data_15465_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15465
_Entry.PDB_ID 2JV2
_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 22
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 9 9 GLY H H 9 8.390 8.742 -0.352 1
1 2 . 1 1 1 A 9 9 GLY HA2 H 9 3.900 4.157 -0.257 1
1 3 . 1 1 1 A 9 9 GLY HA3 H 9 3.860 4.158 -0.298 1
1 4 . 1 1 1 A 9 9 GLY CA C 9 45.150 44.647 0.503 1
1 5 . 1 1 1 A 9 9 GLY N N 9 110.000 113.124 -3.124 1
1 6 . 1 1 1 A 10 10 VAL H H 10 7.870 8.770 -0.900 1
1 7 . 1 1 1 A 10 10 VAL HA H 10 4.040 4.434 -0.394 1
1 15 . 1 1 1 A 10 10 VAL C C 10 175.880 175.323 0.557 1
1 16 . 1 1 1 A 10 10 VAL CA C 10 62.110 62.109 0.001 1
1 17 . 1 1 1 A 10 10 VAL CB C 10 32.760 32.659 0.101 1
1 20 . 1 1 1 A 10 10 VAL N N 10 119.730 120.453 -0.723 1
1 21 . 1 1 1 A 11 11 ILE H H 11 8.230 8.969 -0.739 1
1 22 . 1 1 1 A 11 11 ILE HA H 11 4.090 4.875 -0.785 1
1 32 . 1 1 1 A 11 11 ILE C C 11 175.850 175.151 0.699 1
1 33 . 1 1 1 A 11 11 ILE CA C 11 60.800 60.302 0.498 1
1 34 . 1 1 1 A 11 11 ILE CB C 11 38.470 39.742 -1.272 1
1 38 . 1 1 1 A 11 11 ILE N N 11 125.570 127.554 -1.984 1
1 39 . 1 1 1 A 12 12 MET H H 12 8.370 8.940 -0.570 1
1 40 . 1 1 1 A 12 12 MET HA H 12 4.540 5.332 -0.792 1
1 48 . 1 1 1 A 12 12 MET C C 12 174.830 174.916 -0.086 1
1 49 . 1 1 1 A 12 12 MET CA C 12 54.790 53.669 1.121 1
1 50 . 1 1 1 A 12 12 MET CB C 12 32.640 35.745 -3.105 1
1 53 . 1 1 1 A 12 12 MET N N 12 125.930 124.695 1.235 1
1 54 . 1 1 1 A 13 13 SER H H 13 7.990 8.952 -0.962 1
1 55 . 1 1 1 A 13 13 SER HA H 13 5.030 5.355 -0.325 1
1 58 . 1 1 1 A 13 13 SER C C 13 174.330 173.434 0.896 1
1 59 . 1 1 1 A 13 13 SER CA C 13 57.320 56.043 1.277 1
1 60 . 1 1 1 A 13 13 SER CB C 13 64.790 65.862 -1.072 1
1 61 . 1 1 1 A 13 13 SER N N 13 116.400 117.955 -1.555 1
1 62 . 1 1 1 A 14 14 GLU H H 14 9.430 8.732 0.698 1
1 63 . 1 1 1 A 14 14 GLU HA H 14 5.250 5.106 0.144 1
1 68 . 1 1 1 A 14 14 GLU C C 14 172.980 173.996 -1.016 1
1 69 . 1 1 1 A 14 14 GLU CA C 14 55.390 55.403 -0.013 1
1 70 . 1 1 1 A 14 14 GLU CB C 14 33.910 34.270 -0.360 1
1 72 . 1 1 1 A 14 14 GLU N N 14 123.670 121.658 2.012 1
1 73 . 1 1 1 A 15 15 LEU H H 15 8.930 8.901 0.029 1
1 74 . 1 1 1 A 15 15 LEU HA H 15 4.870 5.203 -0.333 1
1 84 . 1 1 1 A 15 15 LEU C C 15 174.000 174.560 -0.560 1
1 85 . 1 1 1 A 15 15 LEU CA C 15 53.020 53.782 -0.762 1
1 86 . 1 1 1 A 15 15 LEU CB C 15 46.040 46.044 -0.004 1
1 90 . 1 1 1 A 15 15 LEU N N 15 125.350 125.761 -0.411 1
1 91 . 1 1 1 A 16 16 LYS H H 16 8.840 8.800 0.040 1
1 92 . 1 1 1 A 16 16 LYS HA H 16 5.360 5.004 0.356 1
1 101 . 1 1 1 A 16 16 LYS C C 16 175.660 175.816 -0.156 1
1 102 . 1 1 1 A 16 16 LYS CA C 16 54.940 55.270 -0.330 1
1 103 . 1 1 1 A 16 16 LYS CB C 16 34.280 34.374 -0.094 1
1 107 . 1 1 1 A 16 16 LYS N N 16 124.640 126.854 -2.214 1
1 108 . 1 1 1 A 17 17 LEU H H 17 8.820 9.044 -0.224 1
1 109 . 1 1 1 A 17 17 LEU HA H 17 5.430 5.219 0.211 1
1 119 . 1 1 1 A 17 17 LEU C C 17 174.630 175.750 -1.120 1
1 120 . 1 1 1 A 17 17 LEU CA C 17 52.900 53.628 -0.728 1
1 121 . 1 1 1 A 17 17 LEU CB C 17 46.910 45.773 1.137 1
1 125 . 1 1 1 A 17 17 LEU N N 17 123.460 126.253 -2.793 1
1 126 . 1 1 1 A 18 18 LYS H H 18 9.110 8.711 0.399 1
1 127 . 1 1 1 A 18 18 LYS HA H 18 5.490 4.962 0.528 1
1 136 . 1 1 1 A 18 18 LYS CA C 18 52.270 52.844 -0.574 1
1 137 . 1 1 1 A 18 18 LYS CB C 18 37.500 36.261 1.239 1
1 141 . 1 1 1 A 18 18 LYS N N 18 122.230 123.425 -1.195 1
1 142 . 1 1 1 A 19 19 PRO HA H 19 4.100 4.371 -0.271 1
1 149 . 1 1 1 A 19 19 PRO CA C 19 62.440 62.782 -0.342 1
1 150 . 1 1 1 A 19 19 PRO CB C 19 30.640 32.090 -1.450 1
1 153 . 1 1 1 A 20 20 LEU H H 20 8.490 8.370 0.120 1
1 154 . 1 1 1 A 20 20 LEU HA H 20 4.320 4.208 0.112 1
1 164 . 1 1 1 A 20 20 LEU CA C 20 57.680 58.592 -0.912 1
1 165 . 1 1 1 A 20 20 LEU CB C 20 38.760 40.875 -2.115 1
1 169 . 1 1 1 A 20 20 LEU N N 20 123.250 119.634 3.616 1
1 170 . 1 1 1 A 21 21 PRO HA H 21 4.530 4.521 0.009 1
1 177 . 1 1 1 A 21 21 PRO CA C 21 62.880 62.376 0.504 1
1 178 . 1 1 1 A 21 21 PRO CB C 21 31.420 32.216 -0.796 1
1 181 . 1 1 1 A 22 22 LYS H H 22 8.180 8.359 -0.179 1
1 182 . 1 1 1 A 22 22 LYS HA H 22 4.110 4.373 -0.263 1
1 191 . 1 1 1 A 22 22 LYS C C 22 175.680 175.440 0.240 1
1 192 . 1 1 1 A 22 22 LYS CA C 22 56.210 55.739 0.471 1
1 193 . 1 1 1 A 22 22 LYS CB C 22 30.660 31.746 -1.086 1
1 197 . 1 1 1 A 22 22 LYS N N 22 119.160 121.886 -2.726 1
1 198 . 1 1 1 A 23 23 VAL H H 23 7.530 7.984 -0.454 1
1 199 . 1 1 1 A 23 23 VAL HA H 23 4.280 4.762 -0.482 1
1 207 . 1 1 1 A 23 23 VAL C C 23 173.690 173.240 0.450 1
1 208 . 1 1 1 A 23 23 VAL CA C 23 59.830 59.624 0.206 1
1 209 . 1 1 1 A 23 23 VAL CB C 23 34.550 35.490 -0.940 1
1 212 . 1 1 1 A 23 23 VAL N N 23 121.820 123.021 -1.201 1
1 213 . 1 1 1 A 24 24 GLU H H 24 8.270 8.989 -0.719 1
1 214 . 1 1 1 A 24 24 GLU HA H 24 4.330 4.989 -0.659 1
1 219 . 1 1 1 A 24 24 GLU C C 24 175.390 175.286 0.104 1
1 220 . 1 1 1 A 24 24 GLU CA C 24 55.220 54.825 0.395 1
1 221 . 1 1 1 A 24 24 GLU CB C 24 29.970 32.392 -2.422 1
1 223 . 1 1 1 A 24 24 GLU N N 24 125.610 127.043 -1.433 1
1 224 . 1 1 1 A 25 25 LEU H H 25 8.480 8.775 -0.295 1
1 225 . 1 1 1 A 25 25 LEU HA H 25 4.520 4.383 0.137 1
1 235 . 1 1 1 A 25 25 LEU CA C 25 51.660 51.944 -0.284 1
1 236 . 1 1 1 A 25 25 LEU CB C 25 41.750 40.919 0.831 1
1 240 . 1 1 1 A 25 25 LEU N N 25 125.880 126.453 -0.573 1
1 241 . 1 1 1 A 26 26 PRO HA H 26 4.760 4.610 0.150 1
1 248 . 1 1 1 A 26 26 PRO CA C 26 61.330 61.893 -0.563 1
1 249 . 1 1 1 A 26 26 PRO CB C 26 31.060 32.855 -1.795 1
1 252 . 1 1 1 A 27 27 PRO HA H 27 4.390 4.422 -0.032 1
1 259 . 1 1 1 A 27 27 PRO CA C 27 64.550 64.849 -0.299 1
1 260 . 1 1 1 A 27 27 PRO CB C 27 31.770 31.744 0.026 1
1 263 . 1 1 1 A 28 28 ASP H H 28 8.560 8.789 -0.229 1
1 264 . 1 1 1 A 28 28 ASP HA H 28 4.620 4.437 0.183 1
1 267 . 1 1 1 A 28 28 ASP C C 28 177.100 178.695 -1.595 1
1 268 . 1 1 1 A 28 28 ASP CA C 28 53.890 56.264 -2.374 1
1 269 . 1 1 1 A 28 28 ASP CB C 28 39.120 39.602 -0.482 1
1 270 . 1 1 1 A 28 28 ASP N N 28 115.820 117.841 -2.021 1
1 271 . 1 1 1 A 29 29 PHE H H 29 7.940 7.919 0.021 1
1 272 . 1 1 1 A 29 29 PHE HA H 29 4.180 4.348 -0.168 1
1 280 . 1 1 1 A 29 29 PHE C C 29 176.740 178.233 -1.493 1
1 281 . 1 1 1 A 29 29 PHE CA C 29 61.020 61.034 -0.014 1
1 282 . 1 1 1 A 29 29 PHE CB C 29 39.230 38.797 0.433 1
1 288 . 1 1 1 A 29 29 PHE N N 29 119.610 118.366 1.244 1
1 289 . 1 1 1 A 30 30 VAL H H 30 8.010 8.484 -0.474 1
1 290 . 1 1 1 A 30 30 VAL HA H 30 3.350 3.777 -0.427 1
1 298 . 1 1 1 A 30 30 VAL C C 30 176.400 177.150 -0.750 1
1 299 . 1 1 1 A 30 30 VAL CA C 30 66.510 64.832 1.678 1
1 300 . 1 1 1 A 30 30 VAL CB C 30 31.020 31.052 -0.032 1
1 303 . 1 1 1 A 30 30 VAL N N 30 116.370 119.575 -3.205 1
1 304 . 1 1 1 A 31 31 ASP H H 31 7.420 7.979 -0.559 1
1 305 . 1 1 1 A 31 31 ASP HA H 31 4.310 4.369 -0.059 1
1 308 . 1 1 1 A 31 31 ASP C C 31 178.360 178.883 -0.523 1
1 309 . 1 1 1 A 31 31 ASP CA C 31 57.110 57.094 0.016 1
1 310 . 1 1 1 A 31 31 ASP CB C 31 40.450 40.886 -0.436 1
1 311 . 1 1 1 A 31 31 ASP N N 31 119.190 121.605 -2.415 1
1 312 . 1 1 1 A 32 32 VAL H H 32 7.190 7.363 -0.173 1
1 313 . 1 1 1 A 32 32 VAL HA H 32 3.510 3.547 -0.037 1
1 321 . 1 1 1 A 32 32 VAL C C 32 178.100 178.536 -0.436 1
1 322 . 1 1 1 A 32 32 VAL CA C 32 65.570 66.367 -0.797 1
1 323 . 1 1 1 A 32 32 VAL CB C 32 31.410 31.279 0.131 1
1 326 . 1 1 1 A 32 32 VAL N N 32 119.830 120.060 -0.230 1
1 327 . 1 1 1 A 33 33 ILE H H 33 7.660 8.453 -0.793 1
1 328 . 1 1 1 A 33 33 ILE HA H 33 3.170 3.506 -0.336 1
1 338 . 1 1 1 A 33 33 ILE C C 33 176.660 178.056 -1.396 1
1 339 . 1 1 1 A 33 33 ILE CA C 33 65.220 65.190 0.030 1
1 340 . 1 1 1 A 33 33 ILE CB C 33 37.500 37.763 -0.263 1
1 344 . 1 1 1 A 33 33 ILE N N 33 118.490 120.875 -2.385 1
1 345 . 1 1 1 A 34 34 ARG H H 34 7.830 7.719 0.111 1
1 346 . 1 1 1 A 34 34 ARG HA H 34 3.380 3.898 -0.518 1
1 354 . 1 1 1 A 34 34 ARG C C 34 178.060 177.758 0.302 1
1 355 . 1 1 1 A 34 34 ARG CA C 34 60.570 58.965 1.605 1
1 356 . 1 1 1 A 34 34 ARG CB C 34 30.070 29.806 0.264 1
1 359 . 1 1 1 A 34 34 ARG N N 34 118.260 119.982 -1.722 1
1 361 . 1 1 1 A 35 35 ILE H H 35 7.350 7.809 -0.459 1
1 362 . 1 1 1 A 35 35 ILE HA H 35 3.720 3.713 0.007 1
1 372 . 1 1 1 A 35 35 ILE C C 35 179.090 177.979 1.111 1
1 373 . 1 1 1 A 35 35 ILE CA C 35 64.060 65.380 -1.320 1
1 374 . 1 1 1 A 35 35 ILE CB C 35 38.030 37.637 0.393 1
1 378 . 1 1 1 A 35 35 ILE N N 35 116.750 119.393 -2.643 1
1 379 . 1 1 1 A 36 36 LYS H H 36 7.880 7.647 0.233 1
1 380 . 1 1 1 A 36 36 LYS HA H 36 4.090 3.950 0.140 1
1 389 . 1 1 1 A 36 36 LYS C C 36 178.560 178.899 -0.339 1
1 390 . 1 1 1 A 36 36 LYS CA C 36 57.650 59.774 -2.124 1
1 391 . 1 1 1 A 36 36 LYS CB C 36 32.090 32.180 -0.090 1
1 395 . 1 1 1 A 36 36 LYS N N 36 118.700 119.714 -1.014 1
1 396 . 1 1 1 A 37 37 LEU H H 37 7.860 7.426 0.434 1
1 397 . 1 1 1 A 37 37 LEU HA H 37 4.230 4.279 -0.049 1
1 407 . 1 1 1 A 37 37 LEU C C 37 175.880 176.778 -0.898 1
1 408 . 1 1 1 A 37 37 LEU CA C 37 54.090 55.750 -1.660 1
1 409 . 1 1 1 A 37 37 LEU CB C 37 43.310 42.526 0.784 1
1 413 . 1 1 1 A 37 37 LEU N N 37 116.380 117.328 -0.948 1
1 414 . 1 1 1 A 38 38 GLN H H 38 7.190 7.566 -0.376 1
1 415 . 1 1 1 A 38 38 GLN HA H 38 3.530 4.521 -0.991 1
1 422 . 1 1 1 A 38 38 GLN C C 38 177.480 176.261 1.219 1
1 423 . 1 1 1 A 38 38 GLN CA C 38 58.370 56.725 1.645 1
1 424 . 1 1 1 A 38 38 GLN CB C 38 28.300 28.795 -0.495 1
1 426 . 1 1 1 A 38 38 GLN N N 38 119.210 117.643 1.567 1
1 428 . 1 1 1 A 39 39 GLY H H 39 8.940 8.886 0.054 1
1 429 . 1 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 1 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 1 1 1 A 39 39 GLY C C 39 174.070 174.427 -0.357 1
1 432 . 1 1 1 A 39 39 GLY CA C 39 45.280 45.042 0.238 1
1 433 . 1 1 1 A 39 39 GLY N N 39 113.490 112.147 1.343 1
1 434 . 1 1 1 A 40 40 LYS H H 40 8.350 7.591 0.759 1
1 435 . 1 1 1 A 40 40 LYS HA H 40 4.400 4.595 -0.195 1
1 444 . 1 1 1 A 40 40 LYS C C 40 175.560 175.736 -0.176 1
1 445 . 1 1 1 A 40 40 LYS CA C 40 55.660 54.657 1.003 1
1 446 . 1 1 1 A 40 40 LYS CB C 40 32.870 33.744 -0.874 1
1 450 . 1 1 1 A 40 40 LYS N N 40 122.060 119.980 2.080 1
1 451 . 1 1 1 A 41 41 THR H H 41 8.410 8.582 -0.172 1
1 452 . 1 1 1 A 41 41 THR HA H 41 5.330 5.042 0.288 1
1 457 . 1 1 1 A 41 41 THR C C 41 174.860 174.458 0.402 1
1 458 . 1 1 1 A 41 41 THR CA C 41 62.040 61.661 0.379 1
1 459 . 1 1 1 A 41 41 THR CB C 41 69.420 70.895 -1.475 1
1 461 . 1 1 1 A 41 41 THR N N 41 118.150 117.210 0.940 1
1 462 . 1 1 1 A 42 42 VAL H H 42 9.140 9.070 0.070 1
1 463 . 1 1 1 A 42 42 VAL HA H 42 4.570 5.045 -0.475 1
1 471 . 1 1 1 A 42 42 VAL C C 42 172.970 174.252 -1.282 1
1 472 . 1 1 1 A 42 42 VAL CA C 42 59.450 59.105 0.345 1
1 473 . 1 1 1 A 42 42 VAL CB C 42 35.880 35.504 0.376 1
1 476 . 1 1 1 A 42 42 VAL N N 42 122.510 120.215 2.295 1
1 477 . 1 1 1 A 43 43 ARG H H 43 8.420 8.697 -0.277 1
1 478 . 1 1 1 A 43 43 ARG HA H 43 4.750 4.879 -0.129 1
1 485 . 1 1 1 A 43 43 ARG C C 43 175.650 175.851 -0.201 1
1 486 . 1 1 1 A 43 43 ARG CA C 43 53.650 53.881 -0.231 1
1 487 . 1 1 1 A 43 43 ARG CB C 43 33.870 33.931 -0.061 1
1 490 . 1 1 1 A 43 43 ARG N N 43 120.640 122.879 -2.239 1
1 491 . 1 1 1 A 44 44 THR H H 44 8.370 8.583 -0.213 1
1 492 . 1 1 1 A 44 44 THR HA H 44 3.410 3.787 -0.377 1
1 497 . 1 1 1 A 44 44 THR C C 44 175.020 175.822 -0.802 1
1 498 . 1 1 1 A 44 44 THR CA C 44 65.660 65.052 0.608 1
1 499 . 1 1 1 A 44 44 THR CB C 44 69.400 68.349 1.051 1
1 501 . 1 1 1 A 44 44 THR N N 44 118.590 117.600 0.990 1
1 502 . 1 1 1 A 45 45 GLY H H 45 9.090 8.770 0.320 1
1 503 . 1 1 1 A 45 45 GLY HA2 H 45 3.470 4.024 -0.554 1
1 504 . 1 1 1 A 45 45 GLY HA3 H 45 4.470 4.030 0.440 1
1 505 . 1 1 1 A 45 45 GLY C C 45 174.350 173.850 0.500 1
1 506 . 1 1 1 A 45 45 GLY CA C 45 45.000 44.948 0.052 1
1 507 . 1 1 1 A 45 45 GLY N N 45 117.350 114.999 2.351 1
1 508 . 1 1 1 A 46 46 ASP H H 46 8.010 7.899 0.111 1
1 509 . 1 1 1 A 46 46 ASP HA H 46 4.470 4.630 -0.160 1
1 512 . 1 1 1 A 46 46 ASP C C 46 174.570 174.502 0.068 1
1 513 . 1 1 1 A 46 46 ASP CA C 46 55.570 55.441 0.129 1
1 514 . 1 1 1 A 46 46 ASP CB C 46 41.680 41.504 0.176 1
1 515 . 1 1 1 A 46 46 ASP N N 46 122.240 122.241 -0.001 1
1 516 . 1 1 1 A 47 47 VAL H H 47 8.330 8.503 -0.173 1
1 517 . 1 1 1 A 47 47 VAL HA H 47 4.950 4.942 0.008 1
1 525 . 1 1 1 A 47 47 VAL C C 47 176.330 175.518 0.812 1
1 526 . 1 1 1 A 47 47 VAL CA C 47 61.710 60.904 0.806 1
1 527 . 1 1 1 A 47 47 VAL CB C 47 32.900 35.235 -2.335 1
1 530 . 1 1 1 A 47 47 VAL N N 47 119.860 121.811 -1.951 1
1 531 . 1 1 1 A 48 48 ILE H H 48 9.160 8.685 0.475 1
1 532 . 1 1 1 A 48 48 ILE HA H 48 4.630 5.135 -0.505 1
1 542 . 1 1 1 A 48 48 ILE C C 48 174.400 174.442 -0.042 1
1 543 . 1 1 1 A 48 48 ILE CA C 48 58.990 59.268 -0.278 1
1 544 . 1 1 1 A 48 48 ILE CB C 48 41.810 42.161 -0.351 1
1 548 . 1 1 1 A 48 48 ILE N N 48 124.990 121.644 3.346 1
1 549 . 1 1 1 A 49 49 GLY H H 49 8.660 8.974 -0.314 1
1 550 . 1 1 1 A 49 49 GLY HA2 H 49 4.950 4.313 0.637 1
1 551 . 1 1 1 A 49 49 GLY HA3 H 49 3.620 4.355 -0.735 1
1 552 . 1 1 1 A 49 49 GLY C C 49 172.920 172.008 0.912 1
1 553 . 1 1 1 A 49 49 GLY CA C 49 44.580 44.467 0.113 1
1 554 . 1 1 1 A 49 49 GLY N N 49 112.060 109.429 2.631 1
1 555 . 1 1 1 A 50 50 ILE H H 50 8.810 9.139 -0.329 1
1 556 . 1 1 1 A 50 50 ILE HA H 50 4.370 4.808 -0.438 1
1 566 . 1 1 1 A 50 50 ILE C C 50 174.500 174.762 -0.262 1
1 567 . 1 1 1 A 50 50 ILE CA C 50 59.550 59.964 -0.414 1
1 568 . 1 1 1 A 50 50 ILE CB C 50 41.300 41.332 -0.032 1
1 572 . 1 1 1 A 50 50 ILE N N 50 123.220 125.547 -2.327 1
1 573 . 1 1 1 A 51 51 SER H H 51 8.540 8.999 -0.459 1
1 574 . 1 1 1 A 51 51 SER HA H 51 4.830 5.137 -0.307 1
1 577 . 1 1 1 A 51 51 SER C C 51 174.130 173.916 0.214 1
1 578 . 1 1 1 A 51 51 SER CA C 51 57.770 56.690 1.080 1
1 579 . 1 1 1 A 51 51 SER CB C 51 63.040 64.543 -1.503 1
1 580 . 1 1 1 A 51 51 SER N N 51 121.430 121.607 -0.177 1
1 581 . 1 1 1 A 52 52 ILE H H 52 8.930 8.720 0.210 1
1 582 . 1 1 1 A 52 52 ILE HA H 52 4.290 4.595 -0.305 1
1 592 . 1 1 1 A 52 52 ILE C C 52 175.280 176.032 -0.752 1
1 593 . 1 1 1 A 52 52 ILE CA C 52 60.250 60.244 0.006 1
1 594 . 1 1 1 A 52 52 ILE CB C 52 39.840 40.506 -0.666 1
1 598 . 1 1 1 A 52 52 ILE N N 52 127.060 125.023 2.037 1
1 599 . 1 1 1 A 53 53 LEU H H 53 9.380 9.455 -0.075 1
1 600 . 1 1 1 A 53 53 LEU HA H 53 3.890 4.087 -0.197 1
1 610 . 1 1 1 A 53 53 LEU C C 53 177.130 176.989 0.141 1
1 611 . 1 1 1 A 53 53 LEU CA C 53 55.560 56.199 -0.639 1
1 612 . 1 1 1 A 53 53 LEU CB C 53 39.370 40.652 -1.282 1
1 616 . 1 1 1 A 53 53 LEU N N 53 126.770 129.609 -2.839 1
1 617 . 1 1 1 A 54 54 GLY H H 54 8.310 8.706 -0.396 1
1 618 . 1 1 1 A 54 54 GLY HA2 H 54 3.490 3.897 -0.407 1
1 619 . 1 1 1 A 54 54 GLY HA3 H 54 4.080 3.898 0.182 1
1 620 . 1 1 1 A 54 54 GLY C C 54 173.690 173.775 -0.085 1
1 621 . 1 1 1 A 54 54 GLY CA C 54 45.340 45.705 -0.365 1
1 622 . 1 1 1 A 54 54 GLY N N 54 103.820 104.381 -0.561 1
1 623 . 1 1 1 A 55 55 LYS H H 55 7.730 7.953 -0.223 1
1 624 . 1 1 1 A 55 55 LYS HA H 55 4.560 4.752 -0.192 1
1 633 . 1 1 1 A 55 55 LYS C C 55 174.550 175.046 -0.496 1
1 634 . 1 1 1 A 55 55 LYS CA C 55 54.140 54.472 -0.332 1
1 635 . 1 1 1 A 55 55 LYS CB C 55 34.620 35.157 -0.537 1
1 639 . 1 1 1 A 55 55 LYS N N 55 121.160 120.099 1.061 1
1 640 . 1 1 1 A 56 56 GLU H H 56 8.490 8.831 -0.341 1
1 641 . 1 1 1 A 56 56 GLU HA H 56 4.280 4.704 -0.424 1
1 646 . 1 1 1 A 56 56 GLU C C 56 175.730 175.272 0.458 1
1 647 . 1 1 1 A 56 56 GLU CA C 56 56.730 56.287 0.443 1
1 648 . 1 1 1 A 56 56 GLU CB C 56 30.070 30.670 -0.600 1
1 650 . 1 1 1 A 56 56 GLU N N 56 124.090 124.909 -0.819 1
1 651 . 1 1 1 A 57 57 VAL H H 57 8.920 8.481 0.439 1
1 652 . 1 1 1 A 57 57 VAL HA H 57 4.030 4.840 -0.810 1
1 660 . 1 1 1 A 57 57 VAL C C 57 174.610 173.780 0.830 1
1 661 . 1 1 1 A 57 57 VAL CA C 57 61.680 59.538 2.142 1
1 662 . 1 1 1 A 57 57 VAL CB C 57 33.880 34.486 -0.606 1
1 665 . 1 1 1 A 57 57 VAL N N 57 129.960 126.872 3.088 1
1 666 . 1 1 1 A 58 58 LYS H H 58 7.860 8.742 -0.882 1
1 667 . 1 1 1 A 58 58 LYS HA H 58 5.120 4.839 0.281 1
1 676 . 1 1 1 A 58 58 LYS C C 58 175.380 175.622 -0.242 1
1 677 . 1 1 1 A 58 58 LYS CA C 58 55.200 54.725 0.475 1
1 678 . 1 1 1 A 58 58 LYS CB C 58 34.670 34.193 0.477 1
1 682 . 1 1 1 A 58 58 LYS N N 58 124.790 127.372 -2.582 1
1 683 . 1 1 1 A 59 59 PHE H H 59 9.270 9.100 0.170 1
1 684 . 1 1 1 A 59 59 PHE HA H 59 4.960 5.116 -0.156 1
1 692 . 1 1 1 A 59 59 PHE C C 59 173.950 174.360 -0.410 1
1 693 . 1 1 1 A 59 59 PHE CA C 59 55.910 56.391 -0.481 1
1 694 . 1 1 1 A 59 59 PHE CB C 59 42.950 42.013 0.937 1
1 700 . 1 1 1 A 59 59 PHE N N 59 118.270 122.700 -4.430 1
1 701 . 1 1 1 A 60 60 LYS H H 60 9.170 8.918 0.252 1
1 702 . 1 1 1 A 60 60 LYS HA H 60 4.910 4.987 -0.077 1
1 711 . 1 1 1 A 60 60 LYS C C 60 176.230 175.943 0.287 1
1 712 . 1 1 1 A 60 60 LYS CA C 60 53.910 54.530 -0.620 1
1 713 . 1 1 1 A 60 60 LYS CB C 60 35.170 34.995 0.175 1
1 717 . 1 1 1 A 60 60 LYS N N 60 121.960 124.333 -2.373 1
1 718 . 1 1 1 A 61 61 VAL H H 61 9.400 8.835 0.565 1
1 719 . 1 1 1 A 61 61 VAL HA H 61 4.170 4.078 0.092 1
1 727 . 1 1 1 A 61 61 VAL C C 61 175.500 175.381 0.119 1
1 728 . 1 1 1 A 61 61 VAL CA C 61 61.980 63.292 -1.312 1
1 729 . 1 1 1 A 61 61 VAL CB C 61 29.490 31.237 -1.747 1
1 732 . 1 1 1 A 61 61 VAL N N 61 127.140 127.060 0.080 1
1 733 . 1 1 1 A 62 62 VAL H H 62 8.390 8.696 -0.306 1
1 734 . 1 1 1 A 62 62 VAL HA H 62 3.650 4.000 -0.350 1
1 742 . 1 1 1 A 62 62 VAL C C 62 176.440 176.123 0.317 1
1 743 . 1 1 1 A 62 62 VAL CA C 62 64.930 64.468 0.462 1
1 744 . 1 1 1 A 62 62 VAL CB C 62 32.130 32.499 -0.369 1
1 747 . 1 1 1 A 62 62 VAL N N 62 132.840 129.286 3.554 1
1 748 . 1 1 1 A 63 63 GLN H H 63 7.470 7.290 0.180 1
1 749 . 1 1 1 A 63 63 GLN HA H 63 4.270 4.744 -0.474 1
1 756 . 1 1 1 A 63 63 GLN C C 63 172.290 173.332 -1.042 1
1 757 . 1 1 1 A 63 63 GLN CA C 63 56.640 54.874 1.766 1
1 758 . 1 1 1 A 63 63 GLN CB C 63 32.630 32.845 -0.215 1
1 760 . 1 1 1 A 63 63 GLN N N 63 114.500 119.084 -4.584 1
1 762 . 1 1 1 A 64 64 ALA H H 64 8.200 8.655 -0.455 1
1 763 . 1 1 1 A 64 64 ALA HA H 64 4.830 5.435 -0.605 1
1 767 . 1 1 1 A 64 64 ALA C C 64 174.270 175.638 -1.368 1
1 768 . 1 1 1 A 64 64 ALA CA C 64 50.800 50.039 0.761 1
1 769 . 1 1 1 A 64 64 ALA CB C 64 20.100 21.608 -1.508 1
1 770 . 1 1 1 A 64 64 ALA N N 64 131.410 125.498 5.912 1
1 771 . 1 1 1 A 65 65 TYR H H 65 8.860 8.540 0.320 1
1 772 . 1 1 1 A 65 65 TYR HA H 65 4.540 4.968 -0.428 1
1 779 . 1 1 1 A 65 65 TYR CA C 65 54.270 55.027 -0.757 1
1 780 . 1 1 1 A 65 65 TYR CB C 65 41.360 40.395 0.965 1
1 785 . 1 1 1 A 65 65 TYR N N 65 124.140 120.210 3.930 1
1 786 . 1 1 1 A 66 66 PRO HA H 66 4.120 4.615 -0.495 1
1 793 . 1 1 1 A 66 66 PRO CA C 66 63.450 62.307 1.143 1
1 794 . 1 1 1 A 66 66 PRO CB C 66 34.170 32.721 1.449 1
1 797 . 1 1 1 A 67 67 SER H H 67 7.380 8.174 -0.794 1
1 798 . 1 1 1 A 67 67 SER HA H 67 4.720 5.007 -0.287 1
1 801 . 1 1 1 A 67 67 SER CA C 67 54.250 55.960 -1.710 1
1 802 . 1 1 1 A 67 67 SER CB C 67 64.530 63.908 0.622 1
1 803 . 1 1 1 A 67 67 SER N N 67 106.200 116.789 -10.589 1
