1 A 30 30 ILE C C 30 177.230 177.977 -0.747 2
1 300 . 1 1 A 30 30 ILE CA C 30 66.460 65.133 1.327 2
1 301 . 1 1 A 30 30 ILE CB C 30 38.630 37.595 1.035 2
1 305 . 1 1 A 30 30 ILE N N 30 121.010 120.209 0.801 2
1 306 . 1 1 A 31 31 LYS H H 31 7.020 8.198 -1.178 2
1 307 . 1 1 A 31 31 LYS HA H 31 4.170 4.009 0.161 2
1 316 . 1 1 A 31 31 LYS C C 31 180.570 178.885 1.685 2
1 317 . 1 1 A 31 31 LYS CA C 31 58.920 59.818 -0.898 2
1 318 . 1 1 A 31 31 LYS CB C 31 32.490 32.089 0.401 2
1 322 . 1 1 A 31 31 LYS N N 31 117.400 120.388 -2.988 2
1 323 . 1 1 A 32 32 LEU H H 32 8.400 8.210 0.191 2
1 324 . 1 1 A 32 32 LEU HA H 32 3.990 3.926 0.063 2
1 334 . 1 1 A 32 32 LEU C C 32 178.230 178.441 -0.211 2
1 335 . 1 1 A 32 32 LEU CA C 32 57.700 57.851 -0.151 2
1 336 . 1 1 A 32 32 LEU CB C 32 42.540 41.768 0.772 2
1 340 . 1 1 A 32 32 LEU N N 32 121.180 119.632 1.548 2
1 341 . 1 1 A 33 33 HIS H H 33 7.620 8.078 -0.458 2
1 342 . 1 1 A 33 33 HIS HA H 33 4.600 4.650 -0.050 2
1 347 . 1 1 A 33 33 HIS C C 33 177.090 174.288 2.802 2
1 348 . 1 1 A 33 33 HIS CA C 33 55.840 55.727 0.113 2
1 349 . 1 1 A 33 33 HIS CB C 33 29.330 29.933 -0.602 2
1 351 . 1 1 A 33 33 HIS N N 33 112.220 115.692 -3.472 2
1 352 . 1 1 A 34 34 ASN H H 34 8.030 8.075 -0.045 2
1 353 . 1 1 A 34 34 ASN HA H 34 4.890 4.375 0.515 2
1 358 . 1 1 A 34 34 ASN C C 34 175.910 175.631 0.279 2
1 359 . 1 1 A 34 34 ASN CA C 34 54.530 54.292 0.238 2
1 360 . 1 1 A 34 34 ASN CB C 34 37.380 36.840 0.540 2
1 361 . 1 1 A 34 34 ASN N N 34 117.600 115.384 2.216 2
1 363 . 1 1 A 35 35 MET H H 35 8.330 8.686 -0.356 2
1 364 . 1 1 A 35 35 MET HA H 35 4.940 4.812 0.128 2
1 372 . 1 1 A 35 35 MET C C 35 176.880 176.862 0.018 2
1 373 . 1 1 A 35 35 MET CA C 35 55.600 54.650 0.950 2
1 374 . 1 1 A 35 35 MET CB C 35 33.790 32.906 0.884 2
1 377 . 1 1 A 35 35 MET N N 35 116.190 116.536 -0.346 2
1 378 . 1 1 A 36 36 GLU H H 36 9.730 8.185 1.545 2
1 379 . 1 1 A 36 36 GLU HA H 36 3.850 4.169 -0.319 2
1 384 . 1 1 A 36 36 GLU C C 36 178.290 179.100 -0.810 2
1 385 . 1 1 A 36 36 GLU CA C 36 61.280 59.535 1.745 2
1 386 . 1 1 A 36 36 GLU CB C 36 29.270 29.235 0.035 2
1 388 . 1 1 A 36 36 GLU N N 36 121.630 120.553 1.077 2
1 389 . 1 1 A 37 37 ASP H H 37 8.850 8.163 0.687 2
1 390 . 1 1 A 37 37 ASP HA H 37 4.470 4.442 0.028 2
1 393 . 1 1 A 37 37 ASP C C 37 177.190 178.898 -1.708 2
1 394 . 1 1 A 37 37 ASP CA C 37 56.140 57.388 -1.248 2
1 395 . 1 1 A 37 37 ASP CB C 37 40.050 40.931 -0.881 2
1 396 . 1 1 A 37 37 ASP N N 37 114.390 119.912 -5.522 2
1 397 . 1 1 A 38 38 LEU H H 38 7.880 7.797 0.083 2
1 398 . 1 1 A 38 38 LEU HA H 38 4.290 4.073 0.217 2
1 408 . 1 1 A 38 38 LEU C C 38 175.090 177.555 -2.465 2
1 409 . 1 1 A 38 38 LEU CA C 38 54.670 57.696 -3.026 2
1 410 . 1 1 A 38 38 LEU CB C 38 42.940 41.999 0.941 2
1 414 . 1 1 A 38 38 LEU N N 38 116.550 118.392 -1.842 2
1 415 . 1 1 A 39 39 PHE H H 39 7.500 7.756 -0.256 2
1 416 . 1 1 A 39 39 PHE HA H 39 4.970 4.602 0.368 2
1 424 . 1 1 A 39 39 PHE C C 39 175.380 175.670 -0.290 2
1 425 . 1 1 A 39 39 PHE CA C 39 57.580 58.465 -0.885 2
1 426 . 1 1 A 39 39 PHE CB C 39 44.990 39.477 5.513 2
1 432 . 1 1 A 39 39 PHE N N 39 115.370 117.424 -2.054 2
1 433 . 1 1 A 40 40 GLY H H 40 8.680 8.633 0.047 2
1 434 . 1 1 A 40 40 GLY HA2 H 40 3.370 3.972 -0.602 2
1 435 . 1 1 A 40 40 GLY HA3 H 40 4.550 4.059 0.491 2
1 436 . 1 1 A 40 40 GLY C C 40 173.090 173.864 -0.775 2
1 437 . 1 1 A 40 40 GLY CA C 40 44.180 46.313 -2.133 2
1 438 . 1 1 A 40 40 GLY N N 40 110.930 111.442 -0.512 2
1 439 . 1 1 A 41 41 GLU H H 41 8.320 7.767 0.553 2
1 440 . 1 1 A 41 41 GLU HA H 41 4.280 4.916 -0.636 2
1 445 . 1 1 A 41 41 GLU C C 41 173.900 174.818 -0.918 2
1 446 . 1 1 A 41 41 GLU CA C 41 56.900 54.844 2.056 2