1 804 . 1 1 1 A 68 68 PRO HA H 68 4.880 4.663 0.217 1
1 811 . 1 1 1 A 68 68 PRO CA C 68 62.990 62.450 0.540 1
1 812 . 1 1 1 A 68 68 PRO CB C 68 35.220 33.216 2.004 1
1 815 . 1 1 1 A 69 69 LEU H H 69 8.960 7.914 1.046 1
1 816 . 1 1 1 A 69 69 LEU HA H 69 4.430 5.113 -0.683 1
1 826 . 1 1 1 A 69 69 LEU C C 69 174.570 175.250 -0.680 1
1 827 . 1 1 1 A 69 69 LEU CA C 69 53.900 52.658 1.242 1
1 828 . 1 1 1 A 69 69 LEU CB C 69 44.210 46.093 -1.883 1
1 832 . 1 1 1 A 69 69 LEU N N 69 120.480 117.125 3.355 1
1 833 . 1 1 1 A 70 70 ARG H H 70 8.130 8.371 -0.241 1
1 834 . 1 1 1 A 70 70 ARG HA H 70 4.930 4.808 0.122 1
1 841 . 1 1 1 A 70 70 ARG C C 70 175.460 176.132 -0.672 1
1 842 . 1 1 1 A 70 70 ARG CA C 70 54.040 55.470 -1.430 1
1 843 . 1 1 1 A 70 70 ARG CB C 70 30.550 31.923 -1.373 1
1 846 . 1 1 1 A 70 70 ARG N N 70 125.180 119.654 5.526 1
1 847 . 1 1 1 A 71 71 VAL H H 71 8.450 8.189 0.261 1
1 848 . 1 1 1 A 71 71 VAL HA H 71 3.410 4.406 -0.996 1
1 856 . 1 1 1 A 71 71 VAL C C 71 175.460 175.431 0.029 1
1 857 . 1 1 1 A 71 71 VAL CA C 71 65.210 62.032 3.178 1
1 858 . 1 1 1 A 71 71 VAL CB C 71 29.840 31.522 -1.682 1
1 861 . 1 1 1 A 71 71 VAL N N 71 128.170 122.563 5.607 1
1 862 . 1 1 1 A 72 72 GLU H H 72 8.620 8.593 0.027 1
1 863 . 1 1 1 A 72 72 GLU HA H 72 4.870 4.835 0.035 1
1 868 . 1 1 1 A 72 72 GLU C C 72 176.960 176.867 0.093 1
1 869 . 1 1 1 A 72 72 GLU CA C 72 54.330 54.465 -0.135 1
1 870 . 1 1 1 A 72 72 GLU CB C 72 33.280 33.271 0.009 1
1 872 . 1 1 1 A 72 72 GLU N N 72 127.670 126.937 0.733 1
1 873 . 1 1 1 A 73 73 ASP H H 73 8.700 9.034 -0.334 1
1 874 . 1 1 1 A 73 73 ASP HA H 73 4.150 4.385 -0.235 1
1 877 . 1 1 1 A 73 73 ASP C C 73 177.460 177.996 -0.536 1
1 878 . 1 1 1 A 73 73 ASP CA C 73 57.620 56.627 0.993 1
1 879 . 1 1 1 A 73 73 ASP CB C 73 40.360 39.905 0.455 1
1 880 . 1 1 1 A 73 73 ASP N N 73 121.140 123.889 -2.749 1
1 881 . 1 1 1 A 74 74 ARG H H 74 7.760 7.725 0.035 1
1 882 . 1 1 1 A 74 74 ARG HA H 74 4.280 4.332 -0.052 1
1 889 . 1 1 1 A 74 74 ARG C C 74 176.510 176.763 -0.253 1
1 890 . 1 1 1 A 74 74 ARG CA C 74 55.450 57.054 -1.604 1
1 891 . 1 1 1 A 74 74 ARG CB C 74 29.990 30.851 -0.861 1
1 894 . 1 1 1 A 74 74 ARG N N 74 112.890 117.212 -4.322 1
1 895 . 1 1 1 A 75 75 THR H H 75 7.700 7.489 0.211 1
1 896 . 1 1 1 A 75 75 THR HA H 75 4.020 4.309 -0.289 1
1 901 . 1 1 1 A 75 75 THR C C 75 173.810 173.938 -0.128 1
1 902 . 1 1 1 A 75 75 THR CA C 75 64.060 63.678 0.382 1
1 903 . 1 1 1 A 75 75 THR CB C 75 69.350 69.552 -0.202 1
1 905 . 1 1 1 A 75 75 THR N N 75 120.650 116.284 4.366 1
1 906 . 1 1 1 A 76 76 LYS H H 76 8.520 8.239 0.281 1
1 907 . 1 1 1 A 76 76 LYS HA H 76 4.270 4.674 -0.404 1
1 916 . 1 1 1 A 76 76 LYS C C 76 174.560 175.800 -1.240 1
1 917 . 1 1 1 A 76 76 LYS CA C 76 56.280 55.968 0.312 1
1 918 . 1 1 1 A 76 76 LYS CB C 76 33.120 33.761 -0.641 1
1 922 . 1 1 1 A 76 76 LYS N N 76 130.950 126.921 4.029 1
1 923 . 1 1 1 A 77 77 ILE H H 77 8.430 8.595 -0.165 1
1 924 . 1 1 1 A 77 77 ILE HA H 77 4.850 5.246 -0.396 1
1 934 . 1 1 1 A 77 77 ILE C C 77 174.650 174.937 -0.287 1
1 935 . 1 1 1 A 77 77 ILE CA C 77 59.820 60.098 -0.278 1
1 936 . 1 1 1 A 77 77 ILE CB C 77 38.280 40.880 -2.600 1
1 940 . 1 1 1 A 77 77 ILE N N 77 128.020 123.046 4.974 1
1 941 . 1 1 1 A 78 78 THR H H 78 8.870 8.748 0.122 1
1 942 . 1 1 1 A 78 78 THR HA H 78 4.470 5.110 -0.640 1
1 947 . 1 1 1 A 78 78 THR C C 78 172.760 173.360 -0.600 1
1 948 . 1 1 1 A 78 78 THR CA C 78 60.740 61.330 -0.590 1
1 949 . 1 1 1 A 78 78 THR CB C 78 71.320 71.554 -0.234 1
1 951 . 1 1 1 A 78 78 THR N N 78 123.870 124.104 -0.234 1
1 952 . 1 1 1 A 79 79 LEU H H 79 8.820 8.977 -0.157 1
1 953 . 1 1 1 A 79 79 LEU HA H 79 5.140 5.082 0.058 1
1 963 . 1 1 1 A 79 79 LEU C C 79 176.610 175.878 0.732 1
1 964 . 1 1 1 A 79 79 LEU CA C 79 53.280 53.373 -0.093 1
1 965 . 1 1 1 A 79 79 LEU CB C 79 42.600 42.892 -0.292 1
1 969 . 1 1 1 A 79 79 LEU N N 79 127.070 126.680 0.390 1
1 970 . 1 1 1 A 80 80 VAL H H 80 8.800 8.581 0.219 1
1 971 . 1 1 1 A 80 80 VAL HA H 80 4.260 4.777 -0.517 1
1 979 . 1 1 1 A 80 80 VAL CA C 80 61.350 61.578 -0.228 1
1 980 . 1 1 1 A 80 80 VAL CB C 80 32.790 32.969 -0.179 1
1 983 . 1 1 1 A 80 80 VAL N N 80 124.120 125.621 -1.501 1
1 984 . 1 1 1 A 81 81 THR H H 81 8.160 8.920 -0.760 1
1 985 . 1 1 1 A 81 81 THR HA H 81 4.410 5.262 -0.852 1
1 990 . 1 1 1 A 81 81 THR CA C 81 60.800 60.080 0.720 1
1 991 . 1 1 1 A 81 81 THR CB C 81 69.650 72.428 -2.778 1
1 993 . 1 1 1 A 81 81 THR N N 81 114.500 116.625 -2.125 1
1 1 . 2 1 1 A 9 9 GLY H H 9 8.390 8.548 -0.158 1
1 2 . 2 1 1 A 9 9 GLY HA2 H 9 3.900 4.265 -0.365 1
1 3 . 2 1 1 A 9 9 GLY HA3 H 9 3.860 4.267 -0.407 1
1 4 . 2 1 1 A 9 9 GLY CA C 9 45.150 45.809 -0.659 1
1 5 . 2 1 1 A 9 9 GLY N N 9 110.000 107.372 2.628 1
1 6 . 2 1 1 A 10 10 VAL H H 10 7.870 8.507 -0.637 1
1 7 . 2 1 1 A 10 10 VAL HA H 10 4.040 4.422 -0.382 1
1 15 . 2 1 1 A 10 10 VAL C C 10 175.880 175.245 0.635 1
1 16 . 2 1 1 A 10 10 VAL CA C 10 62.110 62.492 -0.382 1
1 17 . 2 1 1 A 10 10 VAL CB C 10 32.760 32.027 0.733 1
1 20 . 2 1 1 A 10 10 VAL N N 10 119.730 121.247 -1.517 1
1 21 . 2 1 1 A 11 11 ILE H H 11 8.230 9.137 -0.907 1
1 22 . 2 1 1 A 11 11 ILE HA H 11 4.090 4.705 -0.615 1
1 32 . 2 1 1 A 11 11 ILE C C 11 175.850 174.760 1.090 1
1 33 . 2 1 1 A 11 11 ILE CA C 11 60.800 59.749 1.051 1
1 34 . 2 1 1 A 11 11 ILE CB C 11 38.470 40.304 -1.834 1
1 38 . 2 1 1 A 11 11 ILE N N 11 125.570 128.738 -3.168 1
1 39 . 2 1 1 A 12 12 MET H H 12 8.370 8.921 -0.551 1
1 40 . 2 1 1 A 12 12 MET HA H 12 4.540 4.937 -0.397 1
1 48 . 2 1 1 A 12 12 MET C C 12 174.830 175.779 -0.949 1
1 49 . 2 1 1 A 12 12 MET CA C 12 54.790 54.268 0.522 1
1 50 . 2 1 1 A 12 12 MET CB C 12 32.640 33.491 -0.851 1
1 53 . 2 1 1 A 12 12 MET N N 12 125.930 126.798 -0.868 1
1 54 . 2 1 1 A 13 13 SER H H 13 7.990 8.521 -0.531 1
1 55 . 2 1 1 A 13 13 SER HA H 13 5.030 4.731 0.299 1
1 58 . 2 1 1 A 13 13 SER C C 13 174.330 173.756 0.574 1
1 59 . 2 1 1 A 13 13 SER CA C 13 57.320 57.949 -0.629 1
1 60 . 2 1 1 A 13 13 SER CB C 13 64.790 64.456 0.334 1
1 61 . 2 1 1 A 13 13 SER N N 13 116.400 119.195 -2.795 1
1 62 . 2 1 1 A 14 14 GLU H H 14 9.430 8.652 0.778 1
1 63 . 2 1 1 A 14 14 GLU HA H 14 5.250 5.105 0.145 1
1 68 . 2 1 1 A 14 14 GLU C C 14 172.980 174.033 -1.053 1
1 69 . 2 1 1 A 14 14 GLU CA C 14 55.390 55.424 -0.034 1
1 70 . 2 1 1 A 14 14 GLU CB C 14 33.910 34.228 -0.318 1
1 72 . 2 1 1 A 14 14 GLU N N 14 123.670 122.289 1.381 1
1 73 . 2 1 1 A 15 15 LEU H H 15 8.930 8.870 0.060 1
1 74 . 2 1 1 A 15 15 LEU HA H 15 4.870 5.155 -0.285 1
1 84 . 2 1 1 A 15 15 LEU C C 15 174.000 174.486 -0.486 1
1 85 . 2 1 1 A 15 15 LEU CA C 15 53.020 53.810 -0.790 1
1 86 . 2 1 1 A 15 15 LEU CB C 15 46.040 46.008 0.032 1
1 90 . 2 1 1 A 15 15 LEU N N 15 125.350 125.775 -0.425 1
1 91 . 2 1 1 A 16 16 LYS H H 16 8.840 8.789 0.051 1
1 92 . 2 1 1 A 16 16 LYS HA H 16 5.360 5.012 0.348 1
1 101 . 2 1 1 A 16 16 LYS C C 16 175.660 175.808 -0.148 1
1 102 . 2 1 1 A 16 16 LYS CA C 16 54.940 55.235 -0.295 1
1 103 . 2 1 1 A 16 16 LYS CB C 16 34.280 34.425 -0.145 1
1 107 . 2 1 1 A 16 16 LYS N N 16 124.640 126.926 -2.286 1
1 108 . 2 1 1 A 17 17 LEU H H 17 8.820 8.996 -0.176 1
1 109 . 2 1 1 A 17 17 LEU HA H 17 5.430 5.197 0.233 1
1 119 . 2 1 1 A 17 17 LEU C C 17 174.630 175.627 -0.997 1
1 120 . 2 1 1 A 17 17 LEU CA C 17 52.900 53.658 -0.758 1
1 121 . 2 1 1 A 17 17 LEU CB C 17 46.910 45.744 1.166 1
1 125 . 2 1 1 A 17 17 LEU N N 17 123.460 125.933 -2.473 1
1 126 . 2 1 1 A 18 18 LYS H H 18 9.110 8.728 0.382 1
1 127 . 2 1 1 A 18 18 LYS HA H 18 5.490 5.016 0.474 1
1 136 . 2 1 1 A 18 18 LYS CA C 18 52.270 52.846 -0.576 1
1 137 . 2 1 1 A 18 18 LYS CB C 18 37.500 36.177 1.323 1
1 141 . 2 1 1 A 18 18 LYS N N 18 122.230 123.779 -1.549 1
1 142 . 2 1 1 A 19 19 PRO HA H 19 4.100 4.427 -0.327 1
1 149 . 2 1 1 A 19 19 PRO CA C 19 62.440 62.655 -0.215 1
1 150 . 2 1 1 A 19 19 PRO CB C 19 30.640 32.123 -1.483 1
1 153 . 2 1 1 A 20 20 LEU H H 20 8.490 8.413 0.077 1
1 154 . 2 1 1 A 20 20 LEU HA H 20 4.320 4.273 0.047 1
1 164 . 2 1 1 A 20 20 LEU CA C 20 57.680 58.602 -0.922 1
1 165 . 2 1 1 A 20 20 LEU CB C 20 38.760 41.125 -2.365 1
1 169 . 2 1 1 A 20 20 LEU N N 20 123.250 119.547 3.703 1
1 170 . 2 1 1 A 21 21 PRO HA H 21 4.530 4.536 -0.006 1
1 177 . 2 1 1 A 21 21 PRO CA C 21 62.880 62.375 0.505 1
1 178 . 2 1 1 A 21 21 PRO CB C 21 31.420 32.234 -0.814 1
1 181 . 2 1 1 A 22 22 LYS H H 22 8.180 8.406 -0.226 1
1 182 . 2 1 1 A 22 22 LYS HA H 22 4.110 4.406 -0.296 1
1 191 . 2 1 1 A 22 22 LYS C C 22 175.680 175.429 0.251 1
1 192 . 2 1 1 A 22 22 LYS CA C 22 56.210 55.769 0.441 1
1 193 . 2 1 1 A 22 22 LYS CB C 22 30.660 32.098 -1.438 1
1 197 . 2 1 1 A 22 22 LYS N N 22 119.160 121.897 -2.737 1
1 198 . 2 1 1 A 23 23 VAL H H 23 7.530 8.462 -0.932 1
1 199 . 2 1 1 A 23 23 VAL HA H 23 4.280 4.760 -0.480 1
1 207 . 2 1 1 A 23 23 VAL C C 23 173.690 173.394 0.296 1
1 208 . 2 1 1 A 23 23 VAL CA C 23 59.830 59.566 0.264 1
1 209 . 2 1 1 A 23 23 VAL CB C 23 34.550 35.508 -0.958 1
1 212 . 2 1 1 A 23 23 VAL N N 23 121.820 122.873 -1.053 1
1 213 . 2 1 1 A 24 24 GLU H H 24 8.270 8.928 -0.658 1
1 214 . 2 1 1 A 24 24 GLU HA H 24 4.330 4.884 -0.554 1
1 219 . 2 1 1 A 24 24 GLU C C 24 175.390 175.328 0.062 1
1 220 . 2 1 1 A 24 24 GLU CA C 24 55.220 55.246 -0.026 1
1 221 . 2 1 1 A 24 24 GLU CB C 24 29.970 31.357 -1.387 1
1 223 . 2 1 1 A 24 24 GLU N N 24 125.610 126.902 -1.292 1
1 224 . 2 1 1 A 25 25 LEU H H 25 8.480 8.765 -0.285 1
1 225 . 2 1 1 A 25 25 LEU HA H 25 4.520 4.443 0.077 1
1 235 . 2 1 1 A 25 25 LEU CA C 25 51.660 51.099 0.561 1
1 236 . 2 1 1 A 25 25 LEU CB C 25 41.750 41.667 0.083 1
1 240 . 2 1 1 A 25 25 LEU N N 25 125.880 126.614 -0.734 1
1 241 . 2 1 1 A 26 26 PRO HA H 26 4.760 4.669 0.091 1
1 248 . 2 1 1 A 26 26 PRO CA C 26 61.330 61.954 -0.624 1
1 249 . 2 1 1 A 26 26 PRO CB C 26 31.060 32.865 -1.805 1
1 252 . 2 1 1 A 27 27 PRO HA H 27 4.390 4.424 -0.034 1
1 259 . 2 1 1 A 27 27 PRO CA C 27 64.550 64.852 -0.302 1
1 260 . 2 1 1 A 27 27 PRO CB C 27 31.770 31.743 0.027 1
1 263 . 2 1 1 A 28 28 ASP H H 28 8.560 8.768 -0.208 1
1 264 . 2 1 1 A 28 28 ASP HA H 28 4.620 4.398 0.222 1
1 267 . 2 1 1 A 28 28 ASP C C 28 177.100 178.705 -1.605 1
1 268 . 2 1 1 A 28 28 ASP CA C 28 53.890 56.522 -2.632 1
1 269 . 2 1 1 A 28 28 ASP CB C 28 39.120 39.606 -0.486 1
1 270 . 2 1 1 A 28 28 ASP N N 28 115.820 117.832 -2.012 1
1 271 . 2 1 1 A 29 29 PHE H H 29 7.940 7.968 -0.028 1
1 272 . 2 1 1 A 29 29 PHE HA H 29 4.180 4.314 -0.134 1
1 280 . 2 1 1 A 29 29 PHE C C 29 176.740 178.255 -1.515 1
1 281 . 2 1 1 A 29 29 PHE CA C 29 61.020 61.040 -0.020 1
1 282 . 2 1 1 A 29 29 PHE CB C 29 39.230 38.756 0.474 1
1 288 . 2 1 1 A 29 29 PHE N N 29 119.610 118.202 1.408 1
1 289 . 2 1 1 A 30 30 VAL H H 30 8.010 8.451 -0.441 1
1 290 . 2 1 1 A 30 30 VAL HA H 30 3.350 3.775 -0.425 1
1 298 . 2 1 1 A 30 30 VAL C C 30 176.400 177.114 -0.714 1
1 299 . 2 1 1 A 30 30 VAL CA C 30 66.510 64.814 1.696 1
1 300 . 2 1 1 A 30 30 VAL CB C 30 31.020 31.080 -0.060 1
1 303 . 2 1 1 A 30 30 VAL N N 30 116.370 119.590 -3.220 1
1 304 . 2 1 1 A 31 31 ASP H H 31 7.420 7.978 -0.558 1
1 305 . 2 1 1 A 31 31 ASP HA H 31 4.310 4.367 -0.057 1
1 308 . 2 1 1 A 31 31 ASP C C 31 178.360 178.892 -0.532 1
1 309 . 2 1 1 A 31 31 ASP CA C 31 57.110 57.100 0.010 1
1 310 . 2 1 1 A 31 31 ASP CB C 31 40.450 40.896 -0.446 1
1 311 . 2 1 1 A 31 31 ASP N N 31 119.190 121.488 -2.298 1
1 312 . 2 1 1 A 32 32 VAL H H 32 7.190 7.370 -0.180 1
1 313 . 2 1 1 A 32 32 VAL HA H 32 3.510 3.551 -0.041 1
1 321 . 2 1 1 A 32 32 VAL C C 32 178.100 178.547 -0.447 1
1 322 . 2 1 1 A 32 32 VAL CA C 32 65.570 66.378 -0.808 1
1 323 . 2 1 1 A 32 32 VAL CB C 32 31.410 31.297 0.113 1
1 326 . 2 1 1 A 32 32 VAL N N 32 119.830 120.240 -0.410 1
1 327 . 2 1 1 A 33 33 ILE H H 33 7.660 8.472 -0.812 1
1 328 . 2 1 1 A 33 33 ILE HA H 33 3.170 3.536 -0.366 1
1 338 . 2 1 1 A 33 33 ILE C C 33 176.660 178.152 -1.492 1
1 339 . 2 1 1 A 33 33 ILE CA C 33 65.220 65.233 -0.013 1
1 340 . 2 1 1 A 33 33 ILE CB C 33 37.500 37.679 -0.179 1
1 344 . 2 1 1 A 33 33 ILE N N 33 118.490 120.890 -2.400 1
1 345 . 2 1 1 A 34 34 ARG H H 34 7.830 7.760 0.070 1
1 346 . 2 1 1 A 34 34 ARG HA H 34 3.380 3.896 -0.516 1
1 354 . 2 1 1 A 34 34 ARG C C 34 178.060 177.712 0.348 1
1 355 . 2 1 1 A 34 34 ARG CA C 34 60.570 58.912 1.658 1
1 356 . 2 1 1 A 34 34 ARG CB C 34 30.070 29.818 0.252 1
1 359 . 2 1 1 A 34 34 ARG N N 34 118.260 119.980 -1.720 1
1 361 . 2 1 1 A 35 35 ILE H H 35 7.350 7.830 -0.480 1
1 362 . 2 1 1 A 35 35 ILE HA H 35 3.720 3.721 -0.001 1
1 372 . 2 1 1 A 35 35 ILE C C 35 179.090 178.032 1.058 1
1 373 . 2 1 1 A 35 35 ILE CA C 35 64.060 65.324 -1.264 1
1 374 . 2 1 1 A 35 35 ILE CB C 35 38.030 37.577 0.453 1
1 378 . 2 1 1 A 35 35 ILE N N 35 116.750 119.456 -2.706 1
1 379 . 2 1 1 A 36 36 LYS H H 36 7.880 7.649 0.231 1
1 380 . 2 1 1 A 36 36 LYS HA H 36 4.090 3.956 0.134 1
1 389 . 2 1 1 A 36 36 LYS C C 36 178.560 178.900 -0.340 1
1 390 . 2 1 1 A 36 36 LYS CA C 36 57.650 59.780 -2.130 1
1 391 . 2 1 1 A 36 36 LYS CB C 36 32.090 32.209 -0.119 1
1 395 . 2 1 1 A 36 36 LYS N N 36 118.700 119.739 -1.039 1
1 396 . 2 1 1 A 37 37 LEU H H 37 7.860 7.457 0.403 1
1 397 . 2 1 1 A 37 37 LEU HA H 37 4.230 4.302 -0.072 1
1 407 . 2 1 1 A 37 37 LEU C C 37 175.880 176.770 -0.890 1
1 408 . 2 1 1 A 37 37 LEU CA C 37 54.090 55.617 -1.527 1
1 409 . 2 1 1 A 37 37 LEU CB C 37 43.310 42.462 0.848 1
1 413 . 2 1 1 A 37 37 LEU N N 37 116.380 117.311 -0.931 1
1 414 . 2 1 1 A 38 38 GLN H H 38 7.190 7.595 -0.405 1
1 415 . 2 1 1 A 38 38 GLN HA H 38 3.530 4.419 -0.889 1
1 422 . 2 1 1 A 38 38 GLN C C 38 177.480 176.261 1.219 1
1 423 . 2 1 1 A 38 38 GLN CA C 38 58.370 56.729 1.641 1
1 424 . 2 1 1 A 38 38 GLN CB C 38 28.300 28.731 -0.431 1
1 426 . 2 1 1 A 38 38 GLN N N 38 119.210 117.653 1.557 1
1 428 . 2 1 1 A 39 39 GLY H H 39 8.940 8.841 0.099 1
1 429 . 2 1 1 A 39 39 GLY HA2 H 39 3.540 3.989 -0.449 1
1 430 . 2 1 1 A 39 39 GLY HA3 H 39 4.220 3.990 0.230 1
1 431 . 2 1 1 A 39 39 GLY C C 39 174.070 174.428 -0.358 1
1 432 . 2 1 1 A 39 39 GLY CA C 39 45.280 45.042 0.238 1
1 433 . 2 1 1 A 39 39 GLY N N 39 113.490 112.152 1.338 1
1 434 . 2 1 1 A 40 40 LYS H H 40 8.350 7.597 0.753 1
1 435 . 2 1 1 A 40 40 LYS HA H 40 4.400 4.594 -0.194 1
1 444 . 2 1 1 A 40 40 LYS C C 40 175.560 175.736 -0.176 1
1 445 . 2 1 1 A 40 40 LYS CA C 40 55.660 54.660 1.000 1
1 446 . 2 1 1 A 40 40 LYS CB C 40 32.870 33.745 -0.875 1
1 450 . 2 1 1 A 40 40 LYS N N 40 122.060 119.976 2.084 1
1 451 . 2 1 1 A 41 41 THR H H 41 8.410 8.543 -0.133 1
1 452 . 2 1 1 A 41 41 THR HA H 41 5.330 4.985 0.345 1
1 457 . 2 1 1 A 41 41 THR C C 41 174.860 174.453 0.407 1
1 458 . 2 1 1 A 41 41 THR CA C 41 62.040 61.664 0.376 1
1 459 . 2 1 1 A 41 41 THR CB C 41 69.420 70.869 -1.449 1
1 461 . 2 1 1 A 41 41 THR N N 41 118.150 117.335 0.815 1
1 462 . 2 1 1 A 42 42 VAL H H 42 9.140 9.084 0.056 1
1 463 . 2 1 1 A 42 42 VAL HA H 42 4.570 5.044 -0.474 1
1 471 . 2 1 1 A 42 42 VAL C C 42 172.970 174.290 -1.320 1
1 472 . 2 1 1 A 42 42 VAL CA C 42 59.450 59.137 0.313 1
1 473 . 2 1 1 A 42 42 VAL CB C 42 35.880 35.495 0.385 1
1 476 . 2 1 1 A 42 42 VAL N N 42 122.510 120.228 2.282 1
1 477 . 2 1 1 A 43 43 ARG H H 43 8.420 8.672 -0.252 1
1 478 . 2 1 1 A 43 43 ARG HA H 43 4.750 4.870 -0.120 1
1 485 . 2 1 1 A 43 43 ARG C C 43 175.650 175.794 -0.144 1
1 486 . 2 1 1 A 43 43 ARG CA C 43 53.650 53.839 -0.189 1
1 487 . 2 1 1 A 43 43 ARG CB C 43 33.870 34.183 -0.313 1
1 490 . 2 1 1 A 43 43 ARG N N 43 120.640 122.873 -2.233 1
1 491 . 2 1 1 A 44 44 THR H H 44 8.370 8.567 -0.197 1
1 492 . 2 1 1 A 44 44 THR HA H 44 3.410 3.761 -0.351 1
1 497 . 2 1 1 A 44 44 THR C C 44 175.020 175.809 -0.789 1
1 498 . 2 1 1 A 44 44 THR CA C 44 65.660 65.029 0.631 1
1 499 . 2 1 1 A 44 44 THR CB C 44 69.400 68.329 1.071 1
1 501 . 2 1 1 A 44 44 THR N N 44 118.590 117.566 1.024 1
1 502 . 2 1 1 A 45 45 GLY H H 45 9.090 8.769 0.321 1
1 503 . 2 1 1 A 45 45 GLY HA2 H 45 3.470 4.015 -0.545 1
1 504 . 2 1 1 A 45 45 GLY HA3 H 45 4.470 4.018 0.452 1
1 505 . 2 1 1 A 45 45 GLY C C 45 174.350 173.841 0.509 1
1 506 . 2 1 1 A 45 45 GLY CA C 45 45.000 44.939 0.061 1
1 507 . 2 1 1 A 45 45 GLY N N 45 117.350 114.979 2.371 1
1 508 . 2 1 1 A 46 46 ASP H H 46 8.010 7.893 0.117 1
1 509 . 2 1 1 A 46 46 ASP HA H 46 4.470 4.625 -0.155 1
1 512 . 2 1 1 A 46 46 ASP C C 46 174.570 174.518 0.052 1
1 513 . 2 1 1 A 46 46 ASP CA C 46 55.570 55.428 0.142 1
1 514 . 2 1 1 A 46 46 ASP CB C 46 41.680 41.485 0.195 1
1 515 . 2 1 1 A 46 46 ASP N N 46 122.240 122.229 0.011 1
1 516 . 2 1 1 A 47 47 VAL H H 47 8.330 8.499 -0.169 1
1 517 . 2 1 1 A 47 47 VAL HA H 47 4.950 4.940 0.010 1
1 525 . 2 1 1 A 47 47 VAL C C 47 176.330 175.489 0.841 1
1 526 . 2 1 1 A 47 47 VAL CA C 47 61.710 60.940 0.770 1
1 527 . 2 1 1 A 47 47 VAL CB C 47 32.900 35.068 -2.168 1
1 530 . 2 1 1 A 47 47 VAL N N 47 119.860 121.809 -1.949 1
1 531 . 2 1 1 A 48 48 ILE H H 48 9.160 8.697 0.463 1
1 532 . 2 1 1 A 48 48 ILE HA H 48 4.630 5.192 -0.562 1
1 542 . 2 1 1 A 48 48 ILE C C 48 174.400 174.460 -0.060 1
1 543 . 2 1 1 A 48 48 ILE CA C 48 58.990 59.282 -0.292 1
1 544 . 2 1 1 A 48 48 ILE CB C 48 41.810 42.184 -0.374 1
1 548 . 2 1 1 A 48 48 ILE N N 48 124.990 121.594 3.396 1
1 549 . 2 1 1 A 49 49 GLY H H 49 8.660 8.961 -0.301 1
1 550 . 2 1 1 A 49 49 GLY HA2 H 49 4.950 4.303 0.647 1
1 551 . 2 1 1 A 49 49 GLY HA3 H 49 3.620 4.344 -0.724 1
1 552 . 2 1 1 A 49 49 GLY C C 49 172.920 171.853 1.067 1
1 553 . 2 1 1 A 49 49 GLY CA C 49 44.580 44.420 0.160 1
1 554 . 2 1 1 A 49 49 GLY N N 49 112.060 109.367 2.693 1
1 555 . 2 1 1 A 50 50 ILE H H 50 8.810 9.145 -0.335 1
1 556 . 2 1 1 A 50 50 ILE HA H 50 4.370 4.834 -0.464 1
1 566 . 2 1 1 A 50 50 ILE C C 50 174.500 174.669 -0.169 1
1 567 . 2 1 1 A 50 50 ILE CA C 50 59.550 59.778 -0.228 1
1 568 . 2 1 1 A 50 50 ILE CB C 50 41.300 41.373 -0.073 1
1 572 . 2 1 1 A 50 50 ILE N N 50 123.220 125.420 -2.200 1
1 573 . 2 1 1 A 51 51 SER H H 51 8.540 8.828 -0.288 1
1 574 . 2 1 1 A 51 51 SER HA H 51 4.830 4.987 -0.157 1
1 577 . 2 1 1 A 51 51 SER C C 51 174.130 173.844 0.286 1
1 578 . 2 1 1 A 51 51 SER CA C 51 57.770 57.066 0.704 1
1 579 . 2 1 1 A 51 51 SER CB C 51 63.040 64.119 -1.079 1
1 580 . 2 1 1 A 51 51 SER N N 51 121.430 122.453 -1.023 1
1 581 . 2 1 1 A 52 52 ILE H H 52 8.930 8.717 0.213 1
1 582 . 2 1 1 A 52 52 ILE HA H 52 4.290 4.599 -0.309 1
1 592 . 2 1 1 A 52 52 ILE C C 52 175.280 176.099 -0.819 1
1 593 . 2 1 1 A 52 52 ILE CA C 52 60.250 60.369 -0.119 1
1 594 . 2 1 1 A 52 52 ILE CB C 52 39.840 40.391 -0.551 1
1 598 . 2 1 1 A 52 52 ILE N N 52 127.060 128.052 -0.992 1
1 599 . 2 1 1 A 53 53 LEU H H 53 9.380 9.479 -0.099 1
1 600 . 2 1 1 A 53 53 LEU HA H 53 3.890 4.086 -0.196 1
1 610 . 2 1 1 A 53 53 LEU C C 53 177.130 176.986 0.144 1
1 611 . 2 1 1 A 53 53 LEU CA C 53 55.560 56.198 -0.638 1
1 612 . 2 1 1 A 53 53 LEU CB C 53 39.370 40.670 -1.300 1
1 616 . 2 1 1 A 53 53 LEU N N 53 126.770 129.973 -3.203 1
1 617 . 2 1 1 A 54 54 GLY H H 54 8.310 8.710 -0.400 1
1 618 . 2 1 1 A 54 54 GLY HA2 H 54 3.490 3.895 -0.405 1
1 619 . 2 1 1 A 54 54 GLY HA3 H 54 4.080 3.896 0.184 1
1 620 . 2 1 1 A 54 54 GLY C C 54 173.690 173.803 -0.113 1