1 447 . 1 1 A 41 41 GLU CB C 41 32.110 33.827 -1.717 2
1 449 . 1 1 A 41 41 GLU N N 41 126.730 118.392 8.338 2
1 450 . 1 1 A 42 42 VAL H H 42 8.100 8.699 -0.599 2
1 451 . 1 1 A 42 42 VAL HA H 42 5.160 5.064 0.096 2
1 459 . 1 1 A 42 42 VAL C C 42 176.340 174.980 1.360 2
1 460 . 1 1 A 42 42 VAL CA C 42 61.200 60.840 0.360 2
1 461 . 1 1 A 42 42 VAL CB C 42 34.770 34.708 0.062 2
1 464 . 1 1 A 42 42 VAL N N 42 119.360 123.736 -4.376 2
1 465 . 1 1 A 43 43 MET H H 43 9.870 9.480 0.389 2
1 466 . 1 1 A 43 43 MET HA H 43 5.070 5.356 -0.286 2
1 474 . 1 1 A 43 43 MET C C 43 173.890 175.119 -1.229 2
1 475 . 1 1 A 43 43 MET CA C 43 54.740 54.184 0.556 2
1 476 . 1 1 A 43 43 MET CB C 43 37.500 36.449 1.051 2
1 479 . 1 1 A 43 43 MET N N 43 125.720 124.826 0.894 2
1 480 . 1 1 A 44 44 VAL H H 44 8.800 8.910 -0.110 2
1 481 . 1 1 A 44 44 VAL HA H 44 4.720 4.715 0.004 2
1 489 . 1 1 A 44 44 VAL CA C 44 59.090 59.093 -0.003 2
1 490 . 1 1 A 44 44 VAL CB C 44 33.710 33.899 -0.189 2
1 493 . 1 1 A 44 44 VAL N N 44 122.340 123.071 -0.731 2
1 494 . 1 1 A 45 45 PRO HA H 45 4.480 4.480 -0.000 2
1 501 . 1 1 A 45 45 PRO C C 45 177.080 175.964 1.116 2
1 502 . 1 1 A 45 45 PRO CA C 45 63.240 63.666 -0.426 2
1 503 . 1 1 A 45 45 PRO CB C 45 32.170 31.058 1.112 2
1 506 . 1 1 A 46 46 THR H H 46 8.200 7.817 0.382 2
1 507 . 1 1 A 46 46 THR HA H 46 4.290 4.627 -0.337 2
1 512 . 1 1 A 46 46 THR C C 46 174.600 173.974 0.626 2
1 513 . 1 1 A 46 46 THR CA C 46 62.100 60.489 1.611 2
1 514 . 1 1 A 46 46 THR CB C 46 69.990 70.818 -0.828 2
1 516 . 1 1 A 46 46 THR N N 46 113.410 110.848 2.562 2
1 517 . 1 1 A 47 47 GLU H H 47 8.380 8.579 -0.199 2
1 518 . 1 1 A 47 47 GLU HA H 47 4.400 4.305 0.095 2
1 521 . 1 1 A 47 47 GLU C C 47 175.970 176.584 -0.614 2
1 522 . 1 1 A 47 47 GLU CA C 47 55.200 57.162 -1.962 2
1 523 . 1 1 A 47 47 GLU CB C 47 32.300 30.190 2.110 2
1 524 . 1 1 A 47 47 GLU N N 47 122.830 122.712 0.118 2
1 525 . 1 1 A 48 48 GLU H H 48 8.400 8.370 0.030 2
1 526 . 1 1 A 48 48 GLU HA H 48 4.280 4.377 -0.097 2
1 531 . 1 1 A 48 48 GLU C C 48 175.750 176.230 -0.480 2
1 532 . 1 1 A 48 48 GLU CA C 48 55.190 57.274 -2.084 2
1 533 . 1 1 A 48 48 GLU CB C 48 31.980 30.796 1.184 2
1 535 . 1 1 A 48 48 GLU N N 48 121.950 121.578 0.372 2
1 536 . 1 1 A 49 49 VAL H H 49 8.240 8.186 0.054 2
1 537 . 1 1 A 49 49 VAL HA H 49 4.170 4.456 -0.286 2
1 542 . 1 1 A 49 49 VAL C C 49 174.610 175.269 -0.659 2
1 543 . 1 1 A 49 49 VAL CA C 49 62.280 61.451 0.829 2
1 544 . 1 1 A 49 49 VAL CB C 49 32.930 34.215 -1.285 2
1 546 . 1 1 A 49 49 VAL N N 49 123.990 120.107 3.883 2
1 547 . 1 1 A 50 50 VAL H H 50 8.230 8.540 -0.310 2
1 548 . 1 1 A 50 50 VAL HA H 50 4.220 4.345 -0.125 2
1 553 . 1 1 A 50 50 VAL C C 50 175.770 175.147 0.624 2
1 554 . 1 1 A 50 50 VAL CA C 50 62.170 62.090 0.080 2
1 555 . 1 1 A 50 50 VAL CB C 50 33.110 33.459 -0.349 2
1 557 . 1 1 A 50 50 VAL N N 50 123.960 122.962 0.998 2
1 558 . 1 1 A 51 51 GLU H H 51 8.570 8.481 0.089 2
1 559 . 1 1 A 51 51 GLU HA H 51 4.380 4.557 -0.177 2
1 564 . 1 1 A 51 51 GLU C C 51 175.920 176.461 -0.541 2
1 565 . 1 1 A 51 51 GLU CA C 51 56.050 56.314 -0.264 2
1 566 . 1 1 A 51 51 GLU CB C 51 31.080 31.227 -0.147 2
1 568 . 1 1 A 51 51 GLU N N 51 125.070 123.655 1.415 2
1 569 . 1 1 A 52 52 ILE H H 52 8.320 8.502 -0.182 2
1 570 . 1 1 A 52 52 ILE HA H 52 4.290 4.151 0.139 2
1 580 . 1 1 A 52 52 ILE C C 52 176.330 176.201 0.129 2
1 581 . 1 1 A 52 52 ILE CA C 52 60.940 62.533 -1.593 2
1 582 . 1 1 A 52 52 ILE CB C 52 38.510 38.721 -0.211 2
1 586 . 1 1 A 52 52 ILE N N 52 122.760 124.326 -1.566 2
1 587 . 1 1 A 53 53 ARG H H 53 8.500 8.277 0.223 2
1 588 . 1 1 A 53 53 ARG HA H 53 4.430 4.222 0.208 2
1 595 . 1 1 A 53 53 ARG C C 53 176.950 177.012 -0.062 2
1 596 . 1 1 A 53 53 ARG CA C 53 56.150 57.319 -1.169 2
1 597 . 1 1 A 53 53 ARG CB C 53 30.200 30.769 -0.569 2
1 600 . 1 1 A 53 53 ARG N N 53 125.250 124.379 0.871 2
1 601 . 1 1 A 54 54 GLY H H 54 8.760 8.358 0.402 2
1 602 . 1 1 A 54 54 GLY HA2 H 54 3.920 4.043 -0.123 2
1 603 . 1 1 A 54 54 GLY HA3 H 54 4.010 4.047 -0.037 2
1 604 . 1 1 A 54 54 GLY C C 54 175.110 174.189 0.921 2
1 605 . 1 1 A 54 54 GLY CA C 54 46.030 45.559 0.471 2
1 606 . 1 1 A 54 54 GLY N N 54 112.510 109.367 3.143 2
1 607 . 1 1 A 55 55 GLY H H 55 8.350 8.304 0.046 2
1 608 . 1 1 A 55 55 GLY HA2 H 55 3.980 4.010 -0.030 2
1 609 . 1 1 A 55 55 GLY HA3 H 55 3.980 4.025 -0.045 2
1 610 . 1 1 A 55 55 GLY C C 55 173.920 174.223 -0.303 2
1 611 . 1 1 A 55 55 GLY CA C 55 45.200 45.867 -0.667 2
1 612 . 1 1 A 55 55 GLY N N 55 107.940 108.423 -0.483 2
1 613 . 1 1 A 56 56 GLN H H 56 8.100 8.401 -0.301 2
1 614 . 1 1 A 56 56 GLN HA H 56 4.420 4.241 0.179 2
1 619 . 1 1 A 56 56 GLN C C 56 175.570 176.486 -0.916 2
1 620 . 1 1 A 56 56 GLN CA C 56 55.420 56.805 -1.385 2
1 621 . 1 1 A 56 56 GLN CB C 56 30.100 29.168 0.932 2
1 623 . 1 1 A 56 56 GLN N N 56 119.350 120.400 -1.050 2
1 624 . 1 1 A 57 57 ARG H H 57 8.520 8.163 0.357 2
1 625 . 1 1 A 57 57 ARG HA H 57 4.400 4.260 0.140 2
1 632 . 1 1 A 57 57 ARG C C 57 176.210 176.634 -0.424 2
1 633 . 1 1 A 57 57 ARG CA C 57 56.440 57.309 -0.869 2
1 634 . 1 1 A 57 57 ARG CB C 57 30.930 30.860 0.070 2
1 637 . 1 1 A 57 57 ARG N N 57 122.610 120.339 2.271 2
1 638 . 1 1 A 58 58 ARG H H 58 8.630 8.195 0.435 2
1 639 . 1 1 A 58 58 ARG HA H 58 4.430 4.438 -0.008 2
1 646 . 1 1 A 58 58 ARG C C 58 175.950 175.979 -0.029 2
1 647 . 1 1 A 58 58 ARG CA C 58 55.450 56.852 -1.401 2
1 648 . 1 1 A 58 58 ARG CB C 58 31.300 31.643 -0.343 2
1 651 . 1 1 A 58 58 ARG N N 58 123.320 120.308 3.012 2
1 652 . 1 1 A 59 59 LYS H H 59 8.560 8.224 0.336 2
1 653 . 1 1 A 59 59 LYS HA H 59 4.410 4.511 -0.101 2
1 662 . 1 1 A 59 59 LYS C C 59 176.590 175.874 0.716 2
1 663 . 1 1 A 59 59 LYS CA C 59 56.720 56.265 0.455 2
1 664 . 1 1 A 59 59 LYS CB C 59 33.150 33.645 -0.495 2
1 668 . 1 1 A 59 59 LYS N N 59 123.380 122.486 0.894 2
1 669 . 1 1 A 60 60 SER H H 60 8.450 8.504 -0.054 2
1 670 . 1 1 A 60 60 SER HA H 60 4.480 4.704 -0.224 2
1 673 . 1 1 A 60 60 SER C C 60 174.280 174.207 0.073 2
1 674 . 1 1 A 60 60 SER CA C 60 58.140 58.309 -0.169 2
1 675 . 1 1 A 60 60 SER CB C 60 64.160 64.399 -0.239 2
1 676 . 1 1 A 60 60 SER N N 60 117.320 118.193 -0.873 2
1 677 . 1 1 A 61 61 GLU H H 61 8.550 8.503 0.047 2
1 678 . 1 1 A 61 61 GLU HA H 61 4.400 4.713 -0.313 2
1 683 . 1 1 A 61 61 GLU C C 61 176.150 175.659 0.491 2
1 684 . 1 1 A 61 61 GLU CA C 61 56.300 56.011 0.289 2
1 685 . 1 1 A 61 61 GLU CB C 61 30.790 31.662 -0.872 2
1 687 . 1 1 A 61 61 GLU N N 61 122.810 122.167 0.643 2
1 688 . 1 1 A 62 62 ARG H H 62 8.310 8.540 -0.230 2
1 689 . 1 1 A 62 62 ARG HA H 62 4.340 4.801 -0.461 2
1 692 . 1 1 A 62 62 ARG C C 62 176.140 175.309 0.831 2
1 693 . 1 1 A 62 62 ARG CA C 62 56.230 54.664 1.566 2
1 694 . 1 1 A 62 62 ARG CB C 62 30.780 32.927 -2.147 2
1 695 . 1 1 A 62 62 ARG N N 62 122.080 121.672 0.408 2
1 696 . 1 1 A 63 63 LYS H H 63 8.470 8.405 0.065 2
1 697 . 1 1 A 63 63 LYS HA H 63 4.300 4.468 -0.168 2
1 700 . 1 1 A 63 63 LYS C C 63 175.490 176.242 -0.752 2
1 701 . 1 1 A 63 63 LYS CA C 63 56.200 56.014 0.186 2
1 702 . 1 1 A 63 63 LYS CB C 63 30.730 33.133 -2.403 2
1 703 . 1 1 A 63 63 LYS N N 63 123.450 121.868 1.582 2
1 704 . 1 1 A 64 64 PHE H H 64 8.200 8.276 -0.076 2
1 705 . 1 1 A 64 64 PHE HA H 64 4.450 4.492 -0.042 2
1 710 . 1 1 A 64 64 PHE C C 64 174.250 175.209 -0.959 2
1 711 . 1 1 A 64 64 PHE CA C 64 57.430 58.156 -0.726 2
1 712 . 1 1 A 64 64 PHE CB C 64 40.330 40.462 -0.132 2