1 621 . 2 1 1 A 54 54 GLY CA C 54 45.340 45.780 -0.440 1
1 622 . 2 1 1 A 54 54 GLY N N 54 103.820 104.386 -0.566 1
1 623 . 2 1 1 A 55 55 LYS H H 55 7.730 7.949 -0.219 1
1 624 . 2 1 1 A 55 55 LYS HA H 55 4.560 4.721 -0.161 1
1 633 . 2 1 1 A 55 55 LYS C C 55 174.550 175.001 -0.451 1
1 634 . 2 1 1 A 55 55 LYS CA C 55 54.140 54.523 -0.383 1
1 635 . 2 1 1 A 55 55 LYS CB C 55 34.620 34.951 -0.331 1
1 639 . 2 1 1 A 55 55 LYS N N 55 121.160 119.946 1.214 1
1 640 . 2 1 1 A 56 56 GLU H H 56 8.490 8.844 -0.354 1
1 641 . 2 1 1 A 56 56 GLU HA H 56 4.280 4.688 -0.408 1
1 646 . 2 1 1 A 56 56 GLU C C 56 175.730 175.266 0.464 1
1 647 . 2 1 1 A 56 56 GLU CA C 56 56.730 56.267 0.463 1
1 648 . 2 1 1 A 56 56 GLU CB C 56 30.070 30.661 -0.591 1
1 650 . 2 1 1 A 56 56 GLU N N 56 124.090 124.884 -0.794 1
1 651 . 2 1 1 A 57 57 VAL H H 57 8.920 8.422 0.498 1
1 652 . 2 1 1 A 57 57 VAL HA H 57 4.030 4.816 -0.786 1
1 660 . 2 1 1 A 57 57 VAL C C 57 174.610 173.698 0.912 1
1 661 . 2 1 1 A 57 57 VAL CA C 57 61.680 59.542 2.138 1
1 662 . 2 1 1 A 57 57 VAL CB C 57 33.880 34.569 -0.689 1
1 665 . 2 1 1 A 57 57 VAL N N 57 129.960 126.526 3.434 1
1 666 . 2 1 1 A 58 58 LYS H H 58 7.860 8.714 -0.854 1
1 667 . 2 1 1 A 58 58 LYS HA H 58 5.120 4.824 0.296 1
1 676 . 2 1 1 A 58 58 LYS C C 58 175.380 175.711 -0.331 1
1 677 . 2 1 1 A 58 58 LYS CA C 58 55.200 54.726 0.474 1
1 678 . 2 1 1 A 58 58 LYS CB C 58 34.670 34.178 0.492 1
1 682 . 2 1 1 A 58 58 LYS N N 58 124.790 127.359 -2.569 1
1 683 . 2 1 1 A 59 59 PHE H H 59 9.270 9.132 0.138 1
1 684 . 2 1 1 A 59 59 PHE HA H 59 4.960 5.178 -0.218 1
1 692 . 2 1 1 A 59 59 PHE C C 59 173.950 174.292 -0.342 1
1 693 . 2 1 1 A 59 59 PHE CA C 59 55.910 56.168 -0.258 1
1 694 . 2 1 1 A 59 59 PHE CB C 59 42.950 42.155 0.795 1
1 700 . 2 1 1 A 59 59 PHE N N 59 118.270 122.710 -4.440 1
1 701 . 2 1 1 A 60 60 LYS H H 60 9.170 8.895 0.275 1
1 702 . 2 1 1 A 60 60 LYS HA H 60 4.910 4.979 -0.069 1
1 711 . 2 1 1 A 60 60 LYS C C 60 176.230 175.839 0.391 1
1 712 . 2 1 1 A 60 60 LYS CA C 60 53.910 54.535 -0.625 1
1 713 . 2 1 1 A 60 60 LYS CB C 60 35.170 34.977 0.193 1
1 717 . 2 1 1 A 60 60 LYS N N 60 121.960 124.312 -2.352 1
1 718 . 2 1 1 A 61 61 VAL H H 61 9.400 8.817 0.583 1
1 719 . 2 1 1 A 61 61 VAL HA H 61 4.170 4.059 0.111 1
1 727 . 2 1 1 A 61 61 VAL C C 61 175.500 175.342 0.158 1
1 728 . 2 1 1 A 61 61 VAL CA C 61 61.980 63.259 -1.279 1
1 729 . 2 1 1 A 61 61 VAL CB C 61 29.490 31.221 -1.731 1
1 732 . 2 1 1 A 61 61 VAL N N 61 127.140 127.043 0.097 1
1 733 . 2 1 1 A 62 62 VAL H H 62 8.390 8.672 -0.282 1
1 734 . 2 1 1 A 62 62 VAL HA H 62 3.650 3.970 -0.320 1
1 742 . 2 1 1 A 62 62 VAL C C 62 176.440 176.024 0.416 1
1 743 . 2 1 1 A 62 62 VAL CA C 62 64.930 64.423 0.507 1
1 744 . 2 1 1 A 62 62 VAL CB C 62 32.130 32.394 -0.264 1
1 747 . 2 1 1 A 62 62 VAL N N 62 132.840 129.180 3.660 1
1 748 . 2 1 1 A 63 63 GLN H H 63 7.470 7.125 0.345 1
1 749 . 2 1 1 A 63 63 GLN HA H 63 4.270 4.648 -0.378 1
1 756 . 2 1 1 A 63 63 GLN C C 63 172.290 173.377 -1.087 1
1 757 . 2 1 1 A 63 63 GLN CA C 63 56.640 55.452 1.188 1
1 758 . 2 1 1 A 63 63 GLN CB C 63 32.630 31.997 0.633 1
1 760 . 2 1 1 A 63 63 GLN N N 63 114.500 116.858 -2.358 1
1 762 . 2 1 1 A 64 64 ALA H H 64 8.200 8.699 -0.499 1
1 763 . 2 1 1 A 64 64 ALA HA H 64 4.830 5.307 -0.477 1
1 767 . 2 1 1 A 64 64 ALA C C 64 174.270 175.610 -1.340 1
1 768 . 2 1 1 A 64 64 ALA CA C 64 50.800 49.989 0.811 1
1 769 . 2 1 1 A 64 64 ALA CB C 64 20.100 21.637 -1.537 1
1 770 . 2 1 1 A 64 64 ALA N N 64 131.410 128.782 2.628 1
1 771 . 2 1 1 A 65 65 TYR H H 65 8.860 8.525 0.335 1
1 772 . 2 1 1 A 65 65 TYR HA H 65 4.540 4.968 -0.428 1
1 779 . 2 1 1 A 65 65 TYR CA C 65 54.270 55.030 -0.760 1
1 780 . 2 1 1 A 65 65 TYR CB C 65 41.360 40.403 0.957 1
1 785 . 2 1 1 A 65 65 TYR N N 65 124.140 120.174 3.966 1
1 786 . 2 1 1 A 66 66 PRO HA H 66 4.120 4.746 -0.626 1
1 793 . 2 1 1 A 66 66 PRO CA C 66 63.450 62.367 1.083 1
1 794 . 2 1 1 A 66 66 PRO CB C 66 34.170 32.766 1.404 1
1 797 . 2 1 1 A 67 67 SER H H 67 7.380 8.245 -0.865 1
1 798 . 2 1 1 A 67 67 SER HA H 67 4.720 5.025 -0.305 1
1 801 . 2 1 1 A 67 67 SER CA C 67 54.250 55.988 -1.738 1
1 802 . 2 1 1 A 67 67 SER CB C 67 64.530 63.941 0.589 1
1 803 . 2 1 1 A 67 67 SER N N 67 106.200 116.844 -10.644 1
1 804 . 2 1 1 A 68 68 PRO HA H 68 4.880 4.685 0.195 1
1 811 . 2 1 1 A 68 68 PRO CA C 68 62.990 62.469 0.521 1
1 812 . 2 1 1 A 68 68 PRO CB C 68 35.220 33.250 1.970 1
1 815 . 2 1 1 A 69 69 LEU H H 69 8.960 7.919 1.041 1
1 816 . 2 1 1 A 69 69 LEU HA H 69 4.430 5.115 -0.685 1
1 826 . 2 1 1 A 69 69 LEU C C 69 174.570 175.209 -0.639 1
1 827 . 2 1 1 A 69 69 LEU CA C 69 53.900 52.663 1.237 1
1 828 . 2 1 1 A 69 69 LEU CB C 69 44.210 46.093 -1.883 1
1 832 . 2 1 1 A 69 69 LEU N N 69 120.480 116.741 3.739 1
1 833 . 2 1 1 A 70 70 ARG H H 70 8.130 8.368 -0.238 1
1 834 . 2 1 1 A 70 70 ARG HA H 70 4.930 4.754 0.176 1
1 841 . 2 1 1 A 70 70 ARG C C 70 175.460 176.098 -0.638 1
1 842 . 2 1 1 A 70 70 ARG CA C 70 54.040 55.447 -1.407 1
1 843 . 2 1 1 A 70 70 ARG CB C 70 30.550 31.922 -1.372 1
1 846 . 2 1 1 A 70 70 ARG N N 70 125.180 119.656 5.524 1
1 847 . 2 1 1 A 71 71 VAL H H 71 8.450 8.232 0.218 1
1 848 . 2 1 1 A 71 71 VAL HA H 71 3.410 4.462 -1.052 1
1 856 . 2 1 1 A 71 71 VAL C C 71 175.460 175.500 -0.040 1
1 857 . 2 1 1 A 71 71 VAL CA C 71 65.210 62.177 3.033 1
1 858 . 2 1 1 A 71 71 VAL CB C 71 29.840 31.903 -2.063 1
1 861 . 2 1 1 A 71 71 VAL N N 71 128.170 122.513 5.657 1
1 862 . 2 1 1 A 72 72 GLU H H 72 8.620 8.582 0.038 1
1 863 . 2 1 1 A 72 72 GLU HA H 72 4.870 4.850 0.020 1
1 868 . 2 1 1 A 72 72 GLU C C 72 176.960 176.810 0.150 1
1 869 . 2 1 1 A 72 72 GLU CA C 72 54.330 54.435 -0.105 1
1 870 . 2 1 1 A 72 72 GLU CB C 72 33.280 33.092 0.188 1
1 872 . 2 1 1 A 72 72 GLU N N 72 127.670 126.817 0.853 1
1 873 . 2 1 1 A 73 73 ASP H H 73 8.700 9.036 -0.336 1
1 874 . 2 1 1 A 73 73 ASP HA H 73 4.150 4.368 -0.218 1
1 877 . 2 1 1 A 73 73 ASP C C 73 177.460 177.999 -0.539 1
1 878 . 2 1 1 A 73 73 ASP CA C 73 57.620 56.688 0.932 1
1 879 . 2 1 1 A 73 73 ASP CB C 73 40.360 39.820 0.540 1
1 880 . 2 1 1 A 73 73 ASP N N 73 121.140 123.910 -2.770 1
1 881 . 2 1 1 A 74 74 ARG H H 74 7.760 7.674 0.086 1
1 882 . 2 1 1 A 74 74 ARG HA H 74 4.280 4.352 -0.072 1
1 889 . 2 1 1 A 74 74 ARG C C 74 176.510 176.773 -0.263 1
1 890 . 2 1 1 A 74 74 ARG CA C 74 55.450 56.781 -1.331 1
1 891 . 2 1 1 A 74 74 ARG CB C 74 29.990 30.836 -0.846 1
1 894 . 2 1 1 A 74 74 ARG N N 74 112.890 117.034 -4.144 1
1 895 . 2 1 1 A 75 75 THR H H 75 7.700 7.386 0.314 1
1 896 . 2 1 1 A 75 75 THR HA H 75 4.020 4.237 -0.217 1
1 901 . 2 1 1 A 75 75 THR C C 75 173.810 174.017 -0.207 1
1 902 . 2 1 1 A 75 75 THR CA C 75 64.060 63.560 0.500 1
1 903 . 2 1 1 A 75 75 THR CB C 75 69.350 70.007 -0.657 1
1 905 . 2 1 1 A 75 75 THR N N 75 120.650 116.483 4.167 1
1 906 . 2 1 1 A 76 76 LYS H H 76 8.520 8.266 0.254 1
1 907 . 2 1 1 A 76 76 LYS HA H 76 4.270 4.690 -0.420 1
1 916 . 2 1 1 A 76 76 LYS C C 76 174.560 175.864 -1.304 1
1 917 . 2 1 1 A 76 76 LYS CA C 76 56.280 56.025 0.255 1
1 918 . 2 1 1 A 76 76 LYS CB C 76 33.120 33.617 -0.497 1
1 922 . 2 1 1 A 76 76 LYS N N 76 130.950 126.874 4.076 1
1 923 . 2 1 1 A 77 77 ILE H H 77 8.430 8.697 -0.267 1
1 924 . 2 1 1 A 77 77 ILE HA H 77 4.850 5.237 -0.387 1
1 934 . 2 1 1 A 77 77 ILE C C 77 174.650 174.854 -0.204 1
1 935 . 2 1 1 A 77 77 ILE CA C 77 59.820 60.188 -0.368 1
1 936 . 2 1 1 A 77 77 ILE CB C 77 38.280 40.856 -2.576 1
1 940 . 2 1 1 A 77 77 ILE N N 77 128.020 123.625 4.395 1
1 941 . 2 1 1 A 78 78 THR H H 78 8.870 8.800 0.070 1
1 942 . 2 1 1 A 78 78 THR HA H 78 4.470 5.096 -0.626 1
1 947 . 2 1 1 A 78 78 THR C C 78 172.760 173.320 -0.560 1
1 948 . 2 1 1 A 78 78 THR CA C 78 60.740 61.345 -0.605 1
1 949 . 2 1 1 A 78 78 THR CB C 78 71.320 71.557 -0.237 1
1 951 . 2 1 1 A 78 78 THR N N 78 123.870 124.116 -0.246 1
1 952 . 2 1 1 A 79 79 LEU H H 79 8.820 8.975 -0.155 1
1 953 . 2 1 1 A 79 79 LEU HA H 79 5.140 5.105 0.035 1
1 963 . 2 1 1 A 79 79 LEU C C 79 176.610 175.913 0.697 1
1 964 . 2 1 1 A 79 79 LEU CA C 79 53.280 53.331 -0.051 1
1 965 . 2 1 1 A 79 79 LEU CB C 79 42.600 42.951 -0.351 1
1 969 . 2 1 1 A 79 79 LEU N N 79 127.070 126.603 0.467 1
1 970 . 2 1 1 A 80 80 VAL H H 80 8.800 8.560 0.240 1
1 971 . 2 1 1 A 80 80 VAL HA H 80 4.260 4.724 -0.464 1
1 979 . 2 1 1 A 80 80 VAL CA C 80 61.350 61.737 -0.387 1
1 980 . 2 1 1 A 80 80 VAL CB C 80 32.790 32.786 0.004 1
1 983 . 2 1 1 A 80 80 VAL N N 80 124.120 125.606 -1.486 1
1 984 . 2 1 1 A 81 81 THR H H 81 8.160 8.795 -0.635 1
1 985 . 2 1 1 A 81 81 THR HA H 81 4.410 5.286 -0.876 1
1 990 . 2 1 1 A 81 81 THR CA C 81 60.800 60.180 0.620 1
1 991 . 2 1 1 A 81 81 THR CB C 81 69.650 72.476 -2.826 1
1 993 . 2 1 1 A 81 81 THR N N 81 114.500 116.788 -2.288 1
1 1 . 3 1 1 A 9 9 GLY H H 9 8.390 7.950 0.440 1
1 2 . 3 1 1 A 9 9 GLY HA2 H 9 3.900 4.078 -0.178 1
1 3 . 3 1 1 A 9 9 GLY HA3 H 9 3.860 4.079 -0.219 1
1 4 . 3 1 1 A 9 9 GLY CA C 9 45.150 45.999 -0.849 1
1 5 . 3 1 1 A 9 9 GLY N N 9 110.000 107.528 2.472 1
1 6 . 3 1 1 A 10 10 VAL H H 10 7.870 8.324 -0.454 1
1 7 . 3 1 1 A 10 10 VAL HA H 10 4.040 4.466 -0.426 1
1 15 . 3 1 1 A 10 10 VAL C C 10 175.880 175.206 0.674 1
1 16 . 3 1 1 A 10 10 VAL CA C 10 62.110 62.521 -0.411 1
1 17 . 3 1 1 A 10 10 VAL CB C 10 32.760 32.162 0.598 1
1 20 . 3 1 1 A 10 10 VAL N N 10 119.730 121.886 -2.156 1
1 21 . 3 1 1 A 11 11 ILE H H 11 8.230 9.089 -0.859 1
1 22 . 3 1 1 A 11 11 ILE HA H 11 4.090 4.655 -0.565 1
1 32 . 3 1 1 A 11 11 ILE C C 11 175.850 174.674 1.176 1
1 33 . 3 1 1 A 11 11 ILE CA C 11 60.800 59.800 1.000 1
1 34 . 3 1 1 A 11 11 ILE CB C 11 38.470 41.684 -3.214 1
1 38 . 3 1 1 A 11 11 ILE N N 11 125.570 128.436 -2.866 1
1 39 . 3 1 1 A 12 12 MET H H 12 8.370 8.829 -0.459 1
1 40 . 3 1 1 A 12 12 MET HA H 12 4.540 4.888 -0.348 1
1 48 . 3 1 1 A 12 12 MET C C 12 174.830 175.754 -0.924 1
1 49 . 3 1 1 A 12 12 MET CA C 12 54.790 54.293 0.497 1
1 50 . 3 1 1 A 12 12 MET CB C 12 32.640 33.477 -0.837 1
1 53 . 3 1 1 A 12 12 MET N N 12 125.930 126.245 -0.315 1
1 54 . 3 1 1 A 13 13 SER H H 13 7.990 8.665 -0.675 1
1 55 . 3 1 1 A 13 13 SER HA H 13 5.030 5.396 -0.366 1
1 58 . 3 1 1 A 13 13 SER C C 13 174.330 173.813 0.517 1
1 59 . 3 1 1 A 13 13 SER CA C 13 57.320 55.974 1.346 1
1 60 . 3 1 1 A 13 13 SER CB C 13 64.790 65.920 -1.130 1
1 61 . 3 1 1 A 13 13 SER N N 13 116.400 118.468 -2.068 1
1 62 . 3 1 1 A 14 14 GLU H H 14 9.430 8.635 0.795 1
1 63 . 3 1 1 A 14 14 GLU HA H 14 5.250 5.419 -0.169 1
1 68 . 3 1 1 A 14 14 GLU C C 14 172.980 174.785 -1.805 1
1 69 . 3 1 1 A 14 14 GLU CA C 14 55.390 55.128 0.262 1
1 70 . 3 1 1 A 14 14 GLU CB C 14 33.910 34.500 -0.590 1
1 72 . 3 1 1 A 14 14 GLU N N 14 123.670 119.963 3.707 1
1 73 . 3 1 1 A 15 15 LEU H H 15 8.930 8.899 0.031 1
1 74 . 3 1 1 A 15 15 LEU HA H 15 4.870 5.100 -0.230 1
1 84 . 3 1 1 A 15 15 LEU C C 15 174.000 174.564 -0.564 1
1 85 . 3 1 1 A 15 15 LEU CA C 15 53.020 53.819 -0.799 1
1 86 . 3 1 1 A 15 15 LEU CB C 15 46.040 45.850 0.190 1
1 90 . 3 1 1 A 15 15 LEU N N 15 125.350 125.670 -0.320 1
1 91 . 3 1 1 A 16 16 LYS H H 16 8.840 8.687 0.153 1
1 92 . 3 1 1 A 16 16 LYS HA H 16 5.360 4.974 0.386 1
1 101 . 3 1 1 A 16 16 LYS C C 16 175.660 175.718 -0.058 1
1 102 . 3 1 1 A 16 16 LYS CA C 16 54.940 55.101 -0.161 1
1 103 . 3 1 1 A 16 16 LYS CB C 16 34.280 34.543 -0.263 1
1 107 . 3 1 1 A 16 16 LYS N N 16 124.640 126.801 -2.161 1
1 108 . 3 1 1 A 17 17 LEU H H 17 8.820 8.756 0.064 1
1 109 . 3 1 1 A 17 17 LEU HA H 17 5.430 5.192 0.238 1
1 119 . 3 1 1 A 17 17 LEU C C 17 174.630 175.237 -0.607 1
1 120 . 3 1 1 A 17 17 LEU CA C 17 52.900 53.344 -0.444 1
1 121 . 3 1 1 A 17 17 LEU CB C 17 46.910 45.416 1.494 1
1 125 . 3 1 1 A 17 17 LEU N N 17 123.460 125.785 -2.325 1
1 126 . 3 1 1 A 18 18 LYS H H 18 9.110 8.638 0.472 1
1 127 . 3 1 1 A 18 18 LYS HA H 18 5.490 4.901 0.589 1
1 136 . 3 1 1 A 18 18 LYS CA C 18 52.270 52.853 -0.583 1
1 137 . 3 1 1 A 18 18 LYS CB C 18 37.500 35.432 2.068 1
1 141 . 3 1 1 A 18 18 LYS N N 18 122.230 123.972 -1.742 1
1 142 . 3 1 1 A 19 19 PRO HA H 19 4.100 4.918 -0.818 1
1 149 . 3 1 1 A 19 19 PRO CA C 19 62.440 62.815 -0.375 1
1 150 . 3 1 1 A 19 19 PRO CB C 19 30.640 32.417 -1.777 1
1 153 . 3 1 1 A 20 20 LEU H H 20 8.490 8.575 -0.085 1
1 154 . 3 1 1 A 20 20 LEU HA H 20 4.320 4.200 0.120 1
1 164 . 3 1 1 A 20 20 LEU CA C 20 57.680 58.778 -1.098 1
1 165 . 3 1 1 A 20 20 LEU CB C 20 38.760 40.563 -1.803 1
1 169 . 3 1 1 A 20 20 LEU N N 20 123.250 119.752 3.498 1
1 170 . 3 1 1 A 21 21 PRO HA H 21 4.530 4.553 -0.023 1
1 177 . 3 1 1 A 21 21 PRO CA C 21 62.880 62.601 0.279 1
1 178 . 3 1 1 A 21 21 PRO CB C 21 31.420 32.261 -0.841 1
1 181 . 3 1 1 A 22 22 LYS H H 22 8.180 8.379 -0.199 1
1 182 . 3 1 1 A 22 22 LYS HA H 22 4.110 4.528 -0.418 1
1 191 . 3 1 1 A 22 22 LYS C C 22 175.680 175.300 0.380 1
1 192 . 3 1 1 A 22 22 LYS CA C 22 56.210 55.703 0.507 1
1 193 . 3 1 1 A 22 22 LYS CB C 22 30.660 32.154 -1.494 1
1 197 . 3 1 1 A 22 22 LYS N N 22 119.160 121.796 -2.636 1
1 198 . 3 1 1 A 23 23 VAL H H 23 7.530 8.033 -0.503 1
1 199 . 3 1 1 A 23 23 VAL HA H 23 4.280 4.728 -0.448 1
1 207 . 3 1 1 A 23 23 VAL C C 23 173.690 173.458 0.232 1
1 208 . 3 1 1 A 23 23 VAL CA C 23 59.830 59.580 0.250 1
1 209 . 3 1 1 A 23 23 VAL CB C 23 34.550 35.584 -1.034 1
1 212 . 3 1 1 A 23 23 VAL N N 23 121.820 125.151 -3.331 1
1 213 . 3 1 1 A 24 24 GLU H H 24 8.270 8.790 -0.520 1
1 214 . 3 1 1 A 24 24 GLU HA H 24 4.330 4.756 -0.426 1
1 219 . 3 1 1 A 24 24 GLU C C 24 175.390 175.390 0.000 1
1 220 . 3 1 1 A 24 24 GLU CA C 24 55.220 55.267 -0.047 1
1 221 . 3 1 1 A 24 24 GLU CB C 24 29.970 31.250 -1.280 1
1 223 . 3 1 1 A 24 24 GLU N N 24 125.610 127.028 -1.418 1
1 224 . 3 1 1 A 25 25 LEU H H 25 8.480 8.690 -0.210 1
1 225 . 3 1 1 A 25 25 LEU HA H 25 4.520 4.410 0.110 1
1 235 . 3 1 1 A 25 25 LEU CA C 25 51.660 51.040 0.620 1
1 236 . 3 1 1 A 25 25 LEU CB C 25 41.750 41.608 0.142 1
1 240 . 3 1 1 A 25 25 LEU N N 25 125.880 126.798 -0.918 1
1 241 . 3 1 1 A 26 26 PRO HA H 26 4.760 4.661 0.099 1
1 248 . 3 1 1 A 26 26 PRO CA C 26 61.330 61.931 -0.601 1
1 249 . 3 1 1 A 26 26 PRO CB C 26 31.060 32.844 -1.784 1
1 252 . 3 1 1 A 27 27 PRO HA H 27 4.390 4.395 -0.005 1
1 259 . 3 1 1 A 27 27 PRO CA C 27 64.550 64.852 -0.302 1
1 260 . 3 1 1 A 27 27 PRO CB C 27 31.770 31.733 0.037 1
1 263 . 3 1 1 A 28 28 ASP H H 28 8.560 8.819 -0.259 1
1 264 . 3 1 1 A 28 28 ASP HA H 28 4.620 4.397 0.223 1
1 267 . 3 1 1 A 28 28 ASP C C 28 177.100 178.810 -1.710 1
1 268 . 3 1 1 A 28 28 ASP CA C 28 53.890 56.547 -2.657 1
1 269 . 3 1 1 A 28 28 ASP CB C 28 39.120 39.618 -0.498 1
1 270 . 3 1 1 A 28 28 ASP N N 28 115.820 117.830 -2.010 1
1 271 . 3 1 1 A 29 29 PHE H H 29 7.940 8.030 -0.090 1
1 272 . 3 1 1 A 29 29 PHE HA H 29 4.180 4.296 -0.116 1
1 280 . 3 1 1 A 29 29 PHE C C 29 176.740 178.289 -1.549 1
1 281 . 3 1 1 A 29 29 PHE CA C 29 61.020 60.931 0.089 1
1 282 . 3 1 1 A 29 29 PHE CB C 29 39.230 38.991 0.239 1
1 288 . 3 1 1 A 29 29 PHE N N 29 119.610 118.199 1.411 1
1 289 . 3 1 1 A 30 30 VAL H H 30 8.010 8.343 -0.333 1
1 290 . 3 1 1 A 30 30 VAL HA H 30 3.350 3.751 -0.401 1
1 298 . 3 1 1 A 30 30 VAL C C 30 176.400 177.145 -0.745 1
1 299 . 3 1 1 A 30 30 VAL CA C 30 66.510 64.809 1.701 1
1 300 . 3 1 1 A 30 30 VAL CB C 30 31.020 31.057 -0.037 1
1 303 . 3 1 1 A 30 30 VAL N N 30 116.370 119.432 -3.062 1
1 304 . 3 1 1 A 31 31 ASP H H 31 7.420 7.969 -0.549 1
1 305 . 3 1 1 A 31 31 ASP HA H 31 4.310 4.357 -0.047 1
1 308 . 3 1 1 A 31 31 ASP C C 31 178.360 178.906 -0.546 1
1 309 . 3 1 1 A 31 31 ASP CA C 31 57.110 57.117 -0.007 1
1 310 . 3 1 1 A 31 31 ASP CB C 31 40.450 40.824 -0.374 1
1 311 . 3 1 1 A 31 31 ASP N N 31 119.190 121.576 -2.386 1
1 312 . 3 1 1 A 32 32 VAL H H 32 7.190 7.560 -0.370 1
1 313 . 3 1 1 A 32 32 VAL HA H 32 3.510 3.563 -0.053 1
1 321 . 3 1 1 A 32 32 VAL C C 32 178.100 178.598 -0.498 1
1 322 . 3 1 1 A 32 32 VAL CA C 32 65.570 66.386 -0.816 1
1 323 . 3 1 1 A 32 32 VAL CB C 32 31.410 31.340 0.070 1
1 326 . 3 1 1 A 32 32 VAL N N 32 119.830 120.283 -0.453 1
1 327 . 3 1 1 A 33 33 ILE H H 33 7.660 8.482 -0.822 1
1 328 . 3 1 1 A 33 33 ILE HA H 33 3.170 3.581 -0.411 1
1 338 . 3 1 1 A 33 33 ILE C C 33 176.660 178.194 -1.534 1
1 339 . 3 1 1 A 33 33 ILE CA C 33 65.220 65.270 -0.050 1
1 340 . 3 1 1 A 33 33 ILE CB C 33 37.500 37.823 -0.323 1
1 344 . 3 1 1 A 33 33 ILE N N 33 118.490 120.930 -2.440 1
1 345 . 3 1 1 A 34 34 ARG H H 34 7.830 7.722 0.108 1
1 346 . 3 1 1 A 34 34 ARG HA H 34 3.380 3.933 -0.553 1
1 354 . 3 1 1 A 34 34 ARG C C 34 178.060 177.394 0.666 1
1 355 . 3 1 1 A 34 34 ARG CA C 34 60.570 58.964 1.606 1
1 356 . 3 1 1 A 34 34 ARG CB C 34 30.070 29.735 0.335 1
1 359 . 3 1 1 A 34 34 ARG N N 34 118.260 120.020 -1.760 1
1 361 . 3 1 1 A 35 35 ILE H H 35 7.350 7.881 -0.531 1
1 362 . 3 1 1 A 35 35 ILE HA H 35 3.720 3.715 0.005 1
1 372 . 3 1 1 A 35 35 ILE C C 35 179.090 178.087 1.003 1
1 373 . 3 1 1 A 35 35 ILE CA C 35 64.060 65.380 -1.320 1
1 374 . 3 1 1 A 35 35 ILE CB C 35 38.030 37.423 0.607 1
1 378 . 3 1 1 A 35 35 ILE N N 35 116.750 119.405 -2.655 1
1 379 . 3 1 1 A 36 36 LYS H H 36 7.880 7.696 0.184 1
1 380 . 3 1 1 A 36 36 LYS HA H 36 4.090 3.982 0.108 1
1 389 . 3 1 1 A 36 36 LYS C C 36 178.560 178.919 -0.359 1
1 390 . 3 1 1 A 36 36 LYS CA C 36 57.650 59.712 -2.062 1
1 391 . 3 1 1 A 36 36 LYS CB C 36 32.090 32.188 -0.098 1
1 395 . 3 1 1 A 36 36 LYS N N 36 118.700 119.846 -1.146 1
1 396 . 3 1 1 A 37 37 LEU H H 37 7.860 7.428 0.432 1
1 397 . 3 1 1 A 37 37 LEU HA H 37 4.230 4.310 -0.080 1
1 407 . 3 1 1 A 37 37 LEU C C 37 175.880 176.780 -0.900 1
1 408 . 3 1 1 A 37 37 LEU CA C 37 54.090 55.689 -1.599 1
1 409 . 3 1 1 A 37 37 LEU CB C 37 43.310 42.519 0.791 1
1 413 . 3 1 1 A 37 37 LEU N N 37 116.380 117.479 -1.099 1
1 414 . 3 1 1 A 38 38 GLN H H 38 7.190 7.539 -0.349 1
1 415 . 3 1 1 A 38 38 GLN HA H 38 3.530 4.404 -0.874 1
1 422 . 3 1 1 A 38 38 GLN C C 38 177.480 176.270 1.210 1
1 423 . 3 1 1 A 38 38 GLN CA C 38 58.370 56.742 1.628 1
1 424 . 3 1 1 A 38 38 GLN CB C 38 28.300 28.715 -0.415 1
1 426 . 3 1 1 A 38 38 GLN N N 38 119.210 117.680 1.530 1
1 428 . 3 1 1 A 39 39 GLY H H 39 8.940 8.819 0.121 1
1 429 . 3 1 1 A 39 39 GLY HA2 H 39 3.540 3.994 -0.454 1
1 430 . 3 1 1 A 39 39 GLY HA3 H 39 4.220 3.995 0.225 1
1 431 . 3 1 1 A 39 39 GLY C C 39 174.070 174.430 -0.360 1
1 432 . 3 1 1 A 39 39 GLY CA C 39 45.280 45.067 0.213 1
1 433 . 3 1 1 A 39 39 GLY N N 39 113.490 112.175 1.315 1
1 434 . 3 1 1 A 40 40 LYS H H 40 8.350 7.637 0.713 1
1 435 . 3 1 1 A 40 40 LYS HA H 40 4.400 4.600 -0.200 1
1 444 . 3 1 1 A 40 40 LYS C C 40 175.560 175.775 -0.215 1
1 445 . 3 1 1 A 40 40 LYS CA C 40 55.660 54.669 0.991 1
1 446 . 3 1 1 A 40 40 LYS CB C 40 32.870 33.757 -0.887 1
1 450 . 3 1 1 A 40 40 LYS N N 40 122.060 119.987 2.073 1
1 451 . 3 1 1 A 41 41 THR H H 41 8.410 8.576 -0.166 1
1 452 . 3 1 1 A 41 41 THR HA H 41 5.330 4.978 0.352 1
1 457 . 3 1 1 A 41 41 THR C C 41 174.860 174.380 0.480 1
1 458 . 3 1 1 A 41 41 THR CA C 41 62.040 61.665 0.375 1
1 459 . 3 1 1 A 41 41 THR CB C 41 69.420 70.891 -1.471 1
1 461 . 3 1 1 A 41 41 THR N N 41 118.150 117.437 0.713 1
1 462 . 3 1 1 A 42 42 VAL H H 42 9.140 9.173 -0.033 1
1 463 . 3 1 1 A 42 42 VAL HA H 42 4.570 5.003 -0.433 1
1 471 . 3 1 1 A 42 42 VAL C C 42 172.970 173.644 -0.674 1
1 472 . 3 1 1 A 42 42 VAL CA C 42 59.450 59.288 0.162 1
1 473 . 3 1 1 A 42 42 VAL CB C 42 35.880 35.251 0.629 1
1 476 . 3 1 1 A 42 42 VAL N N 42 122.510 120.652 1.858 1
1 477 . 3 1 1 A 43 43 ARG H H 43 8.420 8.726 -0.306 1
1 478 . 3 1 1 A 43 43 ARG HA H 43 4.750 4.957 -0.207 1
1 485 . 3 1 1 A 43 43 ARG C C 43 175.650 174.895 0.755 1
1 486 . 3 1 1 A 43 43 ARG CA C 43 53.650 54.051 -0.401 1
1 487 . 3 1 1 A 43 43 ARG CB C 43 33.870 33.967 -0.097 1
1 490 . 3 1 1 A 43 43 ARG N N 43 120.640 122.976 -2.336 1
1 491 . 3 1 1 A 44 44 THR H H 44 8.370 8.561 -0.191 1
1 492 . 3 1 1 A 44 44 THR HA H 44 3.410 3.759 -0.349 1
1 497 . 3 1 1 A 44 44 THR C C 44 175.020 175.809 -0.789 1
1 498 . 3 1 1 A 44 44 THR CA C 44 65.660 65.046 0.614 1
1 499 . 3 1 1 A 44 44 THR CB C 44 69.400 68.332 1.068 1
1 501 . 3 1 1 A 44 44 THR N N 44 118.590 119.313 -0.723 1
1 502 . 3 1 1 A 45 45 GLY H H 45 9.090 8.768 0.322 1
1 503 . 3 1 1 A 45 45 GLY HA2 H 45 3.470 4.015 -0.545 1
1 504 . 3 1 1 A 45 45 GLY HA3 H 45 4.470 4.017 0.453 1
1 505 . 3 1 1 A 45 45 GLY C C 45 174.350 173.840 0.510 1
1 506 . 3 1 1 A 45 45 GLY CA C 45 45.000 44.938 0.062 1
1 507 . 3 1 1 A 45 45 GLY N N 45 117.350 115.012 2.338 1
1 508 . 3 1 1 A 46 46 ASP H H 46 8.010 7.875 0.135 1
1 509 . 3 1 1 A 46 46 ASP HA H 46 4.470 4.623 -0.153 1
1 512 . 3 1 1 A 46 46 ASP C C 46 174.570 174.462 0.108 1
1 513 . 3 1 1 A 46 46 ASP CA C 46 55.570 55.430 0.140 1
1 514 . 3 1 1 A 46 46 ASP CB C 46 41.680 41.552 0.128 1
1 515 . 3 1 1 A 46 46 ASP N N 46 122.240 122.240 0.000 1
1 516 . 3 1 1 A 47 47 VAL H H 47 8.330 8.420 -0.090 1
1 517 . 3 1 1 A 47 47 VAL HA H 47 4.950 4.949 0.001 1
1 525 . 3 1 1 A 47 47 VAL C C 47 176.330 175.386 0.944 1
1 526 . 3 1 1 A 47 47 VAL CA C 47 61.710 60.942 0.768 1
1 527 . 3 1 1 A 47 47 VAL CB C 47 32.900 34.858 -1.958 1
1 530 . 3 1 1 A 47 47 VAL N N 47 119.860 121.808 -1.948 1
1 531 . 3 1 1 A 48 48 ILE H H 48 9.160 8.685 0.475 1
1 532 . 3 1 1 A 48 48 ILE HA H 48 4.630 5.127 -0.497 1
1 542 . 3 1 1 A 48 48 ILE C C 48 174.400 174.356 0.044 1
1 543 . 3 1 1 A 48 48 ILE CA C 48 58.990 59.248 -0.258 1
1 544 . 3 1 1 A 48 48 ILE CB C 48 41.810 42.358 -0.548 1
1 548 . 3 1 1 A 48 48 ILE N N 48 124.990 121.610 3.380 1
1 549 . 3 1 1 A 49 49 GLY H H 49 8.660 8.944 -0.284 1
1 550 . 3 1 1 A 49 49 GLY HA2 H 49 4.950 4.188 0.762 1
1 551 . 3 1 1 A 49 49 GLY HA3 H 49 3.620 4.230 -0.610 1
1 552 . 3 1 1 A 49 49 GLY C C 49 172.920 172.006 0.914 1
1 553 . 3 1 1 A 49 49 GLY CA C 49 44.580 44.360 0.220 1
1 554 . 3 1 1 A 49 49 GLY N N 49 112.060 109.805 2.255 1
1 555 . 3 1 1 A 50 50 ILE H H 50 8.810 8.825 -0.015 1
1 556 . 3 1 1 A 50 50 ILE HA H 50 4.370 4.747 -0.377 1
1 566 . 3 1 1 A 50 50 ILE C C 50 174.500 174.724 -0.224 1
1 567 . 3 1 1 A 50 50 ILE CA C 50 59.550 59.886 -0.336 1
1 568 . 3 1 1 A 50 50 ILE CB C 50 41.300 41.759 -0.459 1
1 572 . 3 1 1 A 50 50 ILE N N 50 123.220 125.253 -2.033 1
1 573 . 3 1 1 A 51 51 SER H H 51 8.540 9.053 -0.513 1
1 574 . 3 1 1 A 51 51 SER HA H 51 4.830 5.092 -0.262 1
1 577 . 3 1 1 A 51 51 SER C C 51 174.130 173.888 0.242 1
1 578 . 3 1 1 A 51 51 SER CA C 51 57.770 56.705 1.065 1
1 579 . 3 1 1 A 51 51 SER CB C 51 63.040 64.563 -1.523 1
1 580 . 3 1 1 A 51 51 SER N N 51 121.430 121.521 -0.091 1
1 581 . 3 1 1 A 52 52 ILE H H 52 8.930 8.744 0.186 1
1 582 . 3 1 1 A 52 52 ILE HA H 52 4.290 4.593 -0.303 1
1 592 . 3 1 1 A 52 52 ILE C C 52 175.280 175.974 -0.694 1
1 593 . 3 1 1 A 52 52 ILE CA C 52 60.250 60.169 0.081 1
1 594 . 3 1 1 A 52 52 ILE CB C 52 39.840 40.517 -0.677 1
1 598 . 3 1 1 A 52 52 ILE N N 52 127.060 124.931 2.129 1
1 599 . 3 1 1 A 53 53 LEU H H 53 9.380 9.428 -0.048 1
1 600 . 3 1 1 A 53 53 LEU HA H 53 3.890 4.067 -0.177 1
1 610 . 3 1 1 A 53 53 LEU C C 53 177.130 176.982 0.148 1
1 611 . 3 1 1 A 53 53 LEU CA C 53 55.560 56.183 -0.623 1
1 612 . 3 1 1 A 53 53 LEU CB C 53 39.370 40.634 -1.264 1
1 616 . 3 1 1 A 53 53 LEU N N 53 126.770 129.494 -2.724 1
1 617 . 3 1 1 A 54 54 GLY H H 54 8.310 8.687 -0.377 1
1 618 . 3 1 1 A 54 54 GLY HA2 H 54 3.490 3.889 -0.399 1
1 619 . 3 1 1 A 54 54 GLY HA3 H 54 4.080 3.890 0.190 1
1 620 . 3 1 1 A 54 54 GLY C C 54 173.690 173.918 -0.228 1
1 621 . 3 1 1 A 54 54 GLY CA C 54 45.340 45.744 -0.404 1
1 622 . 3 1 1 A 54 54 GLY N N 54 103.820 104.343 -0.523 1
1 623 . 3 1 1 A 55 55 LYS H H 55 7.730 7.650 0.080 1
1 624 . 3 1 1 A 55 55 LYS HA H 55 4.560 4.861 -0.301 1
1 633 . 3 1 1 A 55 55 LYS C C 55 174.550 175.106 -0.556 1
1 634 . 3 1 1 A 55 55 LYS CA C 55 54.140 55.175 -1.035 1
1 635 . 3 1 1 A 55 55 LYS CB C 55 34.620 35.644 -1.024 1
1 639 . 3 1 1 A 55 55 LYS N N 55 121.160 120.112 1.048 1
1 640 . 3 1 1 A 56 56 GLU H H 56 8.490 8.878 -0.388 1
1 641 . 3 1 1 A 56 56 GLU HA H 56 4.280 4.630 -0.350 1
1 646 . 3 1 1 A 56 56 GLU C C 56 175.730 175.149 0.581 1
1 647 . 3 1 1 A 56 56 GLU CA C 56 56.730 56.340 0.390 1
1 648 . 3 1 1 A 56 56 GLU CB C 56 30.070 30.738 -0.668 1
1 650 . 3 1 1 A 56 56 GLU N N 56 124.090 128.659 -4.569 1
1 651 . 3 1 1 A 57 57 VAL H H 57 8.920 8.319 0.601 1
1 652 . 3 1 1 A 57 57 VAL HA H 57 4.030 4.745 -0.715 1
1 660 . 3 1 1 A 57 57 VAL C C 57 174.610 173.332 1.278 1
1 661 . 3 1 1 A 57 57 VAL CA C 57 61.680 59.483 2.197 1
1 662 . 3 1 1 A 57 57 VAL CB C 57 33.880 34.417 -0.537 1
1 665 . 3 1 1 A 57 57 VAL N N 57 129.960 126.223 3.737 1
1 666 . 3 1 1 A 58 58 LYS H H 58 7.860 8.584 -0.724 1
1 667 . 3 1 1 A 58 58 LYS HA H 58 5.120 4.593 0.527 1
1 676 . 3 1 1 A 58 58 LYS C C 58 175.380 175.762 -0.382 1
1 677 . 3 1 1 A 58 58 LYS CA C 58 55.200 54.652 0.548 1
1 678 . 3 1 1 A 58 58 LYS CB C 58 34.670 33.953 0.717 1
1 682 . 3 1 1 A 58 58 LYS N N 58 124.790 127.180 -2.390 1
1 683 . 3 1 1 A 59 59 PHE H H 59 9.270 8.925 0.345 1
1 684 . 3 1 1 A 59 59 PHE HA H 59 4.960 5.085 -0.125 1
1 692 . 3 1 1 A 59 59 PHE C C 59 173.950 174.438 -0.488 1
1 693 . 3 1 1 A 59 59 PHE CA C 59 55.910 56.189 -0.279 1
1 694 . 3 1 1 A 59 59 PHE CB C 59 42.950 42.081 0.869 1
1 700 . 3 1 1 A 59 59 PHE N N 59 118.270 122.845 -4.575 1
1 701 . 3 1 1 A 60 60 LYS H H 60 9.170 8.891 0.279 1
1 702 . 3 1 1 A 60 60 LYS HA H 60 4.910 4.915 -0.005 1
1 711 . 3 1 1 A 60 60 LYS C C 60 176.230 175.905 0.325 1
1 712 . 3 1 1 A 60 60 LYS CA C 60 53.910 54.604 -0.694 1
1 713 . 3 1 1 A 60 60 LYS CB C 60 35.170 34.692 0.478 1
1 717 . 3 1 1 A 60 60 LYS N N 60 121.960 124.410 -2.450 1
1 718 . 3 1 1 A 61 61 VAL H H 61 9.400 8.859 0.541 1
1 719 . 3 1 1 A 61 61 VAL HA H 61 4.170 3.999 0.171 1
1 727 . 3 1 1 A 61 61 VAL C C 61 175.500 175.389 0.111 1
1 728 . 3 1 1 A 61 61 VAL CA C 61 61.980 63.420 -1.440 1
1 729 . 3 1 1 A 61 61 VAL CB C 61 29.490 31.115 -1.625 1
1 732 . 3 1 1 A 61 61 VAL N N 61 127.140 127.084 0.056 1
1 733 . 3 1 1 A 62 62 VAL H H 62 8.390 8.599 -0.209 1
1 734 . 3 1 1 A 62 62 VAL HA H 62 3.650 3.959 -0.309 1
1 742 . 3 1 1 A 62 62 VAL C C 62 176.440 176.048 0.392 1
1 743 . 3 1 1 A 62 62 VAL CA C 62 64.930 64.408 0.522 1
1 744 . 3 1 1 A 62 62 VAL CB C 62 32.130 32.416 -0.286 1
1 747 . 3 1 1 A 62 62 VAL N N 62 132.840 129.453 3.387 1
1 748 . 3 1 1 A 63 63 GLN H H 63 7.470 7.092 0.378 1
1 749 . 3 1 1 A 63 63 GLN HA H 63 4.270 4.442 -0.172 1
1 756 . 3 1 1 A 63 63 GLN C C 63 172.290 173.348 -1.058 1
1 757 . 3 1 1 A 63 63 GLN CA C 63 56.640 55.438 1.202 1
1 758 . 3 1 1 A 63 63 GLN CB C 63 32.630 31.897 0.733 1
1 760 . 3 1 1 A 63 63 GLN N N 63 114.500 116.866 -2.366 1
1 762 . 3 1 1 A 64 64 ALA H H 64 8.200 8.284 -0.084 1
1 763 . 3 1 1 A 64 64 ALA HA H 64 4.830 5.293 -0.463 1
1 767 . 3 1 1 A 64 64 ALA C C 64 174.270 175.664 -1.394 1
1 768 . 3 1 1 A 64 64 ALA CA C 64 50.800 49.960 0.840 1
1 769 . 3 1 1 A 64 64 ALA CB C 64 20.100 21.684 -1.584 1
1 770 . 3 1 1 A 64 64 ALA N N 64 131.410 128.794 2.616 1
1 771 . 3 1 1 A 65 65 TYR H H 65 8.860 8.530 0.330 1
1 772 . 3 1 1 A 65 65 TYR HA H 65 4.540 4.966 -0.426 1
1 779 . 3 1 1 A 65 65 TYR CA C 65 54.270 55.030 -0.760 1
1 780 . 3 1 1 A 65 65 TYR CB C 65 41.360 40.435 0.925 1
1 785 . 3 1 1 A 65 65 TYR N N 65 124.140 119.978 4.162 1
1 786 . 3 1 1 A 66 66 PRO HA H 66 4.120 4.769 -0.649 1
1 793 . 3 1 1 A 66 66 PRO CA C 66 63.450 62.357 1.093 1
1 794 . 3 1 1 A 66 66 PRO CB C 66 34.170 32.755 1.415 1
1 797 . 3 1 1 A 67 67 SER H H 67 7.380 8.243 -0.863 1
1 798 . 3 1 1 A 67 67 SER HA H 67 4.720 4.976 -0.256 1
1 801 . 3 1 1 A 67 67 SER CA C 67 54.250 56.057 -1.807 1
1 802 . 3 1 1 A 67 67 SER CB C 67 64.530 63.753 0.777 1
1 803 . 3 1 1 A 67 67 SER N N 67 106.200 116.681 -10.481 1
1 804 . 3 1 1 A 68 68 PRO HA H 68 4.880 4.629 0.251 1
1 811 . 3 1 1 A 68 68 PRO CA C 68 62.990 62.502 0.488 1
1 812 . 3 1 1 A 68 68 PRO CB C 68 35.220 33.165 2.055 1
1 815 . 3 1 1 A 69 69 LEU H H 69 8.960 8.034 0.926 1
1 816 . 3 1 1 A 69 69 LEU HA H 69 4.430 5.115 -0.685 1
1 826 . 3 1 1 A 69 69 LEU C C 69 174.570 175.294 -0.724 1
1 827 . 3 1 1 A 69 69 LEU CA C 69 53.900 52.630 1.270 1
1 828 . 3 1 1 A 69 69 LEU CB C 69 44.210 46.094 -1.884 1
1 832 . 3 1 1 A 69 69 LEU N N 69 120.480 117.110 3.370 1
1 833 . 3 1 1 A 70 70 ARG H H 70 8.130 8.378 -0.248 1
1 834 . 3 1 1 A 70 70 ARG HA H 70 4.930 4.764 0.166 1
1 841 . 3 1 1 A 70 70 ARG C C 70 175.460 176.237 -0.777 1
1 842 . 3 1 1 A 70 70 ARG CA C 70 54.040 55.682 -1.642 1
1 843 . 3 1 1 A 70 70 ARG CB C 70 30.550 31.701 -1.151 1
1 846 . 3 1 1 A 70 70 ARG N N 70 125.180 119.852 5.328 1
1 847 . 3 1 1 A 71 71 VAL H H 71 8.450 8.248 0.202 1
1 848 . 3 1 1 A 71 71 VAL HA H 71 3.410 4.442 -1.032 1
1 856 . 3 1 1 A 71 71 VAL C C 71 175.460 175.469 -0.009 1
1 857 . 3 1 1 A 71 71 VAL CA C 71 65.210 62.343 2.867 1
1 858 . 3 1 1 A 71 71 VAL CB C 71 29.840 31.492 -1.652 1
1 861 . 3 1 1 A 71 71 VAL N N 71 128.170 122.765 5.405 1
1 862 . 3 1 1 A 72 72 GLU H H 72 8.620 8.588 0.032 1
1 863 . 3 1 1 A 72 72 GLU HA H 72 4.870 4.838 0.032 1
1 868 . 3 1 1 A 72 72 GLU C C 72 176.960 175.837 1.123 1
1 869 . 3 1 1 A 72 72 GLU CA C 72 54.330 54.444 -0.114 1
1 870 . 3 1 1 A 72 72 GLU CB C 72 33.280 33.271 0.009 1
1 872 . 3 1 1 A 72 72 GLU N N 72 127.670 126.939 0.731 1
1 873 . 3 1 1 A 73 73 ASP H H 73 8.700 8.962 -0.262 1
1 874 . 3 1 1 A 73 73 ASP HA H 73 4.150 4.267 -0.117 1
1 877 . 3 1 1 A 73 73 ASP C C 73 177.460 177.649 -0.189 1
1 878 . 3 1 1 A 73 73 ASP CA C 73 57.620 56.725 0.895 1
1 879 . 3 1 1 A 73 73 ASP CB C 73 40.360 40.523 -0.163 1
1 880 . 3 1 1 A 73 73 ASP N N 73 121.140 124.174 -3.034 1
1 881 . 3 1 1 A 74 74 ARG H H 74 7.760 8.224 -0.464 1
1 882 . 3 1 1 A 74 74 ARG HA H 74 4.280 4.292 -0.012 1
1 889 . 3 1 1 A 74 74 ARG C C 74 176.510 176.481 0.029 1
1 890 . 3 1 1 A 74 74 ARG CA C 74 55.450 57.650 -2.200 1
1 891 . 3 1 1 A 74 74 ARG CB C 74 29.990 29.867 0.123 1
1 894 . 3 1 1 A 74 74 ARG N N 74 112.890 115.603 -2.713 1
1 895 . 3 1 1 A 75 75 THR H H 75 7.700 7.477 0.223 1
1 896 . 3 1 1 A 75 75 THR HA H 75 4.020 4.353 -0.333 1
1 901 . 3 1 1 A 75 75 THR C C 75 173.810 173.883 -0.073 1
1 902 . 3 1 1 A 75 75 THR CA C 75 64.060 63.808 0.252 1
1 903 . 3 1 1 A 75 75 THR CB C 75 69.350 69.436 -0.086 1
1 905 . 3 1 1 A 75 75 THR N N 75 120.650 116.517 4.133 1
1 906 . 3 1 1 A 76 76 LYS H H 76 8.520 8.232 0.288 1
1 907 . 3 1 1 A 76 76 LYS HA H 76 4.270 4.683 -0.413 1
1 916 . 3 1 1 A 76 76 LYS C C 76 174.560 175.710 -1.150 1
1 917 . 3 1 1 A 76 76 LYS CA C 76 56.280 55.782 0.498 1
1 918 . 3 1 1 A 76 76 LYS CB C 76 33.120 33.728 -0.608 1
1 922 . 3 1 1 A 76 76 LYS N N 76 130.950 127.155 3.795 1
1 923 . 3 1 1 A 77 77 ILE H H 77 8.430 8.614 -0.184 1
1 924 . 3 1 1 A 77 77 ILE HA H 77 4.850 5.226 -0.376 1
1 934 . 3 1 1 A 77 77 ILE C C 77 174.650 175.123 -0.473 1
1 935 . 3 1 1 A 77 77 ILE CA C 77 59.820 60.004 -0.184 1
1 936 . 3 1 1 A 77 77 ILE CB C 77 38.280 41.025 -2.745 1
1 940 . 3 1 1 A 77 77 ILE N N 77 128.020 122.579 5.441 1
1 941 . 3 1 1 A 78 78 THR H H 78 8.870 8.738 0.132 1
1 942 . 3 1 1 A 78 78 THR HA H 78 4.470 5.105 -0.635 1
1 947 . 3 1 1 A 78 78 THR C C 78 172.760 173.182 -0.422 1
1 948 . 3 1 1 A 78 78 THR CA C 78 60.740 61.339 -0.599 1
1 949 . 3 1 1 A 78 78 THR CB C 78 71.320 71.798 -0.478 1
1 951 . 3 1 1 A 78 78 THR N N 78 123.870 123.657 0.213 1
1 952 . 3 1 1 A 79 79 LEU H H 79 8.820 8.923 -0.103 1
1 953 . 3 1 1 A 79 79 LEU HA H 79 5.140 5.030 0.110 1
1 963 . 3 1 1 A 79 79 LEU C C 79 176.610 176.071 0.539 1
1 964 . 3 1 1 A 79 79 LEU CA C 79 53.280 53.314 -0.034 1
1 965 . 3 1 1 A 79 79 LEU CB C 79 42.600 43.136 -0.536 1
1 969 . 3 1 1 A 79 79 LEU N N 79 127.070 126.471 0.599 1
1 970 . 3 1 1 A 80 80 VAL H H 80 8.800 8.894 -0.094 1
1 971 . 3 1 1 A 80 80 VAL HA H 80 4.260 4.445 -0.185 1
1 979 . 3 1 1 A 80 80 VAL CA C 80 61.350 61.831 -0.481 1
1 980 . 3 1 1 A 80 80 VAL CB C 80 32.790 32.875 -0.085 1
1 983 . 3 1 1 A 80 80 VAL N N 80 124.120 124.375 -0.255 1
1 984 . 3 1 1 A 81 81 THR H H 81 8.160 8.731 -0.571 1
1 985 . 3 1 1 A 81 81 THR HA H 81 4.410 4.492 -0.082 1
1 990 . 3 1 1 A 81 81 THR CA C 81 60.800 62.079 -1.279 1
1 991 . 3 1 1 A 81 81 THR CB C 81 69.650 70.190 -0.540 1
1 993 . 3 1 1 A 81 81 THR N N 81 114.500 115.461 -0.961 1
1 1 . 4 1 1 A 9 9 GLY H H 9 8.390 8.470 -0.080 1
1 2 . 4 1 1 A 9 9 GLY HA2 H 9 3.900 4.063 -0.163 1
1 3 . 4 1 1 A 9 9 GLY HA3 H 9 3.860 4.063 -0.203 1
1 4 . 4 1 1 A 9 9 GLY CA C 9 45.150 44.317 0.833 1
1 5 . 4 1 1 A 9 9 GLY N N 9 110.000 110.374 -0.374 1
1 6 . 4 1 1 A 10 10 VAL H H 10 7.870 8.318 -0.448 1
1 7 . 4 1 1 A 10 10 VAL HA H 10 4.040 4.725 -0.685 1
1 15 . 4 1 1 A 10 10 VAL C C 10 175.880 174.589 1.291 1
1 16 . 4 1 1 A 10 10 VAL CA C 10 62.110 60.560 1.550 1
1 17 . 4 1 1 A 10 10 VAL CB C 10 32.760 36.031 -3.271 1
1 20 . 4 1 1 A 10 10 VAL N N 10 119.730 119.654 0.076 1
1 21 . 4 1 1 A 11 11 ILE H H 11 8.230 8.810 -0.580 1
1 22 . 4 1 1 A 11 11 ILE HA H 11 4.090 4.768 -0.678 1
1 32 . 4 1 1 A 11 11 ILE C C 11 175.850 175.073 0.777 1
1 33 . 4 1 1 A 11 11 ILE CA C 11 60.800 59.949 0.851 1
1 34 . 4 1 1 A 11 11 ILE CB C 11 38.470 38.840 -0.370 1
1 38 . 4 1 1 A 11 11 ILE N N 11 125.570 127.150 -1.580 1
1 39 . 4 1 1 A 12 12 MET H H 12 8.370 8.684 -0.314 1
1 40 . 4 1 1 A 12 12 MET HA H 12 4.540 4.941 -0.401 1
1 48 . 4 1 1 A 12 12 MET C C 12 174.830 175.812 -0.982 1
1 49 . 4 1 1 A 12 12 MET CA C 12 54.790 54.117 0.673 1
1 50 . 4 1 1 A 12 12 MET CB C 12 32.640 33.567 -0.927 1
1 53 . 4 1 1 A 12 12 MET N N 12 125.930 127.607 -1.677 1
1 54 . 4 1 1 A 13 13 SER H H 13 7.990 8.739 -0.749 1
1 55 . 4 1 1 A 13 13 SER HA H 13 5.030 5.457 -0.427 1
1 58 . 4 1 1 A 13 13 SER C C 13 174.330 173.324 1.006 1
1 59 . 4 1 1 A 13 13 SER CA C 13 57.320 56.182 1.138 1
1 60 . 4 1 1 A 13 13 SER CB C 13 64.790 65.879 -1.089 1
1 61 . 4 1 1 A 13 13 SER N N 13 116.400 118.239 -1.839 1
1 62 . 4 1 1 A 14 14 GLU H H 14 9.430 8.694 0.736 1
1 63 . 4 1 1 A 14 14 GLU HA H 14 5.250 5.133 0.117 1
1 68 . 4 1 1 A 14 14 GLU C C 14 172.980 174.009 -1.029 1
1 69 . 4 1 1 A 14 14 GLU CA C 14 55.390 55.380 0.010 1
1 70 . 4 1 1 A 14 14 GLU CB C 14 33.910 34.272 -0.362 1
1 72 . 4 1 1 A 14 14 GLU N N 14 123.670 122.254 1.416 1
1 73 . 4 1 1 A 15 15 LEU H H 15 8.930 8.912 0.018 1
1 74 . 4 1 1 A 15 15 LEU HA H 15 4.870 5.169 -0.299 1
1 84 . 4 1 1 A 15 15 LEU C C 15 174.000 174.401 -0.401 1
1 85 . 4 1 1 A 15 15 LEU CA C 15 53.020 53.772 -0.752 1
1 86 . 4 1 1 A 15 15 LEU CB C 15 46.040 46.186 -0.146 1
1 90 . 4 1 1 A 15 15 LEU N N 15 125.350 126.169 -0.819 1
1 91 . 4 1 1 A 16 16 LYS H H 16 8.840 8.715 0.125 1
1 92 . 4 1 1 A 16 16 LYS HA H 16 5.360 4.902 0.458 1
1 101 . 4 1 1 A 16 16 LYS C C 16 175.660 175.346 0.314 1
1 102 . 4 1 1 A 16 16 LYS CA C 16 54.940 55.624 -0.684 1
1 103 . 4 1 1 A 16 16 LYS CB C 16 34.280 33.729 0.551 1
1 107 . 4 1 1 A 16 16 LYS N N 16 124.640 126.907 -2.267 1
1 108 . 4 1 1 A 17 17 LEU H H 17 8.820 9.038 -0.218 1
1 109 . 4 1 1 A 17 17 LEU HA H 17 5.430 5.246 0.184 1
1 119 . 4 1 1 A 17 17 LEU C C 17 174.630 175.684 -1.054 1
1 120 . 4 1 1 A 17 17 LEU CA C 17 52.900 53.470 -0.570 1
1 121 . 4 1 1 A 17 17 LEU CB C 17 46.910 45.371 1.539 1
1 125 . 4 1 1 A 17 17 LEU N N 17 123.460 126.835 -3.375 1
1 126 . 4 1 1 A 18 18 LYS H H 18 9.110 8.679 0.431 1
1 127 . 4 1 1 A 18 18 LYS HA H 18 5.490 4.994 0.496 1
1 136 . 4 1 1 A 18 18 LYS CA C 18 52.270 52.990 -0.720 1
1 137 . 4 1 1 A 18 18 LYS CB C 18 37.500 36.386 1.114 1
1 141 . 4 1 1 A 18 18 LYS N N 18 122.230 123.254 -1.024 1
1 142 . 4 1 1 A 19 19 PRO HA H 19 4.100 4.433 -0.333 1
1 149 . 4 1 1 A 19 19 PRO CA C 19 62.440 62.443 -0.003 1
1 150 . 4 1 1 A 19 19 PRO CB C 19 30.640 32.281 -1.641 1
1 153 . 4 1 1 A 20 20 LEU H H 20 8.490 8.400 0.090 1
1 154 . 4 1 1 A 20 20 LEU HA H 20 4.320 4.231 0.089 1
1 164 . 4 1 1 A 20 20 LEU CA C 20 57.680 58.705 -1.025 1
1 165 . 4 1 1 A 20 20 LEU CB C 20 38.760 41.034 -2.274 1
1 169 . 4 1 1 A 20 20 LEU N N 20 123.250 119.595 3.655 1
1 170 . 4 1 1 A 21 21 PRO HA H 21 4.530 4.544 -0.014 1
1 177 . 4 1 1 A 21 21 PRO CA C 21 62.880 62.556 0.324 1
1 178 . 4 1 1 A 21 21 PRO CB C 21 31.420 32.264 -0.844 1
1 181 . 4 1 1 A 22 22 LYS H H 22 8.180 8.420 -0.240 1
1 182 . 4 1 1 A 22 22 LYS HA H 22 4.110 4.417 -0.307 1
1 191 . 4 1 1 A 22 22 LYS C C 22 175.680 175.465 0.215 1
1 192 . 4 1 1 A 22 22 LYS CA C 22 56.210 55.767 0.443 1
1 193 . 4 1 1 A 22 22 LYS CB C 22 30.660 31.894 -1.234 1
1 197 . 4 1 1 A 22 22 LYS N N 22 119.160 121.933 -2.773 1
1 198 . 4 1 1 A 23 23 VAL H H 23 7.530 8.025 -0.495 1
1 199 . 4 1 1 A 23 23 VAL HA H 23 4.280 4.753 -0.473 1
1 207 . 4 1 1 A 23 23 VAL C C 23 173.690 173.438 0.252 1
1 208 . 4 1 1 A 23 23 VAL CA C 23 59.830 59.540 0.290 1
1 209 . 4 1 1 A 23 23 VAL CB C 23 34.550 35.514 -0.964 1
1 212 . 4 1 1 A 23 23 VAL N N 23 121.820 122.852 -1.032 1
1 213 . 4 1 1 A 24 24 GLU H H 24 8.270 8.921 -0.651 1
1 214 . 4 1 1 A 24 24 GLU HA H 24 4.330 4.890 -0.560 1
1 219 . 4 1 1 A 24 24 GLU C C 24 175.390 175.283 0.107 1
1 220 . 4 1 1 A 24 24 GLU CA C 24 55.220 55.060 0.160 1
1 221 . 4 1 1 A 24 24 GLU CB C 24 29.970 31.538 -1.568 1
1 223 . 4 1 1 A 24 24 GLU N N 24 125.610 126.930 -1.320 1
1 224 . 4 1 1 A 25 25 LEU H H 25 8.480 8.749 -0.269 1
1 225 . 4 1 1 A 25 25 LEU HA H 25 4.520 4.423 0.097 1
1 235 . 4 1 1 A 25 25 LEU CA C 25 51.660 51.783 -0.123 1
1 236 . 4 1 1 A 25 25 LEU CB C 25 41.750 40.916 0.834 1
1 240 . 4 1 1 A 25 25 LEU N N 25 125.880 126.378 -0.498 1
1 241 . 4 1 1 A 26 26 PRO HA H 26 4.760 4.612 0.148 1
1 248 . 4 1 1 A 26 26 PRO CA C 26 61.330 61.888 -0.558 1
1 249 . 4 1 1 A 26 26 PRO CB C 26 31.060 32.829 -1.769 1
1 252 . 4 1 1 A 27 27 PRO HA H 27 4.390 4.417 -0.027 1
1 259 . 4 1 1 A 27 27 PRO CA C 27 64.550 64.841 -0.291 1
1 260 . 4 1 1 A 27 27 PRO CB C 27 31.770 31.739 0.031 1
1 263 . 4 1 1 A 28 28 ASP H H 28 8.560 8.798 -0.238 1
1 264 . 4 1 1 A 28 28 ASP HA H 28 4.620 4.433 0.187 1
1 267 . 4 1 1 A 28 28 ASP C C 28 177.100 178.763 -1.663 1
1 268 . 4 1 1 A 28 28 ASP CA C 28 53.890 56.251 -2.361 1
1 269 . 4 1 1 A 28 28 ASP CB C 28 39.120 39.634 -0.514 1
1 270 . 4 1 1 A 28 28 ASP N N 28 115.820 117.979 -2.159 1
1 271 . 4 1 1 A 29 29 PHE H H 29 7.940 7.888 0.052 1
1 272 . 4 1 1 A 29 29 PHE HA H 29 4.180 4.338 -0.158 1
1 280 . 4 1 1 A 29 29 PHE C C 29 176.740 178.217 -1.477 1