1 715 . 1 1 A 64 64 PHE N N 64 121.740 121.050 0.689 2
1 716 . 1 1 A 65 65 PHE H H 65 8.130 8.010 0.120 2
1 717 . 1 1 A 65 65 PHE HA H 65 4.440 4.840 -0.400 2
1 725 . 1 1 A 65 65 PHE CA C 65 55.650 55.448 0.202 2
1 726 . 1 1 A 65 65 PHE CB C 65 38.900 38.739 0.161 2
1 731 . 1 1 A 65 65 PHE N N 65 120.910 117.279 3.631 2
1 732 . 1 1 A 66 66 PRO C C 66 176.780 177.674 -0.894 2
1 733 . 1 1 A 67 67 GLY H H 67 9.970 8.879 1.091 2
1 734 . 1 1 A 67 67 GLY HA2 H 67 3.820 4.000 -0.180 2
1 735 . 1 1 A 67 67 GLY HA3 H 67 4.400 4.029 0.371 2
1 736 . 1 1 A 67 67 GLY C C 67 173.670 173.679 -0.009 2
1 737 . 1 1 A 67 67 GLY CA C 67 45.900 45.695 0.205 2
1 738 . 1 1 A 67 67 GLY N N 67 111.550 111.945 -0.395 2
1 739 . 1 1 A 68 68 TYR H H 68 7.650 8.116 -0.466 2
1 740 . 1 1 A 68 68 TYR HA H 68 5.000 4.985 0.015 2
1 747 . 1 1 A 68 68 TYR C C 68 175.220 174.843 0.377 2
1 748 . 1 1 A 68 68 TYR CA C 68 57.940 56.871 1.069 2
1 753 . 1 1 A 68 68 TYR N N 68 118.800 119.000 -0.200 2
1 754 . 1 1 A 69 69 VAL H H 69 9.090 8.854 0.236 2
1 755 . 1 1 A 69 69 VAL HA H 69 4.330 4.840 -0.510 2
1 763 . 1 1 A 69 69 VAL C C 69 174.250 174.883 -0.633 2
1 764 . 1 1 A 69 69 VAL CA C 69 62.120 60.335 1.785 2
1 765 . 1 1 A 69 69 VAL CB C 69 35.240 35.844 -0.604 2
1 768 . 1 1 A 69 69 VAL N N 69 119.300 123.258 -3.958 2
1 769 . 1 1 A 70 70 LEU H H 70 9.190 8.834 0.356 2
1 770 . 1 1 A 70 70 LEU HA H 70 5.460 5.442 0.018 2
1 780 . 1 1 A 70 70 LEU C C 70 176.130 176.232 -0.102 2
1 781 . 1 1 A 70 70 LEU CA C 70 54.120 53.406 0.714 2
1 782 . 1 1 A 70 70 LEU CB C 70 43.330 43.568 -0.238 2
1 786 . 1 1 A 70 70 LEU N N 70 126.710 126.784 -0.074 2
1 787 . 1 1 A 71 71 VAL H H 71 9.350 9.328 0.022 2
1 788 . 1 1 A 71 71 VAL HA H 71 5.040 4.854 0.186 2
1 796 . 1 1 A 71 71 VAL C C 71 173.670 174.698 -1.028 2
1 797 . 1 1 A 71 71 VAL CA C 71 61.090 61.313 -0.223 2
1 798 . 1 1 A 71 71 VAL CB C 71 35.800 35.547 0.253 2
1 801 . 1 1 A 71 71 VAL N N 71 121.920 124.445 -2.525 2
1 802 . 1 1 A 72 72 GLN H H 72 8.390 8.771 -0.381 2
1 803 . 1 1 A 72 72 GLN HA H 72 4.610 4.276 0.334 2
1 810 . 1 1 A 72 72 GLN C C 72 175.920 174.544 1.376 2
1 811 . 1 1 A 72 72 GLN CA C 72 53.810 55.262 -1.452 2
1 812 . 1 1 A 72 72 GLN CB C 72 28.850 28.565 0.285 2
1 814 . 1 1 A 72 72 GLN N N 72 130.760 127.744 3.016 2
1 816 . 1 1 A 73 73 MET H H 73 9.750 8.685 1.065 2
1 817 . 1 1 A 73 73 MET HA H 73 5.060 5.191 -0.132 2
1 825 . 1 1 A 73 73 MET C C 73 175.500 174.364 1.136 2
1 826 . 1 1 A 73 73 MET CA C 73 55.520 54.528 0.992 2
1 827 . 1 1 A 73 73 MET CB C 73 35.350 35.578 -0.228 2
1 830 . 1 1 A 73 73 MET N N 73 121.070 124.358 -3.288 2
1 831 . 1 1 A 74 74 VAL H H 74 8.530 8.431 0.099 2
1 832 . 1 1 A 74 74 VAL HA H 74 3.970 4.418 -0.448 2
1 840 . 1 1 A 74 74 VAL C C 74 174.900 175.461 -0.561 2
1 841 . 1 1 A 74 74 VAL CA C 74 62.150 61.687 0.463 2
1 842 . 1 1 A 74 74 VAL CB C 74 32.480 32.722 -0.242 2
1 845 . 1 1 A 74 74 VAL N N 74 124.120 122.467 1.653 2
1 846 . 1 1 A 75 75 MET H H 75 8.600 8.640 -0.040 2
1 847 . 1 1 A 75 75 MET HA H 75 4.360 4.529 -0.170 2
1 855 . 1 1 A 75 75 MET C C 75 173.480 175.577 -2.097 2
1 856 . 1 1 A 75 75 MET CA C 75 53.830 54.643 -0.813 2
1 857 . 1 1 A 75 75 MET CB C 75 29.960 32.653 -2.693 2
1 860 . 1 1 A 75 75 MET N N 75 128.250 126.235 2.015 2
1 861 . 1 1 A 76 76 ASN H H 76 8.410 8.378 0.032 2
1 862 . 1 1 A 76 76 ASN HA H 76 4.540 5.019 -0.479 2
1 867 . 1 1 A 76 76 ASN C C 76 173.950 175.073 -1.123 2
1 868 . 1 1 A 76 76 ASN CA C 76 51.720 51.698 0.022 2
1 869 . 1 1 A 76 76 ASN CB C 76 38.430 40.758 -2.328 2
1 870 . 1 1 A 76 76 ASN N N 76 127.500 123.071 4.429 2
1 872 . 1 1 A 77 77 ASP H H 77 8.470 8.915 -0.445 2
1 873 . 1 1 A 77 77 ASP HA H 77 4.410 4.375 0.035 2