1 281 . 4 1 1 A 29 29 PHE CA C 29 61.020 61.129 -0.109 1
1 282 . 4 1 1 A 29 29 PHE CB C 29 39.230 38.558 0.672 1
1 288 . 4 1 1 A 29 29 PHE N N 29 119.610 118.278 1.332 1
1 289 . 4 1 1 A 30 30 VAL H H 30 8.010 8.445 -0.435 1
1 290 . 4 1 1 A 30 30 VAL HA H 30 3.350 3.774 -0.424 1
1 298 . 4 1 1 A 30 30 VAL C C 30 176.400 177.277 -0.877 1
1 299 . 4 1 1 A 30 30 VAL CA C 30 66.510 64.814 1.696 1
1 300 . 4 1 1 A 30 30 VAL CB C 30 31.020 31.056 -0.036 1
1 303 . 4 1 1 A 30 30 VAL N N 30 116.370 119.430 -3.060 1
1 304 . 4 1 1 A 31 31 ASP H H 31 7.420 8.137 -0.717 1
1 305 . 4 1 1 A 31 31 ASP HA H 31 4.310 4.366 -0.056 1
1 308 . 4 1 1 A 31 31 ASP C C 31 178.360 178.591 -0.231 1
1 309 . 4 1 1 A 31 31 ASP CA C 31 57.110 57.445 -0.335 1
1 310 . 4 1 1 A 31 31 ASP CB C 31 40.450 41.123 -0.673 1
1 311 . 4 1 1 A 31 31 ASP N N 31 119.190 121.624 -2.434 1
1 312 . 4 1 1 A 32 32 VAL H H 32 7.190 7.372 -0.182 1
1 313 . 4 1 1 A 32 32 VAL HA H 32 3.510 3.538 -0.028 1
1 321 . 4 1 1 A 32 32 VAL C C 32 178.100 178.492 -0.392 1
1 322 . 4 1 1 A 32 32 VAL CA C 32 65.570 66.370 -0.800 1
1 323 . 4 1 1 A 32 32 VAL CB C 32 31.410 31.278 0.132 1
1 326 . 4 1 1 A 32 32 VAL N N 32 119.830 119.114 0.716 1
1 327 . 4 1 1 A 33 33 ILE H H 33 7.660 8.442 -0.782 1
1 328 . 4 1 1 A 33 33 ILE HA H 33 3.170 3.514 -0.344 1
1 338 . 4 1 1 A 33 33 ILE C C 33 176.660 178.143 -1.483 1
1 339 . 4 1 1 A 33 33 ILE CA C 33 65.220 65.185 0.035 1
1 340 . 4 1 1 A 33 33 ILE CB C 33 37.500 37.654 -0.154 1
1 344 . 4 1 1 A 33 33 ILE N N 33 118.490 120.812 -2.322 1
1 345 . 4 1 1 A 34 34 ARG H H 34 7.830 7.728 0.102 1
1 346 . 4 1 1 A 34 34 ARG HA H 34 3.380 3.896 -0.516 1
1 354 . 4 1 1 A 34 34 ARG C C 34 178.060 177.868 0.192 1
1 355 . 4 1 1 A 34 34 ARG CA C 34 60.570 59.055 1.515 1
1 356 . 4 1 1 A 34 34 ARG CB C 34 30.070 29.831 0.239 1
1 359 . 4 1 1 A 34 34 ARG N N 34 118.260 119.947 -1.687 1
1 361 . 4 1 1 A 35 35 ILE H H 35 7.350 7.800 -0.450 1
1 362 . 4 1 1 A 35 35 ILE HA H 35 3.720 3.712 0.008 1
1 372 . 4 1 1 A 35 35 ILE C C 35 179.090 178.002 1.088 1
1 373 . 4 1 1 A 35 35 ILE CA C 35 64.060 65.332 -1.272 1
1 374 . 4 1 1 A 35 35 ILE CB C 35 38.030 37.665 0.365 1
1 378 . 4 1 1 A 35 35 ILE N N 35 116.750 119.387 -2.637 1
1 379 . 4 1 1 A 36 36 LYS H H 36 7.880 7.564 0.316 1
1 380 . 4 1 1 A 36 36 LYS HA H 36 4.090 3.981 0.109 1
1 389 . 4 1 1 A 36 36 LYS C C 36 178.560 178.881 -0.321 1
1 390 . 4 1 1 A 36 36 LYS CA C 36 57.650 59.753 -2.103 1
1 391 . 4 1 1 A 36 36 LYS CB C 36 32.090 32.255 -0.165 1
1 395 . 4 1 1 A 36 36 LYS N N 36 118.700 119.647 -0.947 1
1 396 . 4 1 1 A 37 37 LEU H H 37 7.860 7.415 0.445 1
1 397 . 4 1 1 A 37 37 LEU HA H 37 4.230 4.273 -0.043 1
1 407 . 4 1 1 A 37 37 LEU C C 37 175.880 176.773 -0.893 1
1 408 . 4 1 1 A 37 37 LEU CA C 37 54.090 55.712 -1.622 1
1 409 . 4 1 1 A 37 37 LEU CB C 37 43.310 42.604 0.706 1
1 413 . 4 1 1 A 37 37 LEU N N 37 116.380 117.306 -0.926 1
1 414 . 4 1 1 A 38 38 GLN H H 38 7.190 7.545 -0.355 1
1 415 . 4 1 1 A 38 38 GLN HA H 38 3.530 4.474 -0.944 1
1 422 . 4 1 1 A 38 38 GLN C C 38 177.480 176.263 1.217 1
1 423 . 4 1 1 A 38 38 GLN CA C 38 58.370 56.728 1.642 1
1 424 . 4 1 1 A 38 38 GLN CB C 38 28.300 28.723 -0.423 1
1 426 . 4 1 1 A 38 38 GLN N N 38 119.210 117.634 1.576 1
1 428 . 4 1 1 A 39 39 GLY H H 39 8.940 8.870 0.070 1
1 429 . 4 1 1 A 39 39 GLY HA2 H 39 3.540 3.987 -0.447 1
1 430 . 4 1 1 A 39 39 GLY HA3 H 39 4.220 3.988 0.232 1
1 431 . 4 1 1 A 39 39 GLY C C 39 174.070 174.423 -0.353 1
1 432 . 4 1 1 A 39 39 GLY CA C 39 45.280 45.062 0.218 1
1 433 . 4 1 1 A 39 39 GLY N N 39 113.490 112.159 1.331 1
1 434 . 4 1 1 A 40 40 LYS H H 40 8.350 7.602 0.748 1
1 435 . 4 1 1 A 40 40 LYS HA H 40 4.400 4.606 -0.206 1
1 444 . 4 1 1 A 40 40 LYS C C 40 175.560 175.771 -0.211 1
1 445 . 4 1 1 A 40 40 LYS CA C 40 55.660 54.633 1.027 1
1 446 . 4 1 1 A 40 40 LYS CB C 40 32.870 33.764 -0.894 1
1 450 . 4 1 1 A 40 40 LYS N N 40 122.060 119.988 2.072 1
1 451 . 4 1 1 A 41 41 THR H H 41 8.410 8.561 -0.151 1
1 452 . 4 1 1 A 41 41 THR HA H 41 5.330 5.051 0.279 1
1 457 . 4 1 1 A 41 41 THR C C 41 174.860 174.478 0.382 1
1 458 . 4 1 1 A 41 41 THR CA C 41 62.040 61.661 0.379 1
1 459 . 4 1 1 A 41 41 THR CB C 41 69.420 70.872 -1.452 1
1 461 . 4 1 1 A 41 41 THR N N 41 118.150 117.326 0.824 1
1 462 . 4 1 1 A 42 42 VAL H H 42 9.140 9.098 0.042 1
1 463 . 4 1 1 A 42 42 VAL HA H 42 4.570 5.056 -0.486 1
1 471 . 4 1 1 A 42 42 VAL C C 42 172.970 174.307 -1.337 1
1 472 . 4 1 1 A 42 42 VAL CA C 42 59.450 59.102 0.348 1
1 473 . 4 1 1 A 42 42 VAL CB C 42 35.880 35.610 0.270 1
1 476 . 4 1 1 A 42 42 VAL N N 42 122.510 120.209 2.301 1
1 477 . 4 1 1 A 43 43 ARG H H 43 8.420 8.655 -0.235 1
1 478 . 4 1 1 A 43 43 ARG HA H 43 4.750 4.871 -0.121 1
1 485 . 4 1 1 A 43 43 ARG C C 43 175.650 175.806 -0.156 1
1 486 . 4 1 1 A 43 43 ARG CA C 43 53.650 53.840 -0.190 1
1 487 . 4 1 1 A 43 43 ARG CB C 43 33.870 34.083 -0.213 1
1 490 . 4 1 1 A 43 43 ARG N N 43 120.640 122.823 -2.183 1
1 491 . 4 1 1 A 44 44 THR H H 44 8.370 8.563 -0.193 1
1 492 . 4 1 1 A 44 44 THR HA H 44 3.410 3.761 -0.351 1
1 497 . 4 1 1 A 44 44 THR C C 44 175.020 175.813 -0.793 1
1 498 . 4 1 1 A 44 44 THR CA C 44 65.660 65.015 0.645 1
1 499 . 4 1 1 A 44 44 THR CB C 44 69.400 68.334 1.066 1
1 501 . 4 1 1 A 44 44 THR N N 44 118.590 117.548 1.042 1
1 502 . 4 1 1 A 45 45 GLY H H 45 9.090 8.759 0.331 1
1 503 . 4 1 1 A 45 45 GLY HA2 H 45 3.470 4.016 -0.546 1
1 504 . 4 1 1 A 45 45 GLY HA3 H 45 4.470 4.020 0.450 1
1 505 . 4 1 1 A 45 45 GLY C C 45 174.350 173.843 0.507 1
1 506 . 4 1 1 A 45 45 GLY CA C 45 45.000 44.942 0.058 1
1 507 . 4 1 1 A 45 45 GLY N N 45 117.350 114.963 2.387 1
1 508 . 4 1 1 A 46 46 ASP H H 46 8.010 7.885 0.125 1
1 509 . 4 1 1 A 46 46 ASP HA H 46 4.470 4.624 -0.154 1
1 512 . 4 1 1 A 46 46 ASP C C 46 174.570 174.445 0.125 1
1 513 . 4 1 1 A 46 46 ASP CA C 46 55.570 55.424 0.146 1
1 514 . 4 1 1 A 46 46 ASP CB C 46 41.680 41.483 0.197 1
1 515 . 4 1 1 A 46 46 ASP N N 46 122.240 122.227 0.013 1
1 516 . 4 1 1 A 47 47 VAL H H 47 8.330 8.499 -0.169 1
1 517 . 4 1 1 A 47 47 VAL HA H 47 4.950 4.931 0.019 1
1 525 . 4 1 1 A 47 47 VAL C C 47 176.330 175.475 0.855 1
1 526 . 4 1 1 A 47 47 VAL CA C 47 61.710 60.871 0.839 1
1 527 . 4 1 1 A 47 47 VAL CB C 47 32.900 35.355 -2.455 1
1 530 . 4 1 1 A 47 47 VAL N N 47 119.860 121.797 -1.937 1
1 531 . 4 1 1 A 48 48 ILE H H 48 9.160 8.696 0.464 1
1 532 . 4 1 1 A 48 48 ILE HA H 48 4.630 5.144 -0.514 1
1 542 . 4 1 1 A 48 48 ILE C C 48 174.400 174.462 -0.062 1
1 543 . 4 1 1 A 48 48 ILE CA C 48 58.990 59.286 -0.296 1
1 544 . 4 1 1 A 48 48 ILE CB C 48 41.810 42.177 -0.367 1
1 548 . 4 1 1 A 48 48 ILE N N 48 124.990 121.480 3.510 1
1 549 . 4 1 1 A 49 49 GLY H H 49 8.660 8.965 -0.305 1
1 550 . 4 1 1 A 49 49 GLY HA2 H 49 4.950 4.307 0.643 1
1 551 . 4 1 1 A 49 49 GLY HA3 H 49 3.620 4.349 -0.729 1
1 552 . 4 1 1 A 49 49 GLY C C 49 172.920 171.939 0.981 1
1 553 . 4 1 1 A 49 49 GLY CA C 49 44.580 44.426 0.154 1
1 554 . 4 1 1 A 49 49 GLY N N 49 112.060 109.395 2.665 1
1 555 . 4 1 1 A 50 50 ILE H H 50 8.810 9.119 -0.309 1
1 556 . 4 1 1 A 50 50 ILE HA H 50 4.370 4.821 -0.451 1
1 566 . 4 1 1 A 50 50 ILE C C 50 174.500 174.640 -0.140 1
1 567 . 4 1 1 A 50 50 ILE CA C 50 59.550 59.861 -0.311 1
1 568 . 4 1 1 A 50 50 ILE CB C 50 41.300 41.398 -0.098 1
1 572 . 4 1 1 A 50 50 ILE N N 50 123.220 125.392 -2.172 1
1 573 . 4 1 1 A 51 51 SER H H 51 8.540 8.836 -0.296 1
1 574 . 4 1 1 A 51 51 SER HA H 51 4.830 4.994 -0.164 1
1 577 . 4 1 1 A 51 51 SER C C 51 174.130 173.866 0.264 1
1 578 . 4 1 1 A 51 51 SER CA C 51 57.770 57.063 0.707 1
1 579 . 4 1 1 A 51 51 SER CB C 51 63.040 64.180 -1.140 1
1 580 . 4 1 1 A 51 51 SER N N 51 121.430 122.526 -1.096 1
1 581 . 4 1 1 A 52 52 ILE H H 52 8.930 8.688 0.242 1
1 582 . 4 1 1 A 52 52 ILE HA H 52 4.290 4.592 -0.302 1
1 592 . 4 1 1 A 52 52 ILE C C 52 175.280 176.011 -0.731 1
1 593 . 4 1 1 A 52 52 ILE CA C 52 60.250 60.218 0.032 1
1 594 . 4 1 1 A 52 52 ILE CB C 52 39.840 40.522 -0.682 1
1 598 . 4 1 1 A 52 52 ILE N N 52 127.060 127.861 -0.801 1
1 599 . 4 1 1 A 53 53 LEU H H 53 9.380 9.453 -0.073 1
1 600 . 4 1 1 A 53 53 LEU HA H 53 3.890 4.086 -0.196 1
1 610 . 4 1 1 A 53 53 LEU C C 53 177.130 176.988 0.142 1
1 611 . 4 1 1 A 53 53 LEU CA C 53 55.560 56.197 -0.637 1
1 612 . 4 1 1 A 53 53 LEU CB C 53 39.370 40.651 -1.281 1
1 616 . 4 1 1 A 53 53 LEU N N 53 126.770 129.575 -2.805 1
1 617 . 4 1 1 A 54 54 GLY H H 54 8.310 8.698 -0.388 1
1 618 . 4 1 1 A 54 54 GLY HA2 H 54 3.490 3.903 -0.413 1
1 619 . 4 1 1 A 54 54 GLY HA3 H 54 4.080 3.904 0.176 1
1 620 . 4 1 1 A 54 54 GLY C C 54 173.690 173.986 -0.296 1
1 621 . 4 1 1 A 54 54 GLY CA C 54 45.340 45.713 -0.373 1
1 622 . 4 1 1 A 54 54 GLY N N 54 103.820 104.390 -0.570 1
1 623 . 4 1 1 A 55 55 LYS H H 55 7.730 7.759 -0.029 1
1 624 . 4 1 1 A 55 55 LYS HA H 55 4.560 4.924 -0.364 1
1 633 . 4 1 1 A 55 55 LYS C C 55 174.550 174.936 -0.386 1
1 634 . 4 1 1 A 55 55 LYS CA C 55 54.140 54.895 -0.755 1
1 635 . 4 1 1 A 55 55 LYS CB C 55 34.620 35.675 -1.055 1
1 639 . 4 1 1 A 55 55 LYS N N 55 121.160 120.183 0.977 1
1 640 . 4 1 1 A 56 56 GLU H H 56 8.490 8.777 -0.287 1
1 641 . 4 1 1 A 56 56 GLU HA H 56 4.280 4.697 -0.417 1
1 646 . 4 1 1 A 56 56 GLU C C 56 175.730 175.208 0.522 1
1 647 . 4 1 1 A 56 56 GLU CA C 56 56.730 56.323 0.407 1
1 648 . 4 1 1 A 56 56 GLU CB C 56 30.070 30.729 -0.659 1
1 650 . 4 1 1 A 56 56 GLU N N 56 124.090 128.135 -4.045 1
1 651 . 4 1 1 A 57 57 VAL H H 57 8.920 8.458 0.462 1
1 652 . 4 1 1 A 57 57 VAL HA H 57 4.030 4.811 -0.781 1
1 660 . 4 1 1 A 57 57 VAL C C 57 174.610 173.734 0.876 1
1 661 . 4 1 1 A 57 57 VAL CA C 57 61.680 59.554 2.126 1
1 662 . 4 1 1 A 57 57 VAL CB C 57 33.880 34.461 -0.581 1
1 665 . 4 1 1 A 57 57 VAL N N 57 129.960 126.555 3.405 1
1 666 . 4 1 1 A 58 58 LYS H H 58 7.860 8.742 -0.882 1
1 667 . 4 1 1 A 58 58 LYS HA H 58 5.120 4.833 0.287 1
1 676 . 4 1 1 A 58 58 LYS C C 58 175.380 175.691 -0.311 1
1 677 . 4 1 1 A 58 58 LYS CA C 58 55.200 54.726 0.474 1
1 678 . 4 1 1 A 58 58 LYS CB C 58 34.670 34.126 0.544 1
1 682 . 4 1 1 A 58 58 LYS N N 58 124.790 127.366 -2.576 1
1 683 . 4 1 1 A 59 59 PHE H H 59 9.270 9.107 0.163 1
1 684 . 4 1 1 A 59 59 PHE HA H 59 4.960 5.092 -0.132 1
1 692 . 4 1 1 A 59 59 PHE C C 59 173.950 174.330 -0.380 1
1 693 . 4 1 1 A 59 59 PHE CA C 59 55.910 56.303 -0.393 1
1 694 . 4 1 1 A 59 59 PHE CB C 59 42.950 42.010 0.940 1
1 700 . 4 1 1 A 59 59 PHE N N 59 118.270 122.854 -4.584 1
1 701 . 4 1 1 A 60 60 LYS H H 60 9.170 8.911 0.259 1
1 702 . 4 1 1 A 60 60 LYS HA H 60 4.910 5.005 -0.095 1
1 711 . 4 1 1 A 60 60 LYS C C 60 176.230 175.848 0.382 1
1 712 . 4 1 1 A 60 60 LYS CA C 60 53.910 54.635 -0.725 1
1 713 . 4 1 1 A 60 60 LYS CB C 60 35.170 35.021 0.149 1
1 717 . 4 1 1 A 60 60 LYS N N 60 121.960 124.340 -2.380 1
1 718 . 4 1 1 A 61 61 VAL H H 61 9.400 8.821 0.579 1
1 719 . 4 1 1 A 61 61 VAL HA H 61 4.170 4.089 0.081 1
1 727 . 4 1 1 A 61 61 VAL C C 61 175.500 175.366 0.134 1
1 728 . 4 1 1 A 61 61 VAL CA C 61 61.980 63.152 -1.172 1
1 729 . 4 1 1 A 61 61 VAL CB C 61 29.490 31.194 -1.704 1
1 732 . 4 1 1 A 61 61 VAL N N 61 127.140 126.960 0.180 1
1 733 . 4 1 1 A 62 62 VAL H H 62 8.390 8.730 -0.340 1
1 734 . 4 1 1 A 62 62 VAL HA H 62 3.650 3.972 -0.322 1
1 742 . 4 1 1 A 62 62 VAL C C 62 176.440 176.022 0.418 1
1 743 . 4 1 1 A 62 62 VAL CA C 62 64.930 64.432 0.498 1
1 744 . 4 1 1 A 62 62 VAL CB C 62 32.130 32.415 -0.285 1
1 747 . 4 1 1 A 62 62 VAL N N 62 132.840 129.210 3.630 1
1 748 . 4 1 1 A 63 63 GLN H H 63 7.470 7.136 0.334 1
1 749 . 4 1 1 A 63 63 GLN HA H 63 4.270 4.641 -0.371 1
1 756 . 4 1 1 A 63 63 GLN C C 63 172.290 173.348 -1.058 1
1 757 . 4 1 1 A 63 63 GLN CA C 63 56.640 55.469 1.171 1
1 758 . 4 1 1 A 63 63 GLN CB C 63 32.630 31.996 0.634 1
1 760 . 4 1 1 A 63 63 GLN N N 63 114.500 116.827 -2.327 1
1 762 . 4 1 1 A 64 64 ALA H H 64 8.200 8.663 -0.463 1
1 763 . 4 1 1 A 64 64 ALA HA H 64 4.830 5.323 -0.493 1
1 767 . 4 1 1 A 64 64 ALA C C 64 174.270 175.695 -1.425 1
1 768 . 4 1 1 A 64 64 ALA CA C 64 50.800 49.980 0.820 1
1 769 . 4 1 1 A 64 64 ALA CB C 64 20.100 21.690 -1.590 1
1 770 . 4 1 1 A 64 64 ALA N N 64 131.410 128.768 2.642 1
1 771 . 4 1 1 A 65 65 TYR H H 65 8.860 8.531 0.329 1
1 772 . 4 1 1 A 65 65 TYR HA H 65 4.540 4.959 -0.419 1
1 779 . 4 1 1 A 65 65 TYR CA C 65 54.270 55.158 -0.888 1
1 780 . 4 1 1 A 65 65 TYR CB C 65 41.360 40.694 0.666 1
1 785 . 4 1 1 A 65 65 TYR N N 65 124.140 119.966 4.174 1
1 786 . 4 1 1 A 66 66 PRO HA H 66 4.120 4.752 -0.632 1
1 793 . 4 1 1 A 66 66 PRO CA C 66 63.450 62.370 1.080 1
1 794 . 4 1 1 A 66 66 PRO CB C 66 34.170 32.817 1.353 1
1 797 . 4 1 1 A 67 67 SER H H 67 7.380 8.272 -0.892 1
1 798 . 4 1 1 A 67 67 SER HA H 67 4.720 4.978 -0.258 1
1 801 . 4 1 1 A 67 67 SER CA C 67 54.250 56.034 -1.784 1
1 802 . 4 1 1 A 67 67 SER CB C 67 64.530 63.920 0.610 1
1 803 . 4 1 1 A 67 67 SER N N 67 106.200 116.699 -10.499 1
1 804 . 4 1 1 A 68 68 PRO HA H 68 4.880 4.672 0.208 1
1 811 . 4 1 1 A 68 68 PRO CA C 68 62.990 62.468 0.522 1
1 812 . 4 1 1 A 68 68 PRO CB C 68 35.220 33.286 1.934 1
1 815 . 4 1 1 A 69 69 LEU H H 69 8.960 7.915 1.045 1
1 816 . 4 1 1 A 69 69 LEU HA H 69 4.430 5.077 -0.647 1
1 826 . 4 1 1 A 69 69 LEU C C 69 174.570 175.254 -0.684 1
1 827 . 4 1 1 A 69 69 LEU CA C 69 53.900 52.664 1.236 1
1 828 . 4 1 1 A 69 69 LEU CB C 69 44.210 45.911 -1.701 1
1 832 . 4 1 1 A 69 69 LEU N N 69 120.480 117.150 3.330 1
1 833 . 4 1 1 A 70 70 ARG H H 70 8.130 8.366 -0.236 1
1 834 . 4 1 1 A 70 70 ARG HA H 70 4.930 4.816 0.114 1
1 841 . 4 1 1 A 70 70 ARG C C 70 175.460 176.125 -0.665 1
1 842 . 4 1 1 A 70 70 ARG CA C 70 54.040 55.487 -1.447 1
1 843 . 4 1 1 A 70 70 ARG CB C 70 30.550 31.915 -1.365 1
1 846 . 4 1 1 A 70 70 ARG N N 70 125.180 119.654 5.526 1
1 847 . 4 1 1 A 71 71 VAL H H 71 8.450 8.202 0.248 1
1 848 . 4 1 1 A 71 71 VAL HA H 71 3.410 4.432 -1.022 1
1 856 . 4 1 1 A 71 71 VAL C C 71 175.460 175.500 -0.040 1
1 857 . 4 1 1 A 71 71 VAL CA C 71 65.210 62.182 3.028 1
1 858 . 4 1 1 A 71 71 VAL CB C 71 29.840 31.987 -2.147 1
1 861 . 4 1 1 A 71 71 VAL N N 71 128.170 122.629 5.541 1
1 862 . 4 1 1 A 72 72 GLU H H 72 8.620 8.425 0.195 1
1 863 . 4 1 1 A 72 72 GLU HA H 72 4.870 4.849 0.021 1
1 868 . 4 1 1 A 72 72 GLU C C 72 176.960 176.295 0.665 1
1 869 . 4 1 1 A 72 72 GLU CA C 72 54.330 54.434 -0.104 1
1 870 . 4 1 1 A 72 72 GLU CB C 72 33.280 33.091 0.189 1
1 872 . 4 1 1 A 72 72 GLU N N 72 127.670 126.674 0.996 1
1 873 . 4 1 1 A 73 73 ASP H H 73 8.700 8.841 -0.141 1
1 874 . 4 1 1 A 73 73 ASP HA H 73 4.150 4.278 -0.128 1
1 877 . 4 1 1 A 73 73 ASP C C 73 177.460 177.769 -0.309 1
1 878 . 4 1 1 A 73 73 ASP CA C 73 57.620 57.297 0.323 1
1 879 . 4 1 1 A 73 73 ASP CB C 73 40.360 40.430 -0.070 1
1 880 . 4 1 1 A 73 73 ASP N N 73 121.140 126.996 -5.856 1
1 881 . 4 1 1 A 74 74 ARG H H 74 7.760 7.722 0.038 1
1 882 . 4 1 1 A 74 74 ARG HA H 74 4.280 4.351 -0.071 1
1 889 . 4 1 1 A 74 74 ARG C C 74 176.510 176.781 -0.271 1
1 890 . 4 1 1 A 74 74 ARG CA C 74 55.450 56.865 -1.415 1
1 891 . 4 1 1 A 74 74 ARG CB C 74 29.990 30.836 -0.846 1
1 894 . 4 1 1 A 74 74 ARG N N 74 112.890 116.309 -3.419 1
1 895 . 4 1 1 A 75 75 THR H H 75 7.700 7.389 0.311 1
1 896 . 4 1 1 A 75 75 THR HA H 75 4.020 4.257 -0.237 1
1 901 . 4 1 1 A 75 75 THR C C 75 173.810 174.005 -0.195 1
1 902 . 4 1 1 A 75 75 THR CA C 75 64.060 63.565 0.495 1
1 903 . 4 1 1 A 75 75 THR CB C 75 69.350 70.002 -0.652 1
1 905 . 4 1 1 A 75 75 THR N N 75 120.650 116.653 3.997 1
1 906 . 4 1 1 A 76 76 LYS H H 76 8.520 8.235 0.285 1
1 907 . 4 1 1 A 76 76 LYS HA H 76 4.270 4.686 -0.416 1
1 916 . 4 1 1 A 76 76 LYS C C 76 174.560 175.846 -1.286 1
1 917 . 4 1 1 A 76 76 LYS CA C 76 56.280 55.971 0.309 1
1 918 . 4 1 1 A 76 76 LYS CB C 76 33.120 33.568 -0.448 1
1 922 . 4 1 1 A 76 76 LYS N N 76 130.950 126.899 4.051 1
1 923 . 4 1 1 A 77 77 ILE H H 77 8.430 8.747 -0.317 1
1 924 . 4 1 1 A 77 77 ILE HA H 77 4.850 5.187 -0.337 1
1 934 . 4 1 1 A 77 77 ILE C C 77 174.650 174.915 -0.265 1
1 935 . 4 1 1 A 77 77 ILE CA C 77 59.820 60.105 -0.285 1
1 936 . 4 1 1 A 77 77 ILE CB C 77 38.280 40.924 -2.644 1
1 940 . 4 1 1 A 77 77 ILE N N 77 128.020 123.580 4.440 1
1 941 . 4 1 1 A 78 78 THR H H 78 8.870 8.794 0.076 1
1 942 . 4 1 1 A 78 78 THR HA H 78 4.470 5.112 -0.642 1
1 947 . 4 1 1 A 78 78 THR C C 78 172.760 173.465 -0.705 1
1 948 . 4 1 1 A 78 78 THR CA C 78 60.740 61.390 -0.650 1
1 949 . 4 1 1 A 78 78 THR CB C 78 71.320 71.541 -0.221 1
1 951 . 4 1 1 A 78 78 THR N N 78 123.870 124.214 -0.344 1
1 952 . 4 1 1 A 79 79 LEU H H 79 8.820 8.965 -0.145 1
1 953 . 4 1 1 A 79 79 LEU HA H 79 5.140 5.060 0.080 1
1 963 . 4 1 1 A 79 79 LEU C C 79 176.610 175.942 0.668 1
1 964 . 4 1 1 A 79 79 LEU CA C 79 53.280 53.392 -0.112 1
1 965 . 4 1 1 A 79 79 LEU CB C 79 42.600 42.797 -0.197 1
1 969 . 4 1 1 A 79 79 LEU N N 79 127.070 126.547 0.523 1
1 970 . 4 1 1 A 80 80 VAL H H 80 8.800 8.534 0.266 1
1 971 . 4 1 1 A 80 80 VAL HA H 80 4.260 4.672 -0.412 1
1 979 . 4 1 1 A 80 80 VAL CA C 80 61.350 61.734 -0.384 1
1 980 . 4 1 1 A 80 80 VAL CB C 80 32.790 32.748 0.042 1
1 983 . 4 1 1 A 80 80 VAL N N 80 124.120 125.476 -1.356 1
1 984 . 4 1 1 A 81 81 THR H H 81 8.160 8.879 -0.719 1
1 985 . 4 1 1 A 81 81 THR HA H 81 4.410 5.199 -0.789 1
1 990 . 4 1 1 A 81 81 THR CA C 81 60.800 59.938 0.862 1
1 991 . 4 1 1 A 81 81 THR CB C 81 69.650 72.357 -2.707 1
1 993 . 4 1 1 A 81 81 THR N N 81 114.500 116.715 -2.215 1
1 1 . 5 1 1 A 9 9 GLY H H 9 8.390 8.407 -0.017 1
1 2 . 5 1 1 A 9 9 GLY HA2 H 9 3.900 4.066 -0.166 1
1 3 . 5 1 1 A 9 9 GLY HA3 H 9 3.860 4.066 -0.206 1
1 4 . 5 1 1 A 9 9 GLY CA C 9 45.150 44.404 0.746 1
1 5 . 5 1 1 A 9 9 GLY N N 9 110.000 111.921 -1.921 1
1 6 . 5 1 1 A 10 10 VAL H H 10 7.870 8.473 -0.603 1
1 7 . 5 1 1 A 10 10 VAL HA H 10 4.040 4.738 -0.698 1
1 15 . 5 1 1 A 10 10 VAL C C 10 175.880 174.757 1.123 1
1 16 . 5 1 1 A 10 10 VAL CA C 10 62.110 60.735 1.375 1
1 17 . 5 1 1 A 10 10 VAL CB C 10 32.760 35.662 -2.902 1
1 20 . 5 1 1 A 10 10 VAL N N 10 119.730 119.313 0.417 1
1 21 . 5 1 1 A 11 11 ILE H H 11 8.230 8.884 -0.654 1
1 22 . 5 1 1 A 11 11 ILE HA H 11 4.090 4.686 -0.596 1
1 32 . 5 1 1 A 11 11 ILE C C 11 175.850 174.710 1.140 1
1 33 . 5 1 1 A 11 11 ILE CA C 11 60.800 60.011 0.789 1
1 34 . 5 1 1 A 11 11 ILE CB C 11 38.470 40.237 -1.767 1
1 38 . 5 1 1 A 11 11 ILE N N 11 125.570 126.976 -1.406 1
1 39 . 5 1 1 A 12 12 MET H H 12 8.370 8.840 -0.470 1
1 40 . 5 1 1 A 12 12 MET HA H 12 4.540 4.860 -0.320 1
1 48 . 5 1 1 A 12 12 MET C C 12 174.830 175.781 -0.951 1
1 49 . 5 1 1 A 12 12 MET CA C 12 54.790 54.323 0.467 1
1 50 . 5 1 1 A 12 12 MET CB C 12 32.640 33.400 -0.760 1
1 53 . 5 1 1 A 12 12 MET N N 12 125.930 126.710 -0.780 1
1 54 . 5 1 1 A 13 13 SER H H 13 7.990 8.631 -0.641 1
1 55 . 5 1 1 A 13 13 SER HA H 13 5.030 5.259 -0.229 1
1 58 . 5 1 1 A 13 13 SER C C 13 174.330 173.844 0.486 1
1 59 . 5 1 1 A 13 13 SER CA C 13 57.320 56.060 1.260 1
1 60 . 5 1 1 A 13 13 SER CB C 13 64.790 65.703 -0.913 1
1 61 . 5 1 1 A 13 13 SER N N 13 116.400 118.590 -2.190 1
1 62 . 5 1 1 A 14 14 GLU H H 14 9.430 8.568 0.862 1
1 63 . 5 1 1 A 14 14 GLU HA H 14 5.250 5.419 -0.169 1
1 68 . 5 1 1 A 14 14 GLU C C 14 172.980 174.777 -1.797 1
1 69 . 5 1 1 A 14 14 GLU CA C 14 55.390 55.016 0.374 1
1 70 . 5 1 1 A 14 14 GLU CB C 14 33.910 34.532 -0.622 1
1 72 . 5 1 1 A 14 14 GLU N N 14 123.670 119.753 3.917 1
1 73 . 5 1 1 A 15 15 LEU H H 15 8.930 8.939 -0.009 1
1 74 . 5 1 1 A 15 15 LEU HA H 15 4.870 5.042 -0.172 1
1 84 . 5 1 1 A 15 15 LEU C C 15 174.000 174.488 -0.488 1
1 85 . 5 1 1 A 15 15 LEU CA C 15 53.020 53.539 -0.519 1
1 86 . 5 1 1 A 15 15 LEU CB C 15 46.040 45.512 0.528 1
1 90 . 5 1 1 A 15 15 LEU N N 15 125.350 125.672 -0.322 1
1 91 . 5 1 1 A 16 16 LYS H H 16 8.840 8.700 0.140 1
1 92 . 5 1 1 A 16 16 LYS HA H 16 5.360 4.831 0.529 1
1 101 . 5 1 1 A 16 16 LYS C C 16 175.660 175.335 0.325 1
1 102 . 5 1 1 A 16 16 LYS CA C 16 54.940 55.625 -0.685 1
1 103 . 5 1 1 A 16 16 LYS CB C 16 34.280 33.717 0.563 1
1 107 . 5 1 1 A 16 16 LYS N N 16 124.640 127.085 -2.445 1
1 108 . 5 1 1 A 17 17 LEU H H 17 8.820 8.949 -0.129 1
1 109 . 5 1 1 A 17 17 LEU HA H 17 5.430 5.221 0.209 1
1 119 . 5 1 1 A 17 17 LEU C C 17 174.630 174.995 -0.365 1
1 120 . 5 1 1 A 17 17 LEU CA C 17 52.900 53.280 -0.380 1
1 121 . 5 1 1 A 17 17 LEU CB C 17 46.910 45.139 1.771 1
1 125 . 5 1 1 A 17 17 LEU N N 17 123.460 126.682 -3.222 1
1 126 . 5 1 1 A 18 18 LYS H H 18 9.110 8.710 0.400 1
1 127 . 5 1 1 A 18 18 LYS HA H 18 5.490 4.992 0.498 1
1 136 . 5 1 1 A 18 18 LYS CA C 18 52.270 52.921 -0.651 1
1 137 . 5 1 1 A 18 18 LYS CB C 18 37.500 35.792 1.708 1
1 141 . 5 1 1 A 18 18 LYS N N 18 122.230 123.611 -1.381 1
1 142 . 5 1 1 A 19 19 PRO HA H 19 4.100 4.902 -0.802 1
1 149 . 5 1 1 A 19 19 PRO CA C 19 62.440 62.753 -0.313 1
1 150 . 5 1 1 A 19 19 PRO CB C 19 30.640 32.269 -1.629 1
1 153 . 5 1 1 A 20 20 LEU H H 20 8.490 8.617 -0.127 1
1 154 . 5 1 1 A 20 20 LEU HA H 20 4.320 4.340 -0.020 1
1 164 . 5 1 1 A 20 20 LEU CA C 20 57.680 58.680 -1.000 1
1 165 . 5 1 1 A 20 20 LEU CB C 20 38.760 41.692 -2.932 1
1 169 . 5 1 1 A 20 20 LEU N N 20 123.250 119.651 3.599 1
1 170 . 5 1 1 A 21 21 PRO HA H 21 4.530 4.552 -0.022 1
1 177 . 5 1 1 A 21 21 PRO CA C 21 62.880 62.392 0.488 1
1 178 . 5 1 1 A 21 21 PRO CB C 21 31.420 32.473 -1.053 1
1 181 . 5 1 1 A 22 22 LYS H H 22 8.180 8.447 -0.267 1
1 182 . 5 1 1 A 22 22 LYS HA H 22 4.110 4.475 -0.365 1
1 191 . 5 1 1 A 22 22 LYS C C 22 175.680 175.485 0.195 1
1 192 . 5 1 1 A 22 22 LYS CA C 22 56.210 55.829 0.381 1
1 193 . 5 1 1 A 22 22 LYS CB C 22 30.660 32.068 -1.408 1
1 197 . 5 1 1 A 22 22 LYS N N 22 119.160 121.937 -2.777 1
1 198 . 5 1 1 A 23 23 VAL H H 23 7.530 8.548 -1.018 1
1 199 . 5 1 1 A 23 23 VAL HA H 23 4.280 4.839 -0.559 1
1 207 . 5 1 1 A 23 23 VAL C C 23 173.690 173.287 0.403 1
1 208 . 5 1 1 A 23 23 VAL CA C 23 59.830 59.604 0.226 1
1 209 . 5 1 1 A 23 23 VAL CB C 23 34.550 35.574 -1.024 1
1 212 . 5 1 1 A 23 23 VAL N N 23 121.820 122.937 -1.117 1
1 213 . 5 1 1 A 24 24 GLU H H 24 8.270 8.978 -0.708 1
1 214 . 5 1 1 A 24 24 GLU HA H 24 4.330 4.995 -0.665 1
1 219 . 5 1 1 A 24 24 GLU C C 24 175.390 175.255 0.135 1
1 220 . 5 1 1 A 24 24 GLU CA C 24 55.220 55.140 0.080 1
1 221 . 5 1 1 A 24 24 GLU CB C 24 29.970 31.698 -1.728 1
1 223 . 5 1 1 A 24 24 GLU N N 24 125.610 126.896 -1.286 1
1 224 . 5 1 1 A 25 25 LEU H H 25 8.480 8.783 -0.303 1
1 225 . 5 1 1 A 25 25 LEU HA H 25 4.520 4.452 0.068 1
1 235 . 5 1 1 A 25 25 LEU CA C 25 51.660 51.418 0.242 1
1 236 . 5 1 1 A 25 25 LEU CB C 25 41.750 41.086 0.664 1
1 240 . 5 1 1 A 25 25 LEU N N 25 125.880 126.274 -0.394 1
1 241 . 5 1 1 A 26 26 PRO HA H 26 4.760 4.616 0.144 1
1 248 . 5 1 1 A 26 26 PRO CA C 26 61.330 61.889 -0.559 1
1 249 . 5 1 1 A 26 26 PRO CB C 26 31.060 32.832 -1.772 1
1 252 . 5 1 1 A 27 27 PRO HA H 27 4.390 4.406 -0.016 1
1 259 . 5 1 1 A 27 27 PRO CA C 27 64.550 64.830 -0.280 1
1 260 . 5 1 1 A 27 27 PRO CB C 27 31.770 31.732 0.038 1
1 263 . 5 1 1 A 28 28 ASP H H 28 8.560 8.777 -0.217 1
1 264 . 5 1 1 A 28 28 ASP HA H 28 4.620 4.426 0.194 1
1 267 . 5 1 1 A 28 28 ASP C C 28 177.100 178.728 -1.628 1
1 268 . 5 1 1 A 28 28 ASP CA C 28 53.890 56.300 -2.410 1
1 269 . 5 1 1 A 28 28 ASP CB C 28 39.120 39.588 -0.468 1
1 270 . 5 1 1 A 28 28 ASP N N 28 115.820 117.832 -2.012 1
1 271 . 5 1 1 A 29 29 PHE H H 29 7.940 7.934 0.006 1
1 272 . 5 1 1 A 29 29 PHE HA H 29 4.180 4.313 -0.133 1
1 280 . 5 1 1 A 29 29 PHE C C 29 176.740 178.250 -1.510 1
1 281 . 5 1 1 A 29 29 PHE CA C 29 61.020 61.025 -0.005 1
1 282 . 5 1 1 A 29 29 PHE CB C 29 39.230 38.756 0.474 1
1 288 . 5 1 1 A 29 29 PHE N N 29 119.610 118.359 1.251 1
1 289 . 5 1 1 A 30 30 VAL H H 30 8.010 8.436 -0.426 1
1 290 . 5 1 1 A 30 30 VAL HA H 30 3.350 3.749 -0.399 1
1 298 . 5 1 1 A 30 30 VAL C C 30 176.400 177.103 -0.703 1
1 299 . 5 1 1 A 30 30 VAL CA C 30 66.510 64.806 1.704 1
1 300 . 5 1 1 A 30 30 VAL CB C 30 31.020 31.022 -0.002 1
1 303 . 5 1 1 A 30 30 VAL N N 30 116.370 119.564 -3.194 1
1 304 . 5 1 1 A 31 31 ASP H H 31 7.420 7.972 -0.552 1
1 305 . 5 1 1 A 31 31 ASP HA H 31 4.310 4.367 -0.057 1
1 308 . 5 1 1 A 31 31 ASP C C 31 178.360 178.895 -0.535 1
1 309 . 5 1 1 A 31 31 ASP CA C 31 57.110 57.096 0.014 1
1 310 . 5 1 1 A 31 31 ASP CB C 31 40.450 40.884 -0.434 1
1 311 . 5 1 1 A 31 31 ASP N N 31 119.190 121.593 -2.403 1
1 312 . 5 1 1 A 32 32 VAL H H 32 7.190 7.385 -0.195 1
1 313 . 5 1 1 A 32 32 VAL HA H 32 3.510 3.559 -0.049 1
1 321 . 5 1 1 A 32 32 VAL C C 32 178.100 178.522 -0.422 1
1 322 . 5 1 1 A 32 32 VAL CA C 32 65.570 66.389 -0.819 1
1 323 . 5 1 1 A 32 32 VAL CB C 32 31.410 31.279 0.131 1
1 326 . 5 1 1 A 32 32 VAL N N 32 119.830 120.237 -0.407 1
1 327 . 5 1 1 A 33 33 ILE H H 33 7.660 8.455 -0.795 1
1 328 . 5 1 1 A 33 33 ILE HA H 33 3.170 3.584 -0.414 1
1 338 . 5 1 1 A 33 33 ILE C C 33 176.660 178.178 -1.518 1
1 339 . 5 1 1 A 33 33 ILE CA C 33 65.220 65.268 -0.048 1
1 340 . 5 1 1 A 33 33 ILE CB C 33 37.500 37.691 -0.191 1
1 344 . 5 1 1 A 33 33 ILE N N 33 118.490 120.860 -2.370 1
1 345 . 5 1 1 A 34 34 ARG H H 34 7.830 7.739 0.091 1
1 346 . 5 1 1 A 34 34 ARG HA H 34 3.380 3.914 -0.534 1
1 354 . 5 1 1 A 34 34 ARG C C 34 178.060 177.400 0.660 1
1 355 . 5 1 1 A 34 34 ARG CA C 34 60.570 58.873 1.697 1
1 356 . 5 1 1 A 34 34 ARG CB C 34 30.070 29.697 0.373 1
1 359 . 5 1 1 A 34 34 ARG N N 34 118.260 119.974 -1.714 1
1 361 . 5 1 1 A 35 35 ILE H H 35 7.350 7.881 -0.531 1
1 362 . 5 1 1 A 35 35 ILE HA H 35 3.720 3.727 -0.007 1
1 372 . 5 1 1 A 35 35 ILE C C 35 179.090 178.053 1.037 1
1 373 . 5 1 1 A 35 35 ILE CA C 35 64.060 65.340 -1.280 1
1 374 . 5 1 1 A 35 35 ILE CB C 35 38.030 37.566 0.464 1
1 378 . 5 1 1 A 35 35 ILE N N 35 116.750 119.564 -2.814 1
1 379 . 5 1 1 A 36 36 LYS H H 36 7.880 7.660 0.220 1
1 380 . 5 1 1 A 36 36 LYS HA H 36 4.090 3.985 0.105 1
1 389 . 5 1 1 A 36 36 LYS C C 36 178.560 178.988 -0.428 1
1 390 . 5 1 1 A 36 36 LYS CA C 36 57.650 59.804 -2.154 1
1 391 . 5 1 1 A 36 36 LYS CB C 36 32.090 32.272 -0.182 1
1 395 . 5 1 1 A 36 36 LYS N N 36 118.700 119.751 -1.051 1
1 396 . 5 1 1 A 37 37 LEU H H 37 7.860 7.451 0.409 1
1 397 . 5 1 1 A 37 37 LEU HA H 37 4.230 4.308 -0.078 1
1 407 . 5 1 1 A 37 37 LEU C C 37 175.880 176.800 -0.920 1
1 408 . 5 1 1 A 37 37 LEU CA C 37 54.090 55.876 -1.786 1
1 409 . 5 1 1 A 37 37 LEU CB C 37 43.310 42.651 0.659 1
1 413 . 5 1 1 A 37 37 LEU N N 37 116.380 117.470 -1.090 1
1 414 . 5 1 1 A 38 38 GLN H H 38 7.190 7.604 -0.414 1
1 415 . 5 1 1 A 38 38 GLN HA H 38 3.530 4.478 -0.948 1
1 422 . 5 1 1 A 38 38 GLN C C 38 177.480 176.269 1.211 1
1 423 . 5 1 1 A 38 38 GLN CA C 38 58.370 56.733 1.637 1
1 424 . 5 1 1 A 38 38 GLN CB C 38 28.300 28.809 -0.509 1
1 426 . 5 1 1 A 38 38 GLN N N 38 119.210 117.657 1.553 1
1 428 . 5 1 1 A 39 39 GLY H H 39 8.940 8.837 0.103 1
1 429 . 5 1 1 A 39 39 GLY HA2 H 39 3.540 3.994 -0.454 1
1 430 . 5 1 1 A 39 39 GLY HA3 H 39 4.220 3.995 0.225 1
1 431 . 5 1 1 A 39 39 GLY C C 39 174.070 174.438 -0.368 1
1 432 . 5 1 1 A 39 39 GLY CA C 39 45.280 45.069 0.211 1
1 433 . 5 1 1 A 39 39 GLY N N 39 113.490 112.154 1.336 1
1 434 . 5 1 1 A 40 40 LYS H H 40 8.350 7.585 0.765 1
1 435 . 5 1 1 A 40 40 LYS HA H 40 4.400 4.611 -0.211 1
1 444 . 5 1 1 A 40 40 LYS C C 40 175.560 175.857 -0.297 1
1 445 . 5 1 1 A 40 40 LYS CA C 40 55.660 54.653 1.007 1
1 446 . 5 1 1 A 40 40 LYS CB C 40 32.870 33.772 -0.902 1
1 450 . 5 1 1 A 40 40 LYS N N 40 122.060 119.990 2.070 1
1 451 . 5 1 1 A 41 41 THR H H 41 8.410 8.565 -0.155 1
1 452 . 5 1 1 A 41 41 THR HA H 41 5.330 5.003 0.327 1
1 457 . 5 1 1 A 41 41 THR C C 41 174.860 174.474 0.386 1
1 458 . 5 1 1 A 41 41 THR CA C 41 62.040 61.653 0.387 1
1 459 . 5 1 1 A 41 41 THR CB C 41 69.420 70.911 -1.491 1
1 461 . 5 1 1 A 41 41 THR N N 41 118.150 117.043 1.107 1
1 462 . 5 1 1 A 42 42 VAL H H 42 9.140 9.051 0.089 1
1 463 . 5 1 1 A 42 42 VAL HA H 42 4.570 5.055 -0.485 1
1 471 . 5 1 1 A 42 42 VAL C C 42 172.970 174.293 -1.323 1
1 472 . 5 1 1 A 42 42 VAL CA C 42 59.450 59.118 0.332 1
1 473 . 5 1 1 A 42 42 VAL CB C 42 35.880 35.594 0.286 1
1 476 . 5 1 1 A 42 42 VAL N N 42 122.510 119.809 2.701 1
1 477 . 5 1 1 A 43 43 ARG H H 43 8.420 8.678 -0.258 1
1 478 . 5 1 1 A 43 43 ARG HA H 43 4.750 4.846 -0.096 1
1 485 . 5 1 1 A 43 43 ARG C C 43 175.650 175.799 -0.149 1
1 486 . 5 1 1 A 43 43 ARG CA C 43 53.650 53.797 -0.147 1
1 487 . 5 1 1 A 43 43 ARG CB C 43 33.870 34.097 -0.227 1
1 490 . 5 1 1 A 43 43 ARG N N 43 120.640 122.840 -2.200 1
1 491 . 5 1 1 A 44 44 THR H H 44 8.370 8.573 -0.203 1
1 492 . 5 1 1 A 44 44 THR HA H 44 3.410 3.760 -0.350 1
1 497 . 5 1 1 A 44 44 THR C C 44 175.020 175.816 -0.796 1
1 498 . 5 1 1 A 44 44 THR CA C 44 65.660 65.000 0.660 1
1 499 . 5 1 1 A 44 44 THR CB C 44 69.400 68.338 1.062 1
1 501 . 5 1 1 A 44 44 THR N N 44 118.590 117.596 0.994 1
1 502 . 5 1 1 A 45 45 GLY H H 45 9.090 8.774 0.316 1
1 503 . 5 1 1 A 45 45 GLY HA2 H 45 3.470 4.019 -0.549 1
1 504 . 5 1 1 A 45 45 GLY HA3 H 45 4.470 4.023 0.447 1
1 505 . 5 1 1 A 45 45 GLY C C 45 174.350 173.846 0.504 1
1 506 . 5 1 1 A 45 45 GLY CA C 45 45.000 44.959 0.041 1
1 507 . 5 1 1 A 45 45 GLY N N 45 117.350 114.939 2.411 1
1 508 . 5 1 1 A 46 46 ASP H H 46 8.010 7.877 0.133 1
1 509 . 5 1 1 A 46 46 ASP HA H 46 4.470 4.627 -0.157 1
1 512 . 5 1 1 A 46 46 ASP C C 46 174.570 174.491 0.079 1
1 513 . 5 1 1 A 46 46 ASP CA C 46 55.570 55.434 0.136 1
1 514 . 5 1 1 A 46 46 ASP CB C 46 41.680 41.493 0.187 1
1 515 . 5 1 1 A 46 46 ASP N N 46 122.240 122.222 0.018 1
1 516 . 5 1 1 A 47 47 VAL H H 47 8.330 8.500 -0.170 1
1 517 . 5 1 1 A 47 47 VAL HA H 47 4.950 4.926 0.024 1
1 525 . 5 1 1 A 47 47 VAL C C 47 176.330 175.426 0.904 1
1 526 . 5 1 1 A 47 47 VAL CA C 47 61.710 60.934 0.776 1
1 527 . 5 1 1 A 47 47 VAL CB C 47 32.900 35.164 -2.264 1
1 530 . 5 1 1 A 47 47 VAL N N 47 119.860 121.811 -1.951 1
1 531 . 5 1 1 A 48 48 ILE H H 48 9.160 8.690 0.470 1
1 532 . 5 1 1 A 48 48 ILE HA H 48 4.630 5.073 -0.443 1
1 542 . 5 1 1 A 48 48 ILE C C 48 174.400 174.358 0.042 1
1 543 . 5 1 1 A 48 48 ILE CA C 48 58.990 59.433 -0.443 1
1 544 . 5 1 1 A 48 48 ILE CB C 48 41.810 42.309 -0.499 1
1 548 . 5 1 1 A 48 48 ILE N N 48 124.990 121.645 3.345 1
1 549 . 5 1 1 A 49 49 GLY H H 49 8.660 8.960 -0.300 1
1 550 . 5 1 1 A 49 49 GLY HA2 H 49 4.950 4.186 0.764 1
1 551 . 5 1 1 A 49 49 GLY HA3 H 49 3.620 4.230 -0.610 1
1 552 . 5 1 1 A 49 49 GLY C C 49 172.920 171.901 1.019 1
1 553 . 5 1 1 A 49 49 GLY CA C 49 44.580 44.366 0.214 1
1 554 . 5 1 1 A 49 49 GLY N N 49 112.060 109.988 2.072 1
1 555 . 5 1 1 A 50 50 ILE H H 50 8.810 8.858 -0.048 1
1 556 . 5 1 1 A 50 50 ILE HA H 50 4.370 4.742 -0.372 1
1 566 . 5 1 1 A 50 50 ILE C C 50 174.500 174.727 -0.227 1
1 567 . 5 1 1 A 50 50 ILE CA C 50 59.550 59.990 -0.440 1
1 568 . 5 1 1 A 50 50 ILE CB C 50 41.300 41.317 -0.017 1
1 572 . 5 1 1 A 50 50 ILE N N 50 123.220 125.564 -2.344 1
1 573 . 5 1 1 A 51 51 SER H H 51 8.540 8.973 -0.433 1
1 574 . 5 1 1 A 51 51 SER HA H 51 4.830 5.097 -0.267 1
1 577 . 5 1 1 A 51 51 SER C C 51 174.130 173.889 0.241 1
1 578 . 5 1 1 A 51 51 SER CA C 51 57.770 56.631 1.139 1
1 579 . 5 1 1 A 51 51 SER CB C 51 63.040 64.460 -1.420 1
1 580 . 5 1 1 A 51 51 SER N N 51 121.430 121.455 -0.025 1
1 581 . 5 1 1 A 52 52 ILE H H 52 8.930 8.745 0.185 1
1 582 . 5 1 1 A 52 52 ILE HA H 52 4.290 4.596 -0.306 1
1 592 . 5 1 1 A 52 52 ILE C C 52 175.280 175.986 -0.706 1
1 593 . 5 1 1 A 52 52 ILE CA C 52 60.250 60.176 0.074 1
1 594 . 5 1 1 A 52 52 ILE CB C 52 39.840 40.532 -0.692 1
1 598 . 5 1 1 A 52 52 ILE N N 52 127.060 124.927 2.133 1
1 599 . 5 1 1 A 53 53 LEU H H 53 9.380 9.449 -0.069 1
1 600 . 5 1 1 A 53 53 LEU HA H 53 3.890 4.085 -0.195 1
1 610 . 5 1 1 A 53 53 LEU C C 53 177.130 176.988 0.142 1
1 611 . 5 1 1 A 53 53 LEU CA C 53 55.560 56.199 -0.639 1
1 612 . 5 1 1 A 53 53 LEU CB C 53 39.370 40.657 -1.287 1
1 616 . 5 1 1 A 53 53 LEU N N 53 126.770 129.514 -2.744 1
1 617 . 5 1 1 A 54 54 GLY H H 54 8.310 8.694 -0.384 1
1 618 . 5 1 1 A 54 54 GLY HA2 H 54 3.490 3.891 -0.401 1
1 619 . 5 1 1 A 54 54 GLY HA3 H 54 4.080 3.893 0.187 1
1 620 . 5 1 1 A 54 54 GLY C C 54 173.690 173.764 -0.074 1
1 621 . 5 1 1 A 54 54 GLY CA C 54 45.340 45.743 -0.403 1
1 622 . 5 1 1 A 54 54 GLY N N 54 103.820 104.348 -0.528 1
1 623 . 5 1 1 A 55 55 LYS H H 55 7.730 7.846 -0.116 1
1 624 . 5 1 1 A 55 55 LYS HA H 55 4.560 4.735 -0.175 1
1 633 . 5 1 1 A 55 55 LYS C C 55 174.550 175.007 -0.457 1
1 634 . 5 1 1 A 55 55 LYS CA C 55 54.140 54.487 -0.347 1
1 635 . 5 1 1 A 55 55 LYS CB C 55 34.620 35.149 -0.529 1
1 639 . 5 1 1 A 55 55 LYS N N 55 121.160 120.070 1.090 1
1 640 . 5 1 1 A 56 56 GLU H H 56 8.490 8.895 -0.405 1
1 641 . 5 1 1 A 56 56 GLU HA H 56 4.280 4.642 -0.362 1
1 646 . 5 1 1 A 56 56 GLU C C 56 175.730 175.169 0.561 1
1 647 . 5 1 1 A 56 56 GLU CA C 56 56.730 56.292 0.438 1
1 648 . 5 1 1 A 56 56 GLU CB C 56 30.070 30.787 -0.717 1
1 650 . 5 1 1 A 56 56 GLU N N 56 124.090 125.327 -1.237 1
1 651 . 5 1 1 A 57 57 VAL H H 57 8.920 8.348 0.572 1
1 652 . 5 1 1 A 57 57 VAL HA H 57 4.030 4.751 -0.721 1
1 660 . 5 1 1 A 57 57 VAL C C 57 174.610 173.325 1.285 1
1 661 . 5 1 1 A 57 57 VAL CA C 57 61.680 59.477 2.203 1
1 662 . 5 1 1 A 57 57 VAL CB C 57 33.880 34.418 -0.538 1
1 665 . 5 1 1 A 57 57 VAL N N 57 129.960 126.022 3.938 1
1 666 . 5 1 1 A 58 58 LYS H H 58 7.860 8.630 -0.770 1
1 667 . 5 1 1 A 58 58 LYS HA H 58 5.120 4.616 0.504 1
1 676 . 5 1 1 A 58 58 LYS C C 58 175.380 175.773 -0.393 1
1 677 . 5 1 1 A 58 58 LYS CA C 58 55.200 54.673 0.527 1
1 678 . 5 1 1 A 58 58 LYS CB C 58 34.670 34.009 0.661 1
1 682 . 5 1 1 A 58 58 LYS N N 58 124.790 127.176 -2.386 1
1 683 . 5 1 1 A 59 59 PHE H H 59 9.270 8.915 0.355 1
1 684 . 5 1 1 A 59 59 PHE HA H 59 4.960 5.168 -0.208 1
1 692 . 5 1 1 A 59 59 PHE C C 59 173.950 174.291 -0.341 1
1 693 . 5 1 1 A 59 59 PHE CA C 59 55.910 56.167 -0.257 1
1 694 . 5 1 1 A 59 59 PHE CB C 59 42.950 42.258 0.692 1
1 700 . 5 1 1 A 59 59 PHE N N 59 118.270 122.881 -4.611 1
1 701 . 5 1 1 A 60 60 LYS H H 60 9.170 8.897 0.273 1
1 702 . 5 1 1 A 60 60 LYS HA H 60 4.910 4.954 -0.044 1
1 711 . 5 1 1 A 60 60 LYS C C 60 176.230 176.003 0.227 1
1 712 . 5 1 1 A 60 60 LYS CA C 60 53.910 54.586 -0.676 1
1 713 . 5 1 1 A 60 60 LYS CB C 60 35.170 35.084 0.086 1
1 717 . 5 1 1 A 60 60 LYS N N 60 121.960 124.319 -2.359 1
1 718 . 5 1 1 A 61 61 VAL H H 61 9.400 8.847 0.553 1
1 719 . 5 1 1 A 61 61 VAL HA H 61 4.170 4.011 0.159 1
1 727 . 5 1 1 A 61 61 VAL C C 61 175.500 175.259 0.241 1
1 728 . 5 1 1 A 61 61 VAL CA C 61 61.980 63.560 -1.580 1
1 729 . 5 1 1 A 61 61 VAL CB C 61 29.490 31.045 -1.555 1
1 732 . 5 1 1 A 61 61 VAL N N 61 127.140 127.120 0.020 1
1 733 . 5 1 1 A 62 62 VAL H H 62 8.390 8.747 -0.357 1
1 734 . 5 1 1 A 62 62 VAL HA H 62 3.650 3.971 -0.321 1
1 742 . 5 1 1 A 62 62 VAL C C 62 176.440 176.016 0.424 1
1 743 . 5 1 1 A 62 62 VAL CA C 62 64.930 64.435 0.495 1
1 744 . 5 1 1 A 62 62 VAL CB C 62 32.130 32.422 -0.292 1
1 747 . 5 1 1 A 62 62 VAL N N 62 132.840 129.501 3.339 1
1 748 . 5 1 1 A 63 63 GLN H H 63 7.470 7.112 0.358 1
1 749 . 5 1 1 A 63 63 GLN HA H 63 4.270 4.487 -0.217 1
1 756 . 5 1 1 A 63 63 GLN C C 63 172.290 173.344 -1.054 1
1 757 . 5 1 1 A 63 63 GLN CA C 63 56.640 55.451 1.189 1
1 758 . 5 1 1 A 63 63 GLN CB C 63 32.630 32.041 0.589 1
1 760 . 5 1 1 A 63 63 GLN N N 63 114.500 116.855 -2.355 1
1 762 . 5 1 1 A 64 64 ALA H H 64 8.200 8.505 -0.305 1
1 763 . 5 1 1 A 64 64 ALA HA H 64 4.830 5.316 -0.486 1
1 767 . 5 1 1 A 64 64 ALA C C 64 174.270 175.644 -1.374 1
1 768 . 5 1 1 A 64 64 ALA CA C 64 50.800 49.982 0.818 1
1 769 . 5 1 1 A 64 64 ALA CB C 64 20.100 21.598 -1.498 1
1 770 . 5 1 1 A 64 64 ALA N N 64 131.410 128.779 2.631 1
1 771 . 5 1 1 A 65 65 TYR H H 65 8.860 8.521 0.339 1
1 772 . 5 1 1 A 65 65 TYR HA H 65 4.540 4.955 -0.415 1
1 779 . 5 1 1 A 65 65 TYR CA C 65 54.270 55.141 -0.871 1
1 780 . 5 1 1 A 65 65 TYR CB C 65 41.360 40.681 0.679 1
1 785 . 5 1 1 A 65 65 TYR N N 65 124.140 119.953 4.187 1
1 786 . 5 1 1 A 66 66 PRO HA H 66 4.120 4.736 -0.616 1
1 793 . 5 1 1 A 66 66 PRO CA C 66 63.450 62.356 1.094 1
1 794 . 5 1 1 A 66 66 PRO CB C 66 34.170 32.769 1.401 1
1 797 . 5 1 1 A 67 67 SER H H 67 7.380 8.240 -0.860 1
1 798 . 5 1 1 A 67 67 SER HA H 67 4.720 4.976 -0.256 1
1 801 . 5 1 1 A 67 67 SER CA C 67 54.250 56.026 -1.776 1
1 802 . 5 1 1 A 67 67 SER CB C 67 64.530 63.929 0.601 1
1 803 . 5 1 1 A 67 67 SER N N 67 106.200 116.830 -10.630 1
1 804 . 5 1 1 A 68 68 PRO HA H 68 4.880 4.669 0.211 1
1 811 . 5 1 1 A 68 68 PRO CA C 68 62.990 62.471 0.519 1
1 812 . 5 1 1 A 68 68 PRO CB C 68 35.220 33.286 1.934 1
1 815 . 5 1 1 A 69 69 LEU H H 69 8.960 7.905 1.055 1
1 816 . 5 1 1 A 69 69 LEU HA H 69 4.430 5.076 -0.646 1
1 826 . 5 1 1 A 69 69 LEU C C 69 174.570 175.284 -0.714 1
1 827 . 5 1 1 A 69 69 LEU CA C 69 53.900 52.667 1.233 1
1 828 . 5 1 1 A 69 69 LEU CB C 69 44.210 45.903 -1.693 1
1 832 . 5 1 1 A 69 69 LEU N N 69 120.480 117.160 3.320 1
1 833 . 5 1 1 A 70 70 ARG H H 70 8.130 8.379 -0.249 1
1 834 . 5 1 1 A 70 70 ARG HA H 70 4.930 4.787 0.143 1
1 841 . 5 1 1 A 70 70 ARG C C 70 175.460 176.123 -0.663 1
1 842 . 5 1 1 A 70 70 ARG CA C 70 54.040 55.664 -1.624 1
1 843 . 5 1 1 A 70 70 ARG CB C 70 30.550 31.747 -1.197 1
1 846 . 5 1 1 A 70 70 ARG N N 70 125.180 119.652 5.528 1
1 847 . 5 1 1 A 71 71 VAL H H 71 8.450 8.214 0.236 1
1 848 . 5 1 1 A 71 71 VAL HA H 71 3.410 4.444 -1.034 1
1 856 . 5 1 1 A 71 71 VAL C C 71 175.460 175.465 -0.005 1
1 857 . 5 1 1 A 71 71 VAL CA C 71 65.210 62.327 2.883 1
1 858 . 5 1 1 A 71 71 VAL CB C 71 29.840 31.660 -1.820 1
1 861 . 5 1 1 A 71 71 VAL N N 71 128.170 122.801 5.369 1
1 862 . 5 1 1 A 72 72 GLU H H 72 8.620 8.587 0.033 1
1 863 . 5 1 1 A 72 72 GLU HA H 72 4.870 4.826 0.044 1
1 868 . 5 1 1 A 72 72 GLU C C 72 176.960 176.238 0.722 1
1 869 . 5 1 1 A 72 72 GLU CA C 72 54.330 54.439 -0.109 1
1 870 . 5 1 1 A 72 72 GLU CB C 72 33.280 33.192 0.088 1
1 872 . 5 1 1 A 72 72 GLU N N 72 127.670 126.795 0.875 1
1 873 . 5 1 1 A 73 73 ASP H H 73 8.700 8.840 -0.140 1
1 874 . 5 1 1 A 73 73 ASP HA H 73 4.150 4.273 -0.123 1
1 877 . 5 1 1 A 73 73 ASP C C 73 177.460 177.799 -0.339 1
1 878 . 5 1 1 A 73 73 ASP CA C 73 57.620 57.270 0.350 1
1 879 . 5 1 1 A 73 73 ASP CB C 73 40.360 40.356 0.004 1
1 880 . 5 1 1 A 73 73 ASP N N 73 121.140 126.969 -5.829 1