1 876 . 1 1 A 77 77 ASP C C 77 178.530 177.998 0.532 2
1 877 . 1 1 A 77 77 ASP CA C 77 58.730 56.484 2.246 2
1 878 . 1 1 A 77 77 ASP CB C 77 40.940 40.650 0.290 2
1 879 . 1 1 A 77 77 ASP N N 77 117.090 120.046 -2.956 2
1 880 . 1 1 A 78 78 ALA H H 78 8.160 8.009 0.151 2
1 881 . 1 1 A 78 78 ALA HA H 78 4.350 4.251 0.099 2
1 885 . 1 1 A 78 78 ALA C C 78 181.250 179.669 1.580 2
1 886 . 1 1 A 78 78 ALA CA C 78 55.190 54.974 0.217 2
1 887 . 1 1 A 78 78 ALA CB C 78 18.260 19.365 -1.105 2
1 888 . 1 1 A 78 78 ALA N N 78 122.500 123.336 -0.836 2
1 889 . 1 1 A 79 79 SER H H 79 9.320 8.647 0.673 2
1 890 . 1 1 A 79 79 SER HA H 79 4.290 4.303 -0.013 2
1 893 . 1 1 A 79 79 SER C C 79 176.570 176.478 0.092 2
1 894 . 1 1 A 79 79 SER CA C 79 61.080 61.796 -0.716 2
1 895 . 1 1 A 79 79 SER CB C 79 62.200 62.492 -0.292 2
1 896 . 1 1 A 79 79 SER N N 79 119.280 113.117 6.163 2
1 897 . 1 1 A 80 80 TRP H H 80 8.900 7.960 0.940 2
1 898 . 1 1 A 80 80 TRP HA H 80 4.020 4.278 -0.258 2
1 907 . 1 1 A 80 80 TRP C C 80 178.210 178.227 -0.017 2
1 908 . 1 1 A 80 80 TRP CA C 80 62.490 61.370 1.120 2
1 909 . 1 1 A 80 80 TRP CB C 80 29.800 29.583 0.217 2
1 915 . 1 1 A 80 80 TRP N N 80 125.870 123.823 2.047 2
1 917 . 1 1 A 81 81 HIS H H 81 8.190 8.098 0.092 2
1 918 . 1 1 A 81 81 HIS HA H 81 3.930 4.284 -0.354 2
1 923 . 1 1 A 81 81 HIS C C 81 177.740 177.246 0.494 2
1 924 . 1 1 A 81 81 HIS CA C 81 61.020 59.700 1.320 2
1 925 . 1 1 A 81 81 HIS CB C 81 28.910 29.972 -1.062 2
1 927 . 1 1 A 81 81 HIS N N 81 114.080 118.171 -4.091 2
1 928 . 1 1 A 82 82 LEU H H 82 8.080 8.292 -0.212 2
1 929 . 1 1 A 82 82 LEU HA H 82 3.900 3.764 0.136 2
1 939 . 1 1 A 82 82 LEU C C 82 180.330 178.508 1.822 2
1 940 . 1 1 A 82 82 LEU CA C 82 58.590 58.181 0.409 2
1 941 . 1 1 A 82 82 LEU CB C 82 41.350 41.544 -0.194 2
1 945 . 1 1 A 82 82 LEU N N 82 121.320 121.114 0.206 2
1 946 . 1 1 A 83 83 VAL H H 83 8.000 8.293 -0.293 2
1 947 . 1 1 A 83 83 VAL HA H 83 3.210 3.436 -0.226 2
1 955 . 1 1 A 83 83 VAL C C 83 177.060 177.993 -0.933 2
1 956 . 1 1 A 83 83 VAL CA C 83 67.430 66.678 0.752 2
1 957 . 1 1 A 83 83 VAL CB C 83 31.680 31.314 0.366 2
1 960 . 1 1 A 83 83 VAL N N 83 118.850 118.983 -0.133 2
1 961 . 1 1 A 84 84 ARG H H 84 7.540 7.592 -0.052 2
1 962 . 1 1 A 84 84 ARG HA H 84 3.590 3.756 -0.166 2
1 969 . 1 1 A 84 84 ARG C C 84 177.240 178.553 -1.313 2
1 970 . 1 1 A 84 84 ARG CA C 84 56.050 59.578 -3.528 2
1 971 . 1 1 A 84 84 ARG CB C 84 28.190 29.653 -1.463 2
1 974 . 1 1 A 84 84 ARG N N 84 111.460 120.334 -8.874 2
1 975 . 1 1 A 85 85 SER H H 85 7.530 7.695 -0.165 2
1 976 . 1 1 A 85 85 SER HA H 85 4.280 4.122 0.158 2
1 979 . 1 1 A 85 85 SER C C 85 173.930 174.828 -0.898 2
1 980 . 1 1 A 85 85 SER CA C 85 59.220 61.160 -1.940 2
1 981 . 1 1 A 85 85 SER CB C 85 63.830 62.775 1.055 2
1 982 . 1 1 A 85 85 SER N N 85 113.660 114.257 -0.597 2
1 983 . 1 1 A 86 86 VAL H H 86 7.230 7.230 -0.000 2
1 984 . 1 1 A 86 86 VAL HA H 86 3.480 3.930 -0.450 2
1 992 . 1 1 A 86 86 VAL CA C 86 61.300 60.928 0.372 2
1 993 . 1 1 A 86 86 VAL CB C 86 31.780 32.258 -0.478 2
1 996 . 1 1 A 86 86 VAL N N 86 128.120 122.798 5.322 2
1 997 . 1 1 A 87 87 PRO HA H 87 4.140 4.394 -0.254 2
1 1004 . 1 1 A 87 87 PRO C C 87 176.400 176.747 -0.347 2
1 1005 . 1 1 A 87 87 PRO CA C 87 64.100 63.181 0.918 2
1 1006 . 1 1 A 87 87 PRO CB C 87 31.710 32.388 -0.678 2
1 1009 . 1 1 A 88 88 ARG H H 88 8.320 8.776 -0.456 2
1 1010 . 1 1 A 88 88 ARG HA H 88 3.030 4.001 -0.971 2
1 1017 . 1 1 A 88 88 ARG C C 88 174.630 174.788 -0.158 2
1 1018 . 1 1 A 88 88 ARG CA C 88 57.620 57.521 0.099 2
1 1019 . 1 1 A 88 88 ARG CB C 88 26.960 28.021 -1.061 2
1 1022 . 1 1 A 88 88 ARG N N 88 111.360 116.384 -5.024 2
1 1023 . 1 1 A 89 89 VAL H H 89 7.390 7.804 -0.414 2