1 881 . 5 1 1 A 74 74 ARG H H 74 7.760 7.742 0.018 1
1 882 . 5 1 1 A 74 74 ARG HA H 74 4.280 4.331 -0.051 1
1 889 . 5 1 1 A 74 74 ARG C C 74 176.510 176.764 -0.254 1
1 890 . 5 1 1 A 74 74 ARG CA C 74 55.450 57.058 -1.608 1
1 891 . 5 1 1 A 74 74 ARG CB C 74 29.990 30.852 -0.862 1
1 894 . 5 1 1 A 74 74 ARG N N 74 112.890 116.308 -3.418 1
1 895 . 5 1 1 A 75 75 THR H H 75 7.700 7.429 0.271 1
1 896 . 5 1 1 A 75 75 THR HA H 75 4.020 4.313 -0.293 1
1 901 . 5 1 1 A 75 75 THR C C 75 173.810 173.926 -0.116 1
1 902 . 5 1 1 A 75 75 THR CA C 75 64.060 63.852 0.208 1
1 903 . 5 1 1 A 75 75 THR CB C 75 69.350 69.497 -0.147 1
1 905 . 5 1 1 A 75 75 THR N N 75 120.650 116.285 4.365 1
1 906 . 5 1 1 A 76 76 LYS H H 76 8.520 8.213 0.307 1
1 907 . 5 1 1 A 76 76 LYS HA H 76 4.270 4.671 -0.401 1
1 916 . 5 1 1 A 76 76 LYS C C 76 174.560 175.750 -1.190 1
1 917 . 5 1 1 A 76 76 LYS CA C 76 56.280 55.945 0.335 1
1 918 . 5 1 1 A 76 76 LYS CB C 76 33.120 33.786 -0.666 1
1 922 . 5 1 1 A 76 76 LYS N N 76 130.950 127.020 3.930 1
1 923 . 5 1 1 A 77 77 ILE H H 77 8.430 8.576 -0.146 1
1 924 . 5 1 1 A 77 77 ILE HA H 77 4.850 5.139 -0.289 1
1 934 . 5 1 1 A 77 77 ILE C C 77 174.650 175.100 -0.450 1
1 935 . 5 1 1 A 77 77 ILE CA C 77 59.820 60.016 -0.196 1
1 936 . 5 1 1 A 77 77 ILE CB C 77 38.280 40.875 -2.595 1
1 940 . 5 1 1 A 77 77 ILE N N 77 128.020 123.066 4.954 1
1 941 . 5 1 1 A 78 78 THR H H 78 8.870 8.767 0.103 1
1 942 . 5 1 1 A 78 78 THR HA H 78 4.470 5.094 -0.624 1
1 947 . 5 1 1 A 78 78 THR C C 78 172.760 172.993 -0.233 1
1 948 . 5 1 1 A 78 78 THR CA C 78 60.740 61.283 -0.543 1
1 949 . 5 1 1 A 78 78 THR CB C 78 71.320 71.957 -0.637 1
1 951 . 5 1 1 A 78 78 THR N N 78 123.870 123.670 0.200 1
1 952 . 5 1 1 A 79 79 LEU H H 79 8.820 8.940 -0.120 1
1 953 . 5 1 1 A 79 79 LEU HA H 79 5.140 5.006 0.134 1
1 963 . 5 1 1 A 79 79 LEU C C 79 176.610 175.868 0.742 1
1 964 . 5 1 1 A 79 79 LEU CA C 79 53.280 53.285 -0.005 1
1 965 . 5 1 1 A 79 79 LEU CB C 79 42.600 42.499 0.101 1
1 969 . 5 1 1 A 79 79 LEU N N 79 127.070 126.421 0.649 1
1 970 . 5 1 1 A 80 80 VAL H H 80 8.800 8.623 0.177 1
1 971 . 5 1 1 A 80 80 VAL HA H 80 4.260 4.671 -0.411 1
1 979 . 5 1 1 A 80 80 VAL CA C 80 61.350 61.544 -0.194 1
1 980 . 5 1 1 A 80 80 VAL CB C 80 32.790 32.726 0.064 1
1 983 . 5 1 1 A 80 80 VAL N N 80 124.120 125.284 -1.164 1
1 984 . 5 1 1 A 81 81 THR H H 81 8.160 8.731 -0.571 1
1 985 . 5 1 1 A 81 81 THR HA H 81 4.410 5.177 -0.767 1
1 990 . 5 1 1 A 81 81 THR CA C 81 60.800 59.846 0.954 1
1 991 . 5 1 1 A 81 81 THR CB C 81 69.650 72.716 -3.066 1
1 993 . 5 1 1 A 81 81 THR N N 81 114.500 116.691 -2.191 1
1 1 . 6 1 1 A 9 9 GLY H H 9 8.390 8.137 0.253 1
1 2 . 6 1 1 A 9 9 GLY HA2 H 9 3.900 3.954 -0.054 1
1 3 . 6 1 1 A 9 9 GLY HA3 H 9 3.860 3.954 -0.094 1
1 4 . 6 1 1 A 9 9 GLY CA C 9 45.150 47.244 -2.094 1
1 5 . 6 1 1 A 9 9 GLY N N 9 110.000 106.785 3.215 1
1 6 . 6 1 1 A 10 10 VAL H H 10 7.870 8.492 -0.622 1
1 7 . 6 1 1 A 10 10 VAL HA H 10 4.040 4.350 -0.310 1
1 15 . 6 1 1 A 10 10 VAL C C 10 175.880 175.347 0.533 1
1 16 . 6 1 1 A 10 10 VAL CA C 10 62.110 62.113 -0.003 1
1 17 . 6 1 1 A 10 10 VAL CB C 10 32.760 32.678 0.082 1
1 20 . 6 1 1 A 10 10 VAL N N 10 119.730 123.869 -4.139 1
1 21 . 6 1 1 A 11 11 ILE H H 11 8.230 9.016 -0.786 1
1 22 . 6 1 1 A 11 11 ILE HA H 11 4.090 4.872 -0.782 1
1 32 . 6 1 1 A 11 11 ILE C C 11 175.850 174.910 0.940 1
1 33 . 6 1 1 A 11 11 ILE CA C 11 60.800 59.723 1.077 1
1 34 . 6 1 1 A 11 11 ILE CB C 11 38.470 38.978 -0.508 1
1 38 . 6 1 1 A 11 11 ILE N N 11 125.570 128.235 -2.665 1
1 39 . 6 1 1 A 12 12 MET H H 12 8.370 8.790 -0.420 1
1 40 . 6 1 1 A 12 12 MET HA H 12 4.540 4.944 -0.404 1
1 48 . 6 1 1 A 12 12 MET C C 12 174.830 175.785 -0.955 1
1 49 . 6 1 1 A 12 12 MET CA C 12 54.790 54.114 0.676 1
1 50 . 6 1 1 A 12 12 MET CB C 12 32.640 33.563 -0.923 1
1 53 . 6 1 1 A 12 12 MET N N 12 125.930 127.039 -1.109 1
1 54 . 6 1 1 A 13 13 SER H H 13 7.990 8.761 -0.771 1
1 55 . 6 1 1 A 13 13 SER HA H 13 5.030 5.434 -0.404 1
1 58 . 6 1 1 A 13 13 SER C C 13 174.330 173.335 0.995 1
1 59 . 6 1 1 A 13 13 SER CA C 13 57.320 55.741 1.579 1
1 60 . 6 1 1 A 13 13 SER CB C 13 64.790 66.309 -1.519 1
1 61 . 6 1 1 A 13 13 SER N N 13 116.400 118.195 -1.795 1
1 62 . 6 1 1 A 14 14 GLU H H 14 9.430 8.720 0.710 1
1 63 . 6 1 1 A 14 14 GLU HA H 14 5.250 5.135 0.115 1
1 68 . 6 1 1 A 14 14 GLU C C 14 172.980 174.333 -1.353 1
1 69 . 6 1 1 A 14 14 GLU CA C 14 55.390 55.319 0.071 1
1 70 . 6 1 1 A 14 14 GLU CB C 14 33.910 34.187 -0.277 1
1 72 . 6 1 1 A 14 14 GLU N N 14 123.670 122.239 1.431 1
1 73 . 6 1 1 A 15 15 LEU H H 15 8.930 8.848 0.082 1
1 74 . 6 1 1 A 15 15 LEU HA H 15 4.870 5.155 -0.285 1
1 84 . 6 1 1 A 15 15 LEU C C 15 174.000 175.142 -1.142 1
1 85 . 6 1 1 A 15 15 LEU CA C 15 53.020 53.551 -0.531 1
1 86 . 6 1 1 A 15 15 LEU CB C 15 46.040 45.730 0.310 1
1 90 . 6 1 1 A 15 15 LEU N N 15 125.350 126.023 -0.673 1
1 91 . 6 1 1 A 16 16 LYS H H 16 8.840 8.698 0.142 1
1 92 . 6 1 1 A 16 16 LYS HA H 16 5.360 4.945 0.415 1
1 101 . 6 1 1 A 16 16 LYS C C 16 175.660 175.850 -0.190 1
1 102 . 6 1 1 A 16 16 LYS CA C 16 54.940 55.306 -0.366 1
1 103 . 6 1 1 A 16 16 LYS CB C 16 34.280 34.226 0.054 1
1 107 . 6 1 1 A 16 16 LYS N N 16 124.640 123.962 0.678 1
1 108 . 6 1 1 A 17 17 LEU H H 17 8.820 9.096 -0.276 1
1 109 . 6 1 1 A 17 17 LEU HA H 17 5.430 5.200 0.230 1
1 119 . 6 1 1 A 17 17 LEU C C 17 174.630 175.597 -0.967 1
1 120 . 6 1 1 A 17 17 LEU CA C 17 52.900 53.502 -0.602 1
1 121 . 6 1 1 A 17 17 LEU CB C 17 46.910 45.546 1.364 1
1 125 . 6 1 1 A 17 17 LEU N N 17 123.460 126.456 -2.996 1
1 126 . 6 1 1 A 18 18 LYS H H 18 9.110 8.703 0.407 1
1 127 . 6 1 1 A 18 18 LYS HA H 18 5.490 5.017 0.473 1
1 136 . 6 1 1 A 18 18 LYS CA C 18 52.270 52.758 -0.488 1
1 137 . 6 1 1 A 18 18 LYS CB C 18 37.500 36.153 1.347 1
1 141 . 6 1 1 A 18 18 LYS N N 18 122.230 123.764 -1.534 1
1 142 . 6 1 1 A 19 19 PRO HA H 19 4.100 4.418 -0.318 1
1 149 . 6 1 1 A 19 19 PRO CA C 19 62.440 62.466 -0.026 1
1 150 . 6 1 1 A 19 19 PRO CB C 19 30.640 32.229 -1.589 1
1 153 . 6 1 1 A 20 20 LEU H H 20 8.490 8.352 0.138 1
1 154 . 6 1 1 A 20 20 LEU HA H 20 4.320 4.206 0.114 1
1 164 . 6 1 1 A 20 20 LEU CA C 20 57.680 58.686 -1.006 1
1 165 . 6 1 1 A 20 20 LEU CB C 20 38.760 41.009 -2.249 1
1 169 . 6 1 1 A 20 20 LEU N N 20 123.250 119.564 3.686 1
1 170 . 6 1 1 A 21 21 PRO HA H 21 4.530 4.515 0.015 1
1 177 . 6 1 1 A 21 21 PRO CA C 21 62.880 62.425 0.455 1
1 178 . 6 1 1 A 21 21 PRO CB C 21 31.420 32.197 -0.777 1
1 181 . 6 1 1 A 22 22 LYS H H 22 8.180 8.396 -0.216 1
1 182 . 6 1 1 A 22 22 LYS HA H 22 4.110 4.395 -0.285 1
1 191 . 6 1 1 A 22 22 LYS C C 22 175.680 175.406 0.274 1
1 192 . 6 1 1 A 22 22 LYS CA C 22 56.210 55.774 0.436 1
1 193 . 6 1 1 A 22 22 LYS CB C 22 30.660 31.981 -1.321 1
1 197 . 6 1 1 A 22 22 LYS N N 22 119.160 121.898 -2.738 1
1 198 . 6 1 1 A 23 23 VAL H H 23 7.530 8.456 -0.926 1
1 199 . 6 1 1 A 23 23 VAL HA H 23 4.280 4.753 -0.473 1
1 207 . 6 1 1 A 23 23 VAL C C 23 173.690 173.492 0.198 1
1 208 . 6 1 1 A 23 23 VAL CA C 23 59.830 59.517 0.313 1
1 209 . 6 1 1 A 23 23 VAL CB C 23 34.550 35.518 -0.968 1
1 212 . 6 1 1 A 23 23 VAL N N 23 121.820 122.863 -1.043 1
1 213 . 6 1 1 A 24 24 GLU H H 24 8.270 8.901 -0.631 1
1 214 . 6 1 1 A 24 24 GLU HA H 24 4.330 4.869 -0.539 1
1 219 . 6 1 1 A 24 24 GLU C C 24 175.390 175.415 -0.025 1
1 220 . 6 1 1 A 24 24 GLU CA C 24 55.220 55.068 0.152 1
1 221 . 6 1 1 A 24 24 GLU CB C 24 29.970 31.461 -1.491 1
1 223 . 6 1 1 A 24 24 GLU N N 24 125.610 126.916 -1.306 1
1 224 . 6 1 1 A 25 25 LEU H H 25 8.480 8.712 -0.232 1
1 225 . 6 1 1 A 25 25 LEU HA H 25 4.520 4.431 0.089 1
1 235 . 6 1 1 A 25 25 LEU CA C 25 51.660 51.126 0.534 1
1 236 . 6 1 1 A 25 25 LEU CB C 25 41.750 41.426 0.324 1
1 240 . 6 1 1 A 25 25 LEU N N 25 125.880 126.801 -0.921 1
1 241 . 6 1 1 A 26 26 PRO HA H 26 4.760 4.659 0.101 1
1 248 . 6 1 1 A 26 26 PRO CA C 26 61.330 61.927 -0.597 1
1 249 . 6 1 1 A 26 26 PRO CB C 26 31.060 32.846 -1.786 1
1 252 . 6 1 1 A 27 27 PRO HA H 27 4.390 4.421 -0.031 1
1 259 . 6 1 1 A 27 27 PRO CA C 27 64.550 64.850 -0.300 1
1 260 . 6 1 1 A 27 27 PRO CB C 27 31.770 31.744 0.026 1
1 263 . 6 1 1 A 28 28 ASP H H 28 8.560 8.830 -0.270 1
1 264 . 6 1 1 A 28 28 ASP HA H 28 4.620 4.410 0.210 1
1 267 . 6 1 1 A 28 28 ASP C C 28 177.100 178.820 -1.720 1
1 268 . 6 1 1 A 28 28 ASP CA C 28 53.890 56.529 -2.639 1
1 269 . 6 1 1 A 28 28 ASP CB C 28 39.120 39.621 -0.501 1
1 270 . 6 1 1 A 28 28 ASP N N 28 115.820 117.843 -2.023 1
1 271 . 6 1 1 A 29 29 PHE H H 29 7.940 7.931 0.009 1
1 272 . 6 1 1 A 29 29 PHE HA H 29 4.180 4.288 -0.108 1
1 280 . 6 1 1 A 29 29 PHE C C 29 176.740 178.321 -1.581 1
1 281 . 6 1 1 A 29 29 PHE CA C 29 61.020 60.925 0.095 1
1 282 . 6 1 1 A 29 29 PHE CB C 29 39.230 38.955 0.275 1
1 288 . 6 1 1 A 29 29 PHE N N 29 119.610 118.205 1.405 1
1 289 . 6 1 1 A 30 30 VAL H H 30 8.010 8.423 -0.413 1
1 290 . 6 1 1 A 30 30 VAL HA H 30 3.350 3.773 -0.423 1
1 298 . 6 1 1 A 30 30 VAL C C 30 176.400 177.387 -0.987 1
1 299 . 6 1 1 A 30 30 VAL CA C 30 66.510 64.834 1.676 1
1 300 . 6 1 1 A 30 30 VAL CB C 30 31.020 31.071 -0.051 1
1 303 . 6 1 1 A 30 30 VAL N N 30 116.370 119.437 -3.067 1
1 304 . 6 1 1 A 31 31 ASP H H 31 7.420 8.170 -0.750 1
1 305 . 6 1 1 A 31 31 ASP HA H 31 4.310 4.369 -0.059 1
1 308 . 6 1 1 A 31 31 ASP C C 31 178.360 178.597 -0.237 1
1 309 . 6 1 1 A 31 31 ASP CA C 31 57.110 57.444 -0.334 1
1 310 . 6 1 1 A 31 31 ASP CB C 31 40.450 41.133 -0.683 1
1 311 . 6 1 1 A 31 31 ASP N N 31 119.190 121.626 -2.436 1
1 312 . 6 1 1 A 32 32 VAL H H 32 7.190 7.539 -0.349 1
1 313 . 6 1 1 A 32 32 VAL HA H 32 3.510 3.546 -0.036 1
1 321 . 6 1 1 A 32 32 VAL C C 32 178.100 178.559 -0.459 1
1 322 . 6 1 1 A 32 32 VAL CA C 32 65.570 66.367 -0.797 1
1 323 . 6 1 1 A 32 32 VAL CB C 32 31.410 31.288 0.122 1
1 326 . 6 1 1 A 32 32 VAL N N 32 119.830 119.095 0.735 1
1 327 . 6 1 1 A 33 33 ILE H H 33 7.660 8.454 -0.794 1
1 328 . 6 1 1 A 33 33 ILE HA H 33 3.170 3.518 -0.348 1
1 338 . 6 1 1 A 33 33 ILE C C 33 176.660 178.071 -1.411 1
1 339 . 6 1 1 A 33 33 ILE CA C 33 65.220 65.222 -0.002 1
1 340 . 6 1 1 A 33 33 ILE CB C 33 37.500 37.784 -0.284 1
1 344 . 6 1 1 A 33 33 ILE N N 33 118.490 120.891 -2.401 1
1 345 . 6 1 1 A 34 34 ARG H H 34 7.830 7.711 0.119 1
1 346 . 6 1 1 A 34 34 ARG HA H 34 3.380 3.908 -0.528 1
1 354 . 6 1 1 A 34 34 ARG C C 34 178.060 177.707 0.353 1
1 355 . 6 1 1 A 34 34 ARG CA C 34 60.570 59.102 1.468 1
1 356 . 6 1 1 A 34 34 ARG CB C 34 30.070 29.840 0.230 1
1 359 . 6 1 1 A 34 34 ARG N N 34 118.260 120.021 -1.761 1
1 361 . 6 1 1 A 35 35 ILE H H 35 7.350 7.868 -0.518 1
1 362 . 6 1 1 A 35 35 ILE HA H 35 3.720 3.695 0.025 1
1 372 . 6 1 1 A 35 35 ILE C C 35 179.090 178.065 1.025 1
1 373 . 6 1 1 A 35 35 ILE CA C 35 64.060 65.373 -1.313 1
1 374 . 6 1 1 A 35 35 ILE CB C 35 38.030 37.387 0.643 1
1 378 . 6 1 1 A 35 35 ILE N N 35 116.750 119.393 -2.643 1
1 379 . 6 1 1 A 36 36 LYS H H 36 7.880 7.691 0.189 1
1 380 . 6 1 1 A 36 36 LYS HA H 36 4.090 3.961 0.129 1
1 389 . 6 1 1 A 36 36 LYS C C 36 178.560 178.931 -0.371 1
1 390 . 6 1 1 A 36 36 LYS CA C 36 57.650 59.779 -2.129 1
1 391 . 6 1 1 A 36 36 LYS CB C 36 32.090 32.251 -0.161 1
1 395 . 6 1 1 A 36 36 LYS N N 36 118.700 119.775 -1.075 1
1 396 . 6 1 1 A 37 37 LEU H H 37 7.860 7.395 0.465 1
1 397 . 6 1 1 A 37 37 LEU HA H 37 4.230 4.296 -0.066 1
1 407 . 6 1 1 A 37 37 LEU C C 37 175.880 176.745 -0.865 1
1 408 . 6 1 1 A 37 37 LEU CA C 37 54.090 55.448 -1.358 1
1 409 . 6 1 1 A 37 37 LEU CB C 37 43.310 42.381 0.929 1
1 413 . 6 1 1 A 37 37 LEU N N 37 116.380 117.568 -1.188 1
1 414 . 6 1 1 A 38 38 GLN H H 38 7.190 7.436 -0.246 1
1 415 . 6 1 1 A 38 38 GLN HA H 38 3.530 4.468 -0.938 1
1 422 . 6 1 1 A 38 38 GLN C C 38 177.480 176.260 1.220 1
1 423 . 6 1 1 A 38 38 GLN CA C 38 58.370 56.746 1.624 1
1 424 . 6 1 1 A 38 38 GLN CB C 38 28.300 28.670 -0.370 1
1 426 . 6 1 1 A 38 38 GLN N N 38 119.210 117.701 1.509 1
1 428 . 6 1 1 A 39 39 GLY H H 39 8.940 8.761 0.179 1
1 429 . 6 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 6 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 6 1 1 A 39 39 GLY C C 39 174.070 174.390 -0.320 1
1 432 . 6 1 1 A 39 39 GLY CA C 39 45.280 45.039 0.241 1
1 433 . 6 1 1 A 39 39 GLY N N 39 113.490 112.405 1.085 1
1 434 . 6 1 1 A 40 40 LYS H H 40 8.350 7.622 0.728 1
1 435 . 6 1 1 A 40 40 LYS HA H 40 4.400 4.604 -0.204 1
1 444 . 6 1 1 A 40 40 LYS C C 40 175.560 175.851 -0.291 1
1 445 . 6 1 1 A 40 40 LYS CA C 40 55.660 54.704 0.956 1
1 446 . 6 1 1 A 40 40 LYS CB C 40 32.870 33.749 -0.879 1
1 450 . 6 1 1 A 40 40 LYS N N 40 122.060 119.978 2.082 1
1 451 . 6 1 1 A 41 41 THR H H 41 8.410 8.563 -0.153 1
1 452 . 6 1 1 A 41 41 THR HA H 41 5.330 4.929 0.401 1
1 457 . 6 1 1 A 41 41 THR C C 41 174.860 174.093 0.767 1
1 458 . 6 1 1 A 41 41 THR CA C 41 62.040 61.642 0.398 1
1 459 . 6 1 1 A 41 41 THR CB C 41 69.420 71.042 -1.622 1
1 461 . 6 1 1 A 41 41 THR N N 41 118.150 117.525 0.625 1
1 462 . 6 1 1 A 42 42 VAL H H 42 9.140 9.027 0.113 1
1 463 . 6 1 1 A 42 42 VAL HA H 42 4.570 5.072 -0.502 1
1 471 . 6 1 1 A 42 42 VAL C C 42 172.970 174.293 -1.323 1
1 472 . 6 1 1 A 42 42 VAL CA C 42 59.450 59.236 0.214 1
1 473 . 6 1 1 A 42 42 VAL CB C 42 35.880 35.953 -0.073 1
1 476 . 6 1 1 A 42 42 VAL N N 42 122.510 119.082 3.428 1
1 477 . 6 1 1 A 43 43 ARG H H 43 8.420 8.678 -0.258 1
1 478 . 6 1 1 A 43 43 ARG HA H 43 4.750 4.841 -0.091 1
1 485 . 6 1 1 A 43 43 ARG C C 43 175.650 175.792 -0.142 1
1 486 . 6 1 1 A 43 43 ARG CA C 43 53.650 53.827 -0.177 1
1 487 . 6 1 1 A 43 43 ARG CB C 43 33.870 34.078 -0.208 1
1 490 . 6 1 1 A 43 43 ARG N N 43 120.640 122.877 -2.237 1
1 491 . 6 1 1 A 44 44 THR H H 44 8.370 8.565 -0.195 1
1 492 . 6 1 1 A 44 44 THR HA H 44 3.410 3.756 -0.346 1
1 497 . 6 1 1 A 44 44 THR C C 44 175.020 175.808 -0.788 1
1 498 . 6 1 1 A 44 44 THR CA C 44 65.660 65.023 0.637 1
1 499 . 6 1 1 A 44 44 THR CB C 44 69.400 68.327 1.073 1
1 501 . 6 1 1 A 44 44 THR N N 44 118.590 117.568 1.022 1
1 502 . 6 1 1 A 45 45 GLY H H 45 9.090 8.744 0.346 1
1 503 . 6 1 1 A 45 45 GLY HA2 H 45 3.470 4.014 -0.544 1
1 504 . 6 1 1 A 45 45 GLY HA3 H 45 4.470 4.017 0.453 1
1 505 . 6 1 1 A 45 45 GLY C C 45 174.350 173.840 0.510 1
1 506 . 6 1 1 A 45 45 GLY CA C 45 45.000 44.940 0.060 1
1 507 . 6 1 1 A 45 45 GLY N N 45 117.350 114.982 2.368 1
1 508 . 6 1 1 A 46 46 ASP H H 46 8.010 7.914 0.096 1
1 509 . 6 1 1 A 46 46 ASP HA H 46 4.470 4.623 -0.153 1
1 512 . 6 1 1 A 46 46 ASP C C 46 174.570 174.370 0.200 1
1 513 . 6 1 1 A 46 46 ASP CA C 46 55.570 55.404 0.166 1
1 514 . 6 1 1 A 46 46 ASP CB C 46 41.680 41.524 0.156 1
1 515 . 6 1 1 A 46 46 ASP N N 46 122.240 122.215 0.025 1
1 516 . 6 1 1 A 47 47 VAL H H 47 8.330 8.433 -0.103 1
1 517 . 6 1 1 A 47 47 VAL HA H 47 4.950 4.891 0.059 1
1 525 . 6 1 1 A 47 47 VAL C C 47 176.330 175.533 0.797 1
1 526 . 6 1 1 A 47 47 VAL CA C 47 61.710 60.919 0.791 1
1 527 . 6 1 1 A 47 47 VAL CB C 47 32.900 35.313 -2.413 1
1 530 . 6 1 1 A 47 47 VAL N N 47 119.860 121.824 -1.964 1
1 531 . 6 1 1 A 48 48 ILE H H 48 9.160 8.706 0.454 1
1 532 . 6 1 1 A 48 48 ILE HA H 48 4.630 5.191 -0.561 1
1 542 . 6 1 1 A 48 48 ILE C C 48 174.400 174.451 -0.051 1
1 543 . 6 1 1 A 48 48 ILE CA C 48 58.990 59.281 -0.291 1
1 544 . 6 1 1 A 48 48 ILE CB C 48 41.810 42.181 -0.371 1
1 548 . 6 1 1 A 48 48 ILE N N 48 124.990 121.471 3.519 1
1 549 . 6 1 1 A 49 49 GLY H H 49 8.660 8.909 -0.249 1
1 550 . 6 1 1 A 49 49 GLY HA2 H 49 4.950 4.319 0.631 1
1 551 . 6 1 1 A 49 49 GLY HA3 H 49 3.620 4.361 -0.741 1
1 552 . 6 1 1 A 49 49 GLY C C 49 172.920 171.986 0.934 1
1 553 . 6 1 1 A 49 49 GLY CA C 49 44.580 44.399 0.181 1
1 554 . 6 1 1 A 49 49 GLY N N 49 112.060 109.330 2.730 1
1 555 . 6 1 1 A 50 50 ILE H H 50 8.810 9.012 -0.202 1
1 556 . 6 1 1 A 50 50 ILE HA H 50 4.370 4.843 -0.473 1
1 566 . 6 1 1 A 50 50 ILE C C 50 174.500 174.799 -0.299 1
1 567 . 6 1 1 A 50 50 ILE CA C 50 59.550 59.733 -0.183 1
1 568 . 6 1 1 A 50 50 ILE CB C 50 41.300 42.117 -0.817 1
1 572 . 6 1 1 A 50 50 ILE N N 50 123.220 125.009 -1.789 1
1 573 . 6 1 1 A 51 51 SER H H 51 8.540 8.822 -0.282 1
1 574 . 6 1 1 A 51 51 SER HA H 51 4.830 4.979 -0.149 1
1 577 . 6 1 1 A 51 51 SER C C 51 174.130 173.867 0.263 1
1 578 . 6 1 1 A 51 51 SER CA C 51 57.770 57.047 0.723 1
1 579 . 6 1 1 A 51 51 SER CB C 51 63.040 64.130 -1.090 1
1 580 . 6 1 1 A 51 51 SER N N 51 121.430 122.524 -1.094 1
1 581 . 6 1 1 A 52 52 ILE H H 52 8.930 8.798 0.132 1
1 582 . 6 1 1 A 52 52 ILE HA H 52 4.290 4.634 -0.344 1
1 592 . 6 1 1 A 52 52 ILE C C 52 175.280 176.067 -0.787 1
1 593 . 6 1 1 A 52 52 ILE CA C 52 60.250 60.375 -0.125 1
1 594 . 6 1 1 A 52 52 ILE CB C 52 39.840 40.344 -0.504 1
1 598 . 6 1 1 A 52 52 ILE N N 52 127.060 128.214 -1.154 1
1 599 . 6 1 1 A 53 53 LEU H H 53 9.380 9.492 -0.112 1
1 600 . 6 1 1 A 53 53 LEU HA H 53 3.890 4.094 -0.204 1
1 610 . 6 1 1 A 53 53 LEU C C 53 177.130 176.988 0.142 1
1 611 . 6 1 1 A 53 53 LEU CA C 53 55.560 56.206 -0.646 1
1 612 . 6 1 1 A 53 53 LEU CB C 53 39.370 40.681 -1.311 1
1 616 . 6 1 1 A 53 53 LEU N N 53 126.770 129.940 -3.170 1
1 617 . 6 1 1 A 54 54 GLY H H 54 8.310 8.702 -0.392 1
1 618 . 6 1 1 A 54 54 GLY HA2 H 54 3.490 3.897 -0.407 1
1 619 . 6 1 1 A 54 54 GLY HA3 H 54 4.080 3.898 0.182 1
1 620 . 6 1 1 A 54 54 GLY C C 54 173.690 173.765 -0.075 1
1 621 . 6 1 1 A 54 54 GLY CA C 54 45.340 45.661 -0.321 1
1 622 . 6 1 1 A 54 54 GLY N N 54 103.820 104.474 -0.654 1
1 623 . 6 1 1 A 55 55 LYS H H 55 7.730 8.022 -0.292 1
1 624 . 6 1 1 A 55 55 LYS HA H 55 4.560 4.784 -0.224 1
1 633 . 6 1 1 A 55 55 LYS C C 55 174.550 175.013 -0.463 1
1 634 . 6 1 1 A 55 55 LYS CA C 55 54.140 54.307 -0.167 1
1 635 . 6 1 1 A 55 55 LYS CB C 55 34.620 35.659 -1.039 1
1 639 . 6 1 1 A 55 55 LYS N N 55 121.160 120.025 1.135 1
1 640 . 6 1 1 A 56 56 GLU H H 56 8.490 8.687 -0.197 1
1 641 . 6 1 1 A 56 56 GLU HA H 56 4.280 4.682 -0.402 1
1 646 . 6 1 1 A 56 56 GLU C C 56 175.730 175.223 0.507 1
1 647 . 6 1 1 A 56 56 GLU CA C 56 56.730 56.286 0.444 1
1 648 . 6 1 1 A 56 56 GLU CB C 56 30.070 30.595 -0.525 1
1 650 . 6 1 1 A 56 56 GLU N N 56 124.090 124.338 -0.248 1
1 651 . 6 1 1 A 57 57 VAL H H 57 8.920 8.512 0.408 1
1 652 . 6 1 1 A 57 57 VAL HA H 57 4.030 4.788 -0.758 1
1 660 . 6 1 1 A 57 57 VAL C C 57 174.610 173.810 0.800 1
1 661 . 6 1 1 A 57 57 VAL CA C 57 61.680 59.565 2.115 1
1 662 . 6 1 1 A 57 57 VAL CB C 57 33.880 34.456 -0.576 1
1 665 . 6 1 1 A 57 57 VAL N N 57 129.960 126.754 3.206 1
1 666 . 6 1 1 A 58 58 LYS H H 58 7.860 8.732 -0.872 1
1 667 . 6 1 1 A 58 58 LYS HA H 58 5.120 4.824 0.296 1
1 676 . 6 1 1 A 58 58 LYS C C 58 175.380 175.649 -0.269 1
1 677 . 6 1 1 A 58 58 LYS CA C 58 55.200 54.751 0.449 1
1 678 . 6 1 1 A 58 58 LYS CB C 58 34.670 34.291 0.379 1
1 682 . 6 1 1 A 58 58 LYS N N 58 124.790 127.363 -2.573 1
1 683 . 6 1 1 A 59 59 PHE H H 59 9.270 9.091 0.179 1
1 684 . 6 1 1 A 59 59 PHE HA H 59 4.960 5.161 -0.201 1
1 692 . 6 1 1 A 59 59 PHE C C 59 173.950 174.193 -0.243 1
1 693 . 6 1 1 A 59 59 PHE CA C 59 55.910 56.239 -0.329 1
1 694 . 6 1 1 A 59 59 PHE CB C 59 42.950 42.163 0.787 1
1 700 . 6 1 1 A 59 59 PHE N N 59 118.270 122.417 -4.147 1
1 701 . 6 1 1 A 60 60 LYS H H 60 9.170 8.862 0.308 1
1 702 . 6 1 1 A 60 60 LYS HA H 60 4.910 5.001 -0.091 1
1 711 . 6 1 1 A 60 60 LYS C C 60 176.230 175.853 0.377 1
1 712 . 6 1 1 A 60 60 LYS CA C 60 53.910 54.505 -0.595 1
1 713 . 6 1 1 A 60 60 LYS CB C 60 35.170 35.229 -0.059 1
1 717 . 6 1 1 A 60 60 LYS N N 60 121.960 124.055 -2.095 1
1 718 . 6 1 1 A 61 61 VAL H H 61 9.400 8.790 0.610 1
1 719 . 6 1 1 A 61 61 VAL HA H 61 4.170 4.073 0.097 1
1 727 . 6 1 1 A 61 61 VAL C C 61 175.500 175.336 0.164 1
1 728 . 6 1 1 A 61 61 VAL CA C 61 61.980 63.261 -1.281 1
1 729 . 6 1 1 A 61 61 VAL CB C 61 29.490 31.226 -1.736 1
1 732 . 6 1 1 A 61 61 VAL N N 61 127.140 126.962 0.178 1
1 733 . 6 1 1 A 62 62 VAL H H 62 8.390 8.631 -0.241 1
1 734 . 6 1 1 A 62 62 VAL HA H 62 3.650 3.969 -0.319 1
1 742 . 6 1 1 A 62 62 VAL C C 62 176.440 176.027 0.413 1
1 743 . 6 1 1 A 62 62 VAL CA C 62 64.930 64.425 0.505 1
1 744 . 6 1 1 A 62 62 VAL CB C 62 32.130 32.422 -0.292 1
1 747 . 6 1 1 A 62 62 VAL N N 62 132.840 129.125 3.715 1
1 748 . 6 1 1 A 63 63 GLN H H 63 7.470 7.115 0.355 1
1 749 . 6 1 1 A 63 63 GLN HA H 63 4.270 4.605 -0.335 1
1 756 . 6 1 1 A 63 63 GLN C C 63 172.290 173.289 -0.999 1
1 757 . 6 1 1 A 63 63 GLN CA C 63 56.640 55.435 1.205 1
1 758 . 6 1 1 A 63 63 GLN CB C 63 32.630 31.883 0.747 1
1 760 . 6 1 1 A 63 63 GLN N N 63 114.500 116.892 -2.392 1
1 762 . 6 1 1 A 64 64 ALA H H 64 8.200 8.896 -0.696 1
1 763 . 6 1 1 A 64 64 ALA HA H 64 4.830 5.295 -0.465 1
1 767 . 6 1 1 A 64 64 ALA C C 64 174.270 175.740 -1.470 1
1 768 . 6 1 1 A 64 64 ALA CA C 64 50.800 49.973 0.827 1
1 769 . 6 1 1 A 64 64 ALA CB C 64 20.100 21.533 -1.433 1
1 770 . 6 1 1 A 64 64 ALA N N 64 131.410 128.831 2.579 1
1 771 . 6 1 1 A 65 65 TYR H H 65 8.860 8.505 0.355 1
1 772 . 6 1 1 A 65 65 TYR HA H 65 4.540 4.959 -0.419 1
1 779 . 6 1 1 A 65 65 TYR CA C 65 54.270 55.146 -0.876 1
1 780 . 6 1 1 A 65 65 TYR CB C 65 41.360 40.696 0.664 1
1 785 . 6 1 1 A 65 65 TYR N N 65 124.140 119.970 4.170 1
1 786 . 6 1 1 A 66 66 PRO HA H 66 4.120 4.755 -0.635 1
1 793 . 6 1 1 A 66 66 PRO CA C 66 63.450 62.370 1.080 1
1 794 . 6 1 1 A 66 66 PRO CB C 66 34.170 32.832 1.338 1
1 797 . 6 1 1 A 67 67 SER H H 67 7.380 8.253 -0.873 1
1 798 . 6 1 1 A 67 67 SER HA H 67 4.720 5.014 -0.294 1
1 801 . 6 1 1 A 67 67 SER CA C 67 54.250 56.035 -1.785 1
1 802 . 6 1 1 A 67 67 SER CB C 67 64.530 63.851 0.679 1
1 803 . 6 1 1 A 67 67 SER N N 67 106.200 116.700 -10.500 1
1 804 . 6 1 1 A 68 68 PRO HA H 68 4.880 4.677 0.203 1
1 811 . 6 1 1 A 68 68 PRO CA C 68 62.990 62.528 0.462 1
1 812 . 6 1 1 A 68 68 PRO CB C 68 35.220 33.263 1.957 1
1 815 . 6 1 1 A 69 69 LEU H H 69 8.960 7.929 1.031 1
1 816 . 6 1 1 A 69 69 LEU HA H 69 4.430 5.116 -0.686 1
1 826 . 6 1 1 A 69 69 LEU C C 69 174.570 175.248 -0.678 1
1 827 . 6 1 1 A 69 69 LEU CA C 69 53.900 52.664 1.236 1
1 828 . 6 1 1 A 69 69 LEU CB C 69 44.210 46.093 -1.883 1
1 832 . 6 1 1 A 69 69 LEU N N 69 120.480 116.758 3.722 1
1 833 . 6 1 1 A 70 70 ARG H H 70 8.130 8.371 -0.241 1
1 834 . 6 1 1 A 70 70 ARG HA H 70 4.930 4.852 0.078 1
1 841 . 6 1 1 A 70 70 ARG C C 70 175.460 176.406 -0.946 1
1 842 . 6 1 1 A 70 70 ARG CA C 70 54.040 55.098 -1.058 1
1 843 . 6 1 1 A 70 70 ARG CB C 70 30.550 32.115 -1.565 1
1 846 . 6 1 1 A 70 70 ARG N N 70 125.180 119.642 5.538 1
1 847 . 6 1 1 A 71 71 VAL H H 71 8.450 8.300 0.150 1
1 848 . 6 1 1 A 71 71 VAL HA H 71 3.410 4.436 -1.026 1
1 856 . 6 1 1 A 71 71 VAL C C 71 175.460 175.494 -0.034 1
1 857 . 6 1 1 A 71 71 VAL CA C 71 65.210 62.322 2.888 1
1 858 . 6 1 1 A 71 71 VAL CB C 71 29.840 31.691 -1.851 1
1 861 . 6 1 1 A 71 71 VAL N N 71 128.170 122.145 6.025 1
1 862 . 6 1 1 A 72 72 GLU H H 72 8.620 8.458 0.162 1
1 863 . 6 1 1 A 72 72 GLU HA H 72 4.870 4.825 0.045 1
1 868 . 6 1 1 A 72 72 GLU C C 72 176.960 176.018 0.942 1
1 869 . 6 1 1 A 72 72 GLU CA C 72 54.330 54.436 -0.106 1
1 870 . 6 1 1 A 72 72 GLU CB C 72 33.280 33.106 0.174 1
1 872 . 6 1 1 A 72 72 GLU N N 72 127.670 127.065 0.605 1
1 873 . 6 1 1 A 73 73 ASP H H 73 8.700 9.036 -0.336 1
1 874 . 6 1 1 A 73 73 ASP HA H 73 4.150 4.265 -0.115 1
1 877 . 6 1 1 A 73 73 ASP C C 73 177.460 178.116 -0.656 1
1 878 . 6 1 1 A 73 73 ASP CA C 73 57.620 56.738 0.882 1
1 879 . 6 1 1 A 73 73 ASP CB C 73 40.360 40.549 -0.189 1
1 880 . 6 1 1 A 73 73 ASP N N 73 121.140 124.473 -3.333 1
1 881 . 6 1 1 A 74 74 ARG H H 74 7.760 7.723 0.037 1
1 882 . 6 1 1 A 74 74 ARG HA H 74 4.280 4.354 -0.074 1
1 889 . 6 1 1 A 74 74 ARG C C 74 176.510 176.806 -0.296 1
1 890 . 6 1 1 A 74 74 ARG CA C 74 55.450 56.862 -1.412 1
1 891 . 6 1 1 A 74 74 ARG CB C 74 29.990 30.835 -0.845 1
1 894 . 6 1 1 A 74 74 ARG N N 74 112.890 116.983 -4.093 1
1 895 . 6 1 1 A 75 75 THR H H 75 7.700 7.409 0.291 1
1 896 . 6 1 1 A 75 75 THR HA H 75 4.020 4.269 -0.249 1
1 901 . 6 1 1 A 75 75 THR C C 75 173.810 173.961 -0.151 1
1 902 . 6 1 1 A 75 75 THR CA C 75 64.060 63.776 0.284 1
1 903 . 6 1 1 A 75 75 THR CB C 75 69.350 69.732 -0.382 1
1 905 . 6 1 1 A 75 75 THR N N 75 120.650 116.536 4.114 1
1 906 . 6 1 1 A 76 76 LYS H H 76 8.520 8.283 0.237 1
1 907 . 6 1 1 A 76 76 LYS HA H 76 4.270 4.686 -0.416 1
1 916 . 6 1 1 A 76 76 LYS C C 76 174.560 175.794 -1.234 1
1 917 . 6 1 1 A 76 76 LYS CA C 76 56.280 56.124 0.156 1
1 918 . 6 1 1 A 76 76 LYS CB C 76 33.120 33.461 -0.341 1
1 922 . 6 1 1 A 76 76 LYS N N 76 130.950 127.209 3.741 1
1 923 . 6 1 1 A 77 77 ILE H H 77 8.430 8.758 -0.328 1
1 924 . 6 1 1 A 77 77 ILE HA H 77 4.850 5.234 -0.384 1
1 934 . 6 1 1 A 77 77 ILE C C 77 174.650 174.834 -0.184 1
1 935 . 6 1 1 A 77 77 ILE CA C 77 59.820 60.126 -0.306 1
1 936 . 6 1 1 A 77 77 ILE CB C 77 38.280 40.872 -2.592 1
1 940 . 6 1 1 A 77 77 ILE N N 77 128.020 123.789 4.231 1
1 941 . 6 1 1 A 78 78 THR H H 78 8.870 8.831 0.039 1
1 942 . 6 1 1 A 78 78 THR HA H 78 4.470 5.113 -0.643 1
1 947 . 6 1 1 A 78 78 THR C C 78 172.760 173.492 -0.732 1
1 948 . 6 1 1 A 78 78 THR CA C 78 60.740 61.438 -0.698 1
1 949 . 6 1 1 A 78 78 THR CB C 78 71.320 71.430 -0.110 1
1 951 . 6 1 1 A 78 78 THR N N 78 123.870 124.124 -0.254 1
1 952 . 6 1 1 A 79 79 LEU H H 79 8.820 8.974 -0.154 1
1 953 . 6 1 1 A 79 79 LEU HA H 79 5.140 5.130 0.010 1
1 963 . 6 1 1 A 79 79 LEU C C 79 176.610 175.811 0.799 1
1 964 . 6 1 1 A 79 79 LEU CA C 79 53.280 53.373 -0.093 1
1 965 . 6 1 1 A 79 79 LEU CB C 79 42.600 43.025 -0.425 1
1 969 . 6 1 1 A 79 79 LEU N N 79 127.070 126.481 0.589 1
1 970 . 6 1 1 A 80 80 VAL H H 80 8.800 9.001 -0.201 1
1 971 . 6 1 1 A 80 80 VAL HA H 80 4.260 4.543 -0.283 1
1 979 . 6 1 1 A 80 80 VAL CA C 80 61.350 61.885 -0.535 1
1 980 . 6 1 1 A 80 80 VAL CB C 80 32.790 32.682 0.108 1
1 983 . 6 1 1 A 80 80 VAL N N 80 124.120 125.404 -1.284 1
1 984 . 6 1 1 A 81 81 THR H H 81 8.160 8.715 -0.555 1
1 985 . 6 1 1 A 81 81 THR HA H 81 4.410 4.666 -0.256 1
1 990 . 6 1 1 A 81 81 THR CA C 81 60.800 60.457 0.343 1
1 991 . 6 1 1 A 81 81 THR CB C 81 69.650 68.851 0.799 1
1 993 . 6 1 1 A 81 81 THR N N 81 114.500 115.034 -0.534 1
1 1 . 7 1 1 A 9 9 GLY H H 9 8.390 8.474 -0.084 1
1 2 . 7 1 1 A 9 9 GLY HA2 H 9 3.900 4.066 -0.166 1
1 3 . 7 1 1 A 9 9 GLY HA3 H 9 3.860 4.067 -0.207 1
1 4 . 7 1 1 A 9 9 GLY CA C 9 45.150 44.590 0.560 1
1 5 . 7 1 1 A 9 9 GLY N N 9 110.000 112.347 -2.347 1
1 6 . 7 1 1 A 10 10 VAL H H 10 7.870 8.491 -0.621 1
1 7 . 7 1 1 A 10 10 VAL HA H 10 4.040 4.395 -0.355 1
1 15 . 7 1 1 A 10 10 VAL C C 10 175.880 175.390 0.490 1
1 16 . 7 1 1 A 10 10 VAL CA C 10 62.110 62.308 -0.198 1
1 17 . 7 1 1 A 10 10 VAL CB C 10 32.760 32.251 0.509 1
1 20 . 7 1 1 A 10 10 VAL N N 10 119.730 119.671 0.059 1
1 21 . 7 1 1 A 11 11 ILE H H 11 8.230 8.866 -0.636 1
1 22 . 7 1 1 A 11 11 ILE HA H 11 4.090 5.050 -0.960 1
1 32 . 7 1 1 A 11 11 ILE C C 11 175.850 174.856 0.994 1
1 33 . 7 1 1 A 11 11 ILE CA C 11 60.800 59.487 1.313 1
1 34 . 7 1 1 A 11 11 ILE CB C 11 38.470 40.651 -2.181 1
1 38 . 7 1 1 A 11 11 ILE N N 11 125.570 127.827 -2.257 1
1 39 . 7 1 1 A 12 12 MET H H 12 8.370 9.069 -0.699 1
1 40 . 7 1 1 A 12 12 MET HA H 12 4.540 5.398 -0.858 1
1 48 . 7 1 1 A 12 12 MET C C 12 174.830 175.247 -0.417 1
1 49 . 7 1 1 A 12 12 MET CA C 12 54.790 53.662 1.128 1
1 50 . 7 1 1 A 12 12 MET CB C 12 32.640 34.890 -2.250 1
1 53 . 7 1 1 A 12 12 MET N N 12 125.930 123.696 2.234 1
1 54 . 7 1 1 A 13 13 SER H H 13 7.990 8.922 -0.932 1
1 55 . 7 1 1 A 13 13 SER HA H 13 5.030 5.311 -0.281 1
1 58 . 7 1 1 A 13 13 SER C C 13 174.330 173.146 1.184 1
1 59 . 7 1 1 A 13 13 SER CA C 13 57.320 56.304 1.016 1
1 60 . 7 1 1 A 13 13 SER CB C 13 64.790 66.550 -1.760 1
1 61 . 7 1 1 A 13 13 SER N N 13 116.400 116.792 -0.392 1
1 62 . 7 1 1 A 14 14 GLU H H 14 9.430 8.896 0.534 1
1 63 . 7 1 1 A 14 14 GLU HA H 14 5.250 5.121 0.129 1
1 68 . 7 1 1 A 14 14 GLU C C 14 172.980 174.165 -1.185 1
1 69 . 7 1 1 A 14 14 GLU CA C 14 55.390 55.375 0.015 1
1 70 . 7 1 1 A 14 14 GLU CB C 14 33.910 34.226 -0.316 1
1 72 . 7 1 1 A 14 14 GLU N N 14 123.670 121.669 2.001 1
1 73 . 7 1 1 A 15 15 LEU H H 15 8.930 8.857 0.073 1
1 74 . 7 1 1 A 15 15 LEU HA H 15 4.870 5.150 -0.280 1
1 84 . 7 1 1 A 15 15 LEU C C 15 174.000 174.488 -0.488 1
1 85 . 7 1 1 A 15 15 LEU CA C 15 53.020 53.995 -0.975 1
1 86 . 7 1 1 A 15 15 LEU CB C 15 46.040 46.151 -0.111 1
1 90 . 7 1 1 A 15 15 LEU N N 15 125.350 125.767 -0.417 1
1 91 . 7 1 1 A 16 16 LYS H H 16 8.840 8.797 0.043 1
1 92 . 7 1 1 A 16 16 LYS HA H 16 5.360 4.957 0.403 1
1 101 . 7 1 1 A 16 16 LYS C C 16 175.660 175.597 0.063 1
1 102 . 7 1 1 A 16 16 LYS CA C 16 54.940 55.049 -0.109 1
1 103 . 7 1 1 A 16 16 LYS CB C 16 34.280 34.795 -0.515 1
1 107 . 7 1 1 A 16 16 LYS N N 16 124.640 126.754 -2.114 1
1 108 . 7 1 1 A 17 17 LEU H H 17 8.820 8.890 -0.070 1
1 109 . 7 1 1 A 17 17 LEU HA H 17 5.430 5.139 0.291 1
1 119 . 7 1 1 A 17 17 LEU C C 17 174.630 175.556 -0.926 1
1 120 . 7 1 1 A 17 17 LEU CA C 17 52.900 53.534 -0.634 1
1 121 . 7 1 1 A 17 17 LEU CB C 17 46.910 45.560 1.350 1
1 125 . 7 1 1 A 17 17 LEU N N 17 123.460 125.207 -1.747 1
1 126 . 7 1 1 A 18 18 LYS H H 18 9.110 8.657 0.453 1
1 127 . 7 1 1 A 18 18 LYS HA H 18 5.490 4.974 0.516 1
1 136 . 7 1 1 A 18 18 LYS CA C 18 52.270 53.002 -0.732 1
1 137 . 7 1 1 A 18 18 LYS CB C 18 37.500 36.367 1.133 1
1 141 . 7 1 1 A 18 18 LYS N N 18 122.230 123.613 -1.383 1
1 142 . 7 1 1 A 19 19 PRO HA H 19 4.100 4.822 -0.722 1
1 149 . 7 1 1 A 19 19 PRO CA C 19 62.440 62.639 -0.199 1
1 150 . 7 1 1 A 19 19 PRO CB C 19 30.640 32.301 -1.661 1
1 153 . 7 1 1 A 20 20 LEU H H 20 8.490 8.638 -0.148 1
1 154 . 7 1 1 A 20 20 LEU HA H 20 4.320 4.319 0.001 1
1 164 . 7 1 1 A 20 20 LEU CA C 20 57.680 58.662 -0.982 1
1 165 . 7 1 1 A 20 20 LEU CB C 20 38.760 41.403 -2.643 1
1 169 . 7 1 1 A 20 20 LEU N N 20 123.250 119.647 3.603 1
1 170 . 7 1 1 A 21 21 PRO HA H 21 4.530 4.535 -0.005 1
1 177 . 7 1 1 A 21 21 PRO CA C 21 62.880 62.366 0.514 1
1 178 . 7 1 1 A 21 21 PRO CB C 21 31.420 32.452 -1.032 1
1 181 . 7 1 1 A 22 22 LYS H H 22 8.180 8.459 -0.279 1
1 182 . 7 1 1 A 22 22 LYS HA H 22 4.110 4.429 -0.319 1
1 191 . 7 1 1 A 22 22 LYS C C 22 175.680 175.406 0.274 1
1 192 . 7 1 1 A 22 22 LYS CA C 22 56.210 55.708 0.502 1
1 193 . 7 1 1 A 22 22 LYS CB C 22 30.660 31.320 -0.660 1
1 197 . 7 1 1 A 22 22 LYS N N 22 119.160 122.088 -2.928 1
1 198 . 7 1 1 A 23 23 VAL H H 23 7.530 7.913 -0.383 1
1 199 . 7 1 1 A 23 23 VAL HA H 23 4.280 4.776 -0.496 1
1 207 . 7 1 1 A 23 23 VAL C C 23 173.690 173.103 0.587 1
1 208 . 7 1 1 A 23 23 VAL CA C 23 59.830 59.662 0.168 1
1 209 . 7 1 1 A 23 23 VAL CB C 23 34.550 35.521 -0.971 1
1 212 . 7 1 1 A 23 23 VAL N N 23 121.820 123.549 -1.729 1
1 213 . 7 1 1 A 24 24 GLU H H 24 8.270 8.977 -0.707 1
1 214 . 7 1 1 A 24 24 GLU HA H 24 4.330 5.072 -0.742 1
1 219 . 7 1 1 A 24 24 GLU C C 24 175.390 174.806 0.584 1
1 220 . 7 1 1 A 24 24 GLU CA C 24 55.220 54.378 0.842 1
1 221 . 7 1 1 A 24 24 GLU CB C 24 29.970 32.824 -2.854 1
1 223 . 7 1 1 A 24 24 GLU N N 24 125.610 128.007 -2.397 1
1 224 . 7 1 1 A 25 25 LEU H H 25 8.480 8.769 -0.289 1
1 225 . 7 1 1 A 25 25 LEU HA H 25 4.520 4.457 0.063 1
1 235 . 7 1 1 A 25 25 LEU CA C 25 51.660 51.559 0.101 1
1 236 . 7 1 1 A 25 25 LEU CB C 25 41.750 41.069 0.681 1
1 240 . 7 1 1 A 25 25 LEU N N 25 125.880 128.379 -2.499 1
1 241 . 7 1 1 A 26 26 PRO HA H 26 4.760 4.617 0.143 1
1 248 . 7 1 1 A 26 26 PRO CA C 26 61.330 61.877 -0.547 1
1 249 . 7 1 1 A 26 26 PRO CB C 26 31.060 32.695 -1.635 1
1 252 . 7 1 1 A 27 27 PRO HA H 27 4.390 4.403 -0.013 1
1 259 . 7 1 1 A 27 27 PRO CA C 27 64.550 64.832 -0.282 1
1 260 . 7 1 1 A 27 27 PRO CB C 27 31.770 31.732 0.038 1
1 263 . 7 1 1 A 28 28 ASP H H 28 8.560 8.777 -0.217 1
1 264 . 7 1 1 A 28 28 ASP HA H 28 4.620 4.428 0.192 1
1 267 . 7 1 1 A 28 28 ASP C C 28 177.100 178.760 -1.660 1
1 268 . 7 1 1 A 28 28 ASP CA C 28 53.890 56.296 -2.406 1
1 269 . 7 1 1 A 28 28 ASP CB C 28 39.120 39.600 -0.480 1
1 270 . 7 1 1 A 28 28 ASP N N 28 115.820 117.828 -2.008 1
1 271 . 7 1 1 A 29 29 PHE H H 29 7.940 7.900 0.040 1
1 272 . 7 1 1 A 29 29 PHE HA H 29 4.180 4.341 -0.161 1
1 280 . 7 1 1 A 29 29 PHE C C 29 176.740 178.251 -1.511 1
1 281 . 7 1 1 A 29 29 PHE CA C 29 61.020 61.040 -0.020 1
1 282 . 7 1 1 A 29 29 PHE CB C 29 39.230 38.610 0.620 1
1 288 . 7 1 1 A 29 29 PHE N N 29 119.610 118.357 1.253 1
1 289 . 7 1 1 A 30 30 VAL H H 30 8.010 8.457 -0.447 1
1 290 . 7 1 1 A 30 30 VAL HA H 30 3.350 3.739 -0.389 1
1 298 . 7 1 1 A 30 30 VAL C C 30 176.400 177.095 -0.695 1
1 299 . 7 1 1 A 30 30 VAL CA C 30 66.510 64.796 1.714 1
1 300 . 7 1 1 A 30 30 VAL CB C 30 31.020 31.050 -0.030 1
1 303 . 7 1 1 A 30 30 VAL N N 30 116.370 119.581 -3.211 1
1 304 . 7 1 1 A 31 31 ASP H H 31 7.420 7.969 -0.549 1
1 305 . 7 1 1 A 31 31 ASP HA H 31 4.310 4.364 -0.054 1
1 308 . 7 1 1 A 31 31 ASP C C 31 178.360 178.882 -0.522 1
1 309 . 7 1 1 A 31 31 ASP CA C 31 57.110 57.087 0.023 1
1 310 . 7 1 1 A 31 31 ASP CB C 31 40.450 40.893 -0.443 1
1 311 . 7 1 1 A 31 31 ASP N N 31 119.190 121.574 -2.384 1
1 312 . 7 1 1 A 32 32 VAL H H 32 7.190 7.377 -0.187 1
1 313 . 7 1 1 A 32 32 VAL HA H 32 3.510 3.555 -0.045 1
1 321 . 7 1 1 A 32 32 VAL C C 32 178.100 178.533 -0.433 1
1 322 . 7 1 1 A 32 32 VAL CA C 32 65.570 66.377 -0.807 1
1 323 . 7 1 1 A 32 32 VAL CB C 32 31.410 31.288 0.122 1
1 326 . 7 1 1 A 32 32 VAL N N 32 119.830 120.055 -0.225 1
1 327 . 7 1 1 A 33 33 ILE H H 33 7.660 8.440 -0.780 1
1 328 . 7 1 1 A 33 33 ILE HA H 33 3.170 3.567 -0.397 1
1 338 . 7 1 1 A 33 33 ILE C C 33 176.660 178.165 -1.505 1
1 339 . 7 1 1 A 33 33 ILE CA C 33 65.220 65.254 -0.034 1
1 340 . 7 1 1 A 33 33 ILE CB C 33 37.500 37.699 -0.199 1
1 344 . 7 1 1 A 33 33 ILE N N 33 118.490 120.884 -2.394 1
1 345 . 7 1 1 A 34 34 ARG H H 34 7.830 7.722 0.108 1
1 346 . 7 1 1 A 34 34 ARG HA H 34 3.380 3.907 -0.527 1
1 354 . 7 1 1 A 34 34 ARG C C 34 178.060 177.616 0.444 1
1 355 . 7 1 1 A 34 34 ARG CA C 34 60.570 58.911 1.659 1
1 356 . 7 1 1 A 34 34 ARG CB C 34 30.070 29.797 0.273 1
1 359 . 7 1 1 A 34 34 ARG N N 34 118.260 119.967 -1.707 1
1 361 . 7 1 1 A 35 35 ILE H H 35 7.350 7.873 -0.523 1
1 362 . 7 1 1 A 35 35 ILE HA H 35 3.720 3.709 0.011 1
1 372 . 7 1 1 A 35 35 ILE C C 35 179.090 178.095 0.995 1
1 373 . 7 1 1 A 35 35 ILE CA C 35 64.060 65.362 -1.302 1
1 374 . 7 1 1 A 35 35 ILE CB C 35 38.030 37.551 0.479 1
1 378 . 7 1 1 A 35 35 ILE N N 35 116.750 119.447 -2.697 1
1 379 . 7 1 1 A 36 36 LYS H H 36 7.880 7.671 0.209 1
1 380 . 7 1 1 A 36 36 LYS HA H 36 4.090 3.976 0.114 1
1 389 . 7 1 1 A 36 36 LYS C C 36 178.560 178.788 -0.228 1
1 390 . 7 1 1 A 36 36 LYS CA C 36 57.650 59.668 -2.018 1
1 391 . 7 1 1 A 36 36 LYS CB C 36 32.090 32.173 -0.083 1
1 395 . 7 1 1 A 36 36 LYS N N 36 118.700 119.758 -1.058 1
1 396 . 7 1 1 A 37 37 LEU H H 37 7.860 7.498 0.362 1
1 397 . 7 1 1 A 37 37 LEU HA H 37 4.230 4.324 -0.094 1
1 407 . 7 1 1 A 37 37 LEU C C 37 175.880 176.744 -0.864 1
1 408 . 7 1 1 A 37 37 LEU CA C 37 54.090 55.237 -1.147 1
1 409 . 7 1 1 A 37 37 LEU CB C 37 43.310 42.350 0.960 1
1 413 . 7 1 1 A 37 37 LEU N N 37 116.380 117.387 -1.007 1
1 414 . 7 1 1 A 38 38 GLN H H 38 7.190 7.524 -0.334 1
1 415 . 7 1 1 A 38 38 GLN HA H 38 3.530 4.410 -0.880 1
1 422 . 7 1 1 A 38 38 GLN C C 38 177.480 176.254 1.226 1
1 423 . 7 1 1 A 38 38 GLN CA C 38 58.370 56.670 1.700 1
1 424 . 7 1 1 A 38 38 GLN CB C 38 28.300 28.823 -0.523 1
1 426 . 7 1 1 A 38 38 GLN N N 38 119.210 117.929 1.281 1
1 428 . 7 1 1 A 39 39 GLY H H 39 8.940 8.840 0.100 1
1 429 . 7 1 1 A 39 39 GLY HA2 H 39 3.540 3.992 -0.452 1
1 430 . 7 1 1 A 39 39 GLY HA3 H 39 4.220 3.992 0.228 1
1 431 . 7 1 1 A 39 39 GLY C C 39 174.070 174.465 -0.395 1
1 432 . 7 1 1 A 39 39 GLY CA C 39 45.280 45.044 0.236 1
1 433 . 7 1 1 A 39 39 GLY N N 39 113.490 112.127 1.363 1
1 434 . 7 1 1 A 40 40 LYS H H 40 8.350 7.562 0.788 1
1 435 . 7 1 1 A 40 40 LYS HA H 40 4.400 4.601 -0.201 1
1 444 . 7 1 1 A 40 40 LYS C C 40 175.560 175.903 -0.343 1
1 445 . 7 1 1 A 40 40 LYS CA C 40 55.660 54.722 0.938 1
1 446 . 7 1 1 A 40 40 LYS CB C 40 32.870 33.738 -0.868 1
1 450 . 7 1 1 A 40 40 LYS N N 40 122.060 119.973 2.087 1
1 451 . 7 1 1 A 41 41 THR H H 41 8.410 8.552 -0.142 1
1 452 . 7 1 1 A 41 41 THR HA H 41 5.330 4.991 0.339 1
1 457 . 7 1 1 A 41 41 THR C C 41 174.860 174.257 0.603 1
1 458 . 7 1 1 A 41 41 THR CA C 41 62.040 61.675 0.365 1
1 459 . 7 1 1 A 41 41 THR CB C 41 69.420 70.907 -1.487 1
1 461 . 7 1 1 A 41 41 THR N N 41 118.150 117.202 0.948 1
1 462 . 7 1 1 A 42 42 VAL H H 42 9.140 9.022 0.118 1
1 463 . 7 1 1 A 42 42 VAL HA H 42 4.570 5.038 -0.468 1
1 471 . 7 1 1 A 42 42 VAL C C 42 172.970 174.289 -1.319 1
1 472 . 7 1 1 A 42 42 VAL CA C 42 59.450 59.080 0.370 1
1 473 . 7 1 1 A 42 42 VAL CB C 42 35.880 35.647 0.233 1
1 476 . 7 1 1 A 42 42 VAL N N 42 122.510 119.612 2.898 1
1 477 . 7 1 1 A 43 43 ARG H H 43 8.420 8.690 -0.270 1
1 478 . 7 1 1 A 43 43 ARG HA H 43 4.750 4.871 -0.121 1
1 485 . 7 1 1 A 43 43 ARG C C 43 175.650 175.840 -0.190 1
1 486 . 7 1 1 A 43 43 ARG CA C 43 53.650 53.834 -0.184 1
1 487 . 7 1 1 A 43 43 ARG CB C 43 33.870 33.924 -0.054 1
1 490 . 7 1 1 A 43 43 ARG N N 43 120.640 122.944 -2.304 1
1 491 . 7 1 1 A 44 44 THR H H 44 8.370 8.569 -0.199 1
1 492 . 7 1 1 A 44 44 THR HA H 44 3.410 3.761 -0.351 1
1 497 . 7 1 1 A 44 44 THR C C 44 175.020 175.810 -0.790 1
1 498 . 7 1 1 A 44 44 THR CA C 44 65.660 65.028 0.632 1
1 499 . 7 1 1 A 44 44 THR CB C 44 69.400 68.330 1.070 1
1 501 . 7 1 1 A 44 44 THR N N 44 118.590 117.585 1.005 1
1 502 . 7 1 1 A 45 45 GLY H H 45 9.090 8.777 0.313 1
1 503 . 7 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 7 1 1 A 45 45 GLY HA3 H 45 4.470 4.021 0.449 1
1 505 . 7 1 1 A 45 45 GLY C C 45 174.350 173.844 0.506 1
1 506 . 7 1 1 A 45 45 GLY CA C 45 45.000 44.959 0.041 1
1 507 . 7 1 1 A 45 45 GLY N N 45 117.350 114.973 2.377 1
1 508 . 7 1 1 A 46 46 ASP H H 46 8.010 7.858 0.152 1
1 509 . 7 1 1 A 46 46 ASP HA H 46 4.470 4.627 -0.157 1
1 512 . 7 1 1 A 46 46 ASP C C 46 174.570 174.418 0.152 1
1 513 . 7 1 1 A 46 46 ASP CA C 46 55.570 55.432 0.138 1
1 514 . 7 1 1 A 46 46 ASP CB C 46 41.680 41.554 0.126 1
1 515 . 7 1 1 A 46 46 ASP N N 46 122.240 122.227 0.013 1
1 516 . 7 1 1 A 47 47 VAL H H 47 8.330 8.331 -0.001 1
1 517 . 7 1 1 A 47 47 VAL HA H 47 4.950 4.896 0.054 1
1 525 . 7 1 1 A 47 47 VAL C C 47 176.330 175.435 0.895 1
1 526 . 7 1 1 A 47 47 VAL CA