1 1024 . 1 1 A 89 89 VAL HA H 89 3.910 4.356 -0.446 2
1 1032 . 1 1 A 89 89 VAL C C 89 177.370 175.545 1.825 2
1 1033 . 1 1 A 89 89 VAL CA C 89 64.170 60.529 3.641 2
1 1034 . 1 1 A 89 89 VAL CB C 89 32.070 33.925 -1.855 2
1 1037 . 1 1 A 89 89 VAL N N 89 117.900 118.516 -0.616 2
1 1038 . 1 1 A 90 90 MET H H 90 9.290 8.708 0.582 2
1 1039 . 1 1 A 90 90 MET HA H 90 4.340 4.149 0.191 2
1 1047 . 1 1 A 90 90 MET C C 90 175.800 176.009 -0.209 2
1 1048 . 1 1 A 90 90 MET CA C 90 56.440 56.916 -0.476 2
1 1049 . 1 1 A 90 90 MET CB C 90 34.160 33.236 0.924 2
1 1052 . 1 1 A 90 90 MET N N 90 128.200 126.501 1.699 2
1 1053 . 1 1 A 91 91 GLY H H 91 7.130 6.973 0.157 2
1 1054 . 1 1 A 91 91 GLY HA2 H 91 3.340 3.900 -0.560 2
1 1055 . 1 1 A 91 91 GLY HA3 H 91 4.410 4.023 0.387 2
1 1056 . 1 1 A 91 91 GLY C C 91 170.920 171.515 -0.595 2
1 1057 . 1 1 A 91 91 GLY CA C 91 44.440 45.598 -1.158 2
1 1058 . 1 1 A 91 91 GLY N N 91 104.320 103.798 0.522 2
1 1059 . 1 1 A 92 92 PHE H H 92 8.790 8.496 0.294 2
1 1060 . 1 1 A 92 92 PHE HA H 92 5.270 5.128 0.142 2
1 1068 . 1 1 A 92 92 PHE C C 92 176.230 175.216 1.014 2
1 1069 . 1 1 A 92 92 PHE CA C 92 57.480 57.147 0.333 2
1 1070 . 1 1 A 92 92 PHE CB C 92 42.190 42.492 -0.303 2
1 1075 . 1 1 A 92 92 PHE N N 92 118.770 119.754 -0.984 2
1 1076 . 1 1 A 93 93 ILE H H 93 8.800 8.486 0.314 2
1 1077 . 1 1 A 93 93 ILE HA H 93 4.310 5.036 -0.726 2
1 1087 . 1 1 A 93 93 ILE C C 93 176.380 175.891 0.489 2
1 1088 . 1 1 A 93 93 ILE CA C 93 60.480 59.882 0.598 2
1 1089 . 1 1 A 93 93 ILE CB C 93 38.010 40.574 -2.564 2
1 1093 . 1 1 A 93 93 ILE N N 93 122.300 121.415 0.885 2
1 1094 . 1 1 A 94 94 GLY H H 94 8.640 8.446 0.194 2
1 1095 . 1 1 A 94 94 GLY HA2 H 94 3.830 4.266 -0.435 2
1 1096 . 1 1 A 94 94 GLY HA3 H 94 4.600 4.278 0.322 2
1 1097 . 1 1 A 94 94 GLY C C 94 175.080 174.533 0.547 2
1 1098 . 1 1 A 94 94 GLY CA C 94 44.530 45.868 -1.338 2
1 1099 . 1 1 A 94 94 GLY N N 94 116.550 113.390 3.160 2
1 1100 . 1 1 A 95 95 GLY H H 95 8.900 8.777 0.123 2
1 1101 . 1 1 A 95 95 GLY HA2 H 95 3.970 3.872 0.098 2
1 1102 . 1 1 A 95 95 GLY HA3 H 95 4.370 3.879 0.491 2
1 1103 . 1 1 A 95 95 GLY C C 95 174.560 174.100 0.460 2
1 1104 . 1 1 A 95 95 GLY CA C 95 45.640 47.111 -1.471 2
1 1105 . 1 1 A 95 95 GLY N N 95 112.960 110.773 2.187 2
1 1106 . 1 1 A 96 96 THR H H 96 7.830 7.786 0.044 2
1 1107 . 1 1 A 96 96 THR HA H 96 4.720 4.812 -0.092 2
1 1112 . 1 1 A 96 96 THR C C 96 176.260 174.111 2.149 2
1 1113 . 1 1 A 96 96 THR CA C 96 60.360 59.942 0.418 2
1 1114 . 1 1 A 96 96 THR CB C 96 70.960 71.715 -0.755 2
1 1116 . 1 1 A 96 96 THR N N 96 113.350 111.731 1.619 2
1 1117 . 1 1 A 97 97 SER H H 97 8.850 8.828 0.022 2
1 1118 . 1 1 A 97 97 SER HA H 97 4.310 4.689 -0.379 2
1 1121 . 1 1 A 97 97 SER C C 97 175.570 174.467 1.103 2
1 1122 . 1 1 A 97 97 SER CA C 97 60.850 58.830 2.020 2
1 1123 . 1 1 A 97 97 SER CB C 97 63.000 63.454 -0.454 2
1 1124 . 1 1 A 97 97 SER N N 97 116.420 116.983 -0.563 2
1 1125 . 1 1 A 98 98 ASP H H 98 8.360 8.085 0.275 2
1 1126 . 1 1 A 98 98 ASP HA H 98 4.310 5.120 -0.810 2
1 1129 . 1 1 A 98 98 ASP C C 98 175.380 175.652 -0.272 2
1 1130 . 1 1 A 98 98 ASP CA C 98 54.190 54.671 -0.481 2
1 1131 . 1 1 A 98 98 ASP CB C 98 40.740 43.000 -2.260 2
1 1132 . 1 1 A 98 98 ASP N N 98 116.320 119.261 -2.941 2
1 1133 . 1 1 A 99 99 ARG H H 99 7.450 7.701 -0.251 2
1 1134 . 1 1 A 99 99 ARG HA H 99 4.350 4.613 -0.263 2
1 1141 . 1 1 A 99 99 ARG CA C 99 52.920 53.273 -0.353 2
1 1142 . 1 1 A 99 99 ARG CB C 99 30.340 31.305 -0.966 2
1 1145 . 1 1 A 99 99 ARG N N 99 119.960 118.690 1.270 2
1 1146 . 1 1 A 100 100 PRO HA H 100 4.750 4.575 0.175 2
1 1153 . 1 1 A 100 100 PRO C C 100 175.220 177.025 -1.805 2
1 1154 . 1 1 A 100 100 PRO CA C 100 62.680 62.660 0.020 2
1 1155 . 1 1 A 100 100 PRO CB C 100 32.820 31.736 1.084 2
1 1158 . 1 1 A 101 101 ALA H H 101 7.210 8.339 -1.129 2
1 1159 . 1 1 A 101 101 ALA HA H 101 5.030 4.558 0.472 2
1 1163 . 1 1 A 101 101 ALA CA C 101 48.570 50.401 -1.831 2
1 1164 . 1 1 A 101 101 ALA CB C 101 19.660 17.619 2.041 2
1 1165 . 1 1 A 101 101 ALA N N 101 124.490 125.051 -0.561 2
1 1166 . 1 1 A 102 102 PRO HA H 102 4.440 4.487 -0.047 2
1 1173 . 1 1 A 102 102 PRO C C 102 177.200 176.477 0.723 2
1 1174 . 1 1 A 102 102 PRO CA C 102 62.190 62.718 -0.528 2
1 1175 . 1 1 A 102 102 PRO CB C 102 32.310 32.717 -0.407 2
1 1178 . 1 1 A 103 103 ILE H H 103 8.550 8.035 0.515 2
1 1179 . 1 1 A 103 103 ILE HA H 103 4.630 4.896 -0.266 2
1 1189 . 1 1 A 103 103 ILE C C 103 175.460 175.262 0.198 2
1 1190 . 1 1 A 103 103 ILE CA C 103 59.730 58.522 1.208 2
1 1191 . 1 1 A 103 103 ILE CB C 103 40.140 41.970 -1.830 2
1 1195 . 1 1 A 103 103 ILE N N 103 115.670 116.389 -0.719 2
1 1196 . 1 1 A 104 104 SER H H 104 8.730 8.672 0.058 2
1 1197 . 1 1 A 104 104 SER HA H 104 4.500 4.549 -0.049 2
1 1200 . 1 1 A 104 104 SER C C 104 174.840 175.316 -0.477 2
1 1201 . 1 1 A 104 104 SER CA C 104 58.010 58.500 -0.490 2
1 1202 . 1 1 A 104 104 SER CB C 104 65.470 63.917 1.553 2
1 1203 . 1 1 A 104 104 SER N N 104 119.170 119.753 -0.583 2
1 1204 . 1 1 A 105 105 ASP H H 105 8.830 9.027 -0.197 2
1 1205 . 1 1 A 105 105 ASP HA H 105 4.200 4.259 -0.059 2
1 1208 . 1 1 A 105 105 ASP C C 105 178.520 178.332 0.188 2
1 1209 . 1 1 A 105 105 ASP CA C 105 57.870 57.912 -0.042 2
1 1210 . 1 1 A 105 105 ASP CB C 105 40.040 40.348 -0.308 2
1 1211 . 1 1 A 105 105 ASP N N 105 121.640 124.854 -3.214 2
1 1212 . 1 1 A 106 106 LYS H H 106 8.130 8.020 0.110 2
1 1213 . 1 1 A 106 106 LYS HA H 106 4.100 3.903 0.197 2
1 1222 . 1 1 A 106 106 LYS C C 106 179.400 178.692 0.708 2
1 1223 . 1 1 A 106 106 LYS CA C 106 58.980 59.547 -0.567 2
1 1224 . 1 1 A 106 106 LYS CB C 106 32.330 32.140 0.190 2
1 1228 . 1 1 A 106 106 LYS N N 106 118.300 120.829 -2.529 2
1 1229 . 1 1 A 107 107 GLU H H 107 7.670 7.950 -0.280 2
1 1230 . 1 1 A 107 107 GLU HA H 107 4.020 4.041 -0.021 2
1 1235 . 1 1 A 107 107 GLU C C 107 178.750 179.343 -0.593 2
1 1236 . 1 1 A 107 107 GLU CA C 107 59.210 59.168 0.042 2
1 1237 . 1 1 A 107 107 GLU CB C 107 29.780 29.495 0.285 2
1 1239 . 1 1 A 107 107 GLU N N 107 121.270 119.082 2.188 2
1 1240 . 1 1 A 108 108 VAL H H 108 7.790 7.699 0.091 2
1 1241 . 1 1 A 108 108 VAL HA H 108 3.050 3.426 -0.377 2
1 1249 . 1 1 A 108 108 VAL C C 108 177.550 177.400 0.150 2
1 1250 . 1 1 A 108 108 VAL CA C 108 67.080 66.304 0.776 2
1 1251 . 1 1 A 108 108 VAL CB C 108 31.220 30.973 0.247 2
1 1254 . 1 1 A 108 108 VAL N N 108 120.940 120.547 0.393 2
1 1255 . 1 1 A 109 109 ASP H H 109 7.840 7.859 -0.019 2
1 1256 . 1 1 A 109 109 ASP HA H 109 4.110 4.238 -0.128 2
1 1259 . 1 1 A 109 109 ASP C C 109 178.190 178.543 -0.353 2
1 1260 . 1 1 A 109 109 ASP CA C 109 57.470 57.114 0.356 2
1 1261 . 1 1 A 109 109 ASP CB C 109 40.480 40.011 0.469 2
1 1262 . 1 1 A 109 109 ASP N N 109 118.780 120.631 -1.851 2
1 1263 . 1 1 A 110 110 ALA H H 110 7.520 7.753 -0.233 2
1 1264 . 1 1 A 110 110 ALA HA H 110 4.110 4.146 -0.036 2
1 1268 . 1 1 A 110 110 ALA C C 110 180.550 179.799 0.751 2
1 1269 . 1 1 A 110 110 ALA CA C 110 54.880 55.082 -0.202 2
1 1270 . 1 1 A 110 110 ALA CB C 110 18.440 18.273 0.167 2
1 1271 . 1 1 A 110 110 ALA N N 110 120.640 122.551 -1.911 2
1 1272 . 1 1 A 111 111 ILE H H 111 7.840 7.812 0.028 2
1 1273 . 1 1 A 111 111 ILE HA H 111 3.580 3.594 -0.014 2
1 1281 . 1 1 A 111 111 ILE C C 111 177.470 178.026 -0.556 2
1 1282 . 1 1 A 111 111 ILE CA C 111 64.620 64.979 -0.359 2
1 1283 . 1 1 A 111 111 ILE CB C 111 38.600 37.715 0.885 2
1 1286 . 1 1 A 111 111 ILE N N 111 119.840 118.827 1.013 2
1 1287 . 1 1 A 112 112 MET H H 112 8.100 7.879 0.221 2
1 1288 . 1 1 A 112 112 MET HA H 112 4.400 4.194 0.206 2
1 1296 . 1 1 A 112 112 MET C C 112 177.710 178.654 -0.944 2
1 1297 . 1 1 A 112 112 MET CA C 112 55.300 58.731 -3.431 2
1 1298 . 1 1 A 112 112 MET CB C 112 30.510 32.517 -2.007 2
1 1301 . 1 1 A 112 112 MET N N 112 115.180 118.779 -3.600 2
1 1302 . 1 1 A 113 113 ASN H H 113 8.070 8.153 -0.083 2
1 1303 . 1 1 A 113 113 ASN HA H 113 4.570 4.431 0.139 2
1 1308 . 1 1 A 113 113 ASN C C 113 175.530 178.197 -2.667 2
1 1309 . 1 1 A 113 113 ASN CA C 113 54.420 56.346 -1.926 2
1 1310 . 1 1 A 113 113 ASN CB C 113 38.350 38.230 0.120 2
1 1311 . 1 1 A 113 113 ASN N N 113 117.190 117.638 -0.448 2
1 1313 . 1 1 A 114 114 ARG H H 114 8.070 7.834 0.236 2
1 1314 . 1 1 A 114 114 ARG HA H 114 4.280 3.960 0.320 2
1 1321 . 1 1 A 114 114 ARG C C 114 176.620 178.561 -1.941 2
1 1322 . 1 1 A 114 114 ARG CA C 114 56.910 59.075 -2.165 2
1 1323 . 1 1 A 114 114 ARG CB C 114 30.370 29.888 0.482 2
1 1326 . 1 1 A 114 114 ARG N N 114 118.360 119.714 -1.354 2
1 1327 . 1 1 A 115 115 LEU H H 115 8.100 7.925 0.175 2
1 1328 . 1 1 A 115 115 LEU HA H 115 4.310 3.868 0.442 2
1 1338 . 1 1 A 115 115 LEU C C 115 177.440 178.551 -1.111 2
1 1339 . 1 1 A 115 115 LEU CA C 115 55.440 57.877 -2.438 2
1 1340 . 1 1 A 115 115 LEU CB C 115 42.250 41.642 0.608 2
1 1344 . 1 1 A 115 115 LEU N N 115 120.580 121.070 -0.490 2
1 1345 . 1 1 A 116 116 GLN H H 116 8.180 7.612 0.568 2
1 1346 . 1 1 A 116 116 GLN HA H 116 4.360 4.069 0.291 2
1 1353 . 1 1 A 116 116 GLN C C 116 175.890 176.789 -0.899 2
1 1354 . 1 1 A 116 116 GLN CA C 116 55.810 58.591 -2.781 2
1 1355 . 1 1 A 116 116 GLN CB C 116 29.500 28.458 1.042 2
1 1357 . 1 1 A 116 116 GLN N N 116 119.770 117.578 2.192 2
1 1358 . 1 1 A 117 117 GLN H H 117 8.350 7.915 0.435 2
1 1359 . 1 1 A 117 117 GLN HA H 117 4.380 4.311 0.069 2
1 1366 . 1 1 A 117 117 GLN C C 117 176.130 175.685 0.445 2
1 1367 . 1 1 A 117 117 GLN CA C 117 55.810 56.241 -0.431 2
1 1368 . 1 1 A 117 117 GLN CB C 117 29.500 29.622 -0.123 2
1 1370 . 1 1 A 117 117 GLN N N 117 121.440 119.722 1.718 2
1 1371 . 1 1 A 118 118 VAL H H 118 8.240 8.592 -0.352 2
1 1372 . 1 1 A 118 118 VAL HA H 118 4.120 4.249 -0.129 2
1 1380 . 1 1 A 118 118 VAL C C 118 176.650 176.588 0.062 2
1 1381 . 1 1 A 118 118 VAL CA C 118 62.720 61.925 0.795 2
1 1382 . 1 1 A 118 118 VAL CB C 118 32.730 33.642 -0.912 2
1 1385 . 1 1 A 118 118 VAL N N 118 121.250 124.377 -3.127 2
1 1386 . 1 1 A 119 119 GLY H H 119 8.460 8.453 0.007 2
1 1387 . 1 1 A 119 119 GLY HA2 H 119 3.990 3.901 0.089 2
1 1388 . 1 1 A 119 119 GLY HA3 H 119 3.990 3.928 0.062 2
1 1389 . 1 1 A 119 119 GLY C C 119 173.770 174.449 -0.679 2
1 1390 . 1 1 A 119 119 GLY CA C 119 45.260 46.631 -1.371 2
1 1391 . 1 1 A 119 119 GLY N N 119 112.300 111.829 0.471 2
1 1392 . 1 1 A 120 120 ASP H H 120 8.230 8.140 0.090 2
1 1393 . 1 1 A 120 120 ASP HA H 120 4.580 4.665 -0.085 2
1 1396 . 1 1 A 120 120 ASP C C 120 175.180 175.943 -0.763 2
1 1397 . 1 1 A 120 120 ASP CA C 120 54.340 54.978 -0.638 2
1 1398 . 1 1 A 120 120 ASP CB C 120 41.390 41.744 -0.354 2
1 1399 . 1 1 A 120 120 ASP N N 120 120.420 120.897 -0.477 2
1 1400 . 1 1 A 121 121 LYS H H 121 7.950 8.205 -0.255 2
1 1401 . 1 1 A 121 121 LYS HA H 121 4.240 4.630 -0.390 2
1 1402 . 1 1 A 121 121 LYS CA C 121 53.620 54.458 -0.838 2
1 1403 . 1 1 A 121 121 LYS N N 121 119.110 120.859 -1.749 2
1 1404 . 1 1 A 122 122 PRO HA H 122 4.410 4.555 -0.145 2
1 1405 . 1 1 A 122 122 PRO C C 122 176.560 176.581 -0.021 2
1 1406 . 1 1 A 122 122 PRO CA C 122 63.130 63.620 -0.490 2
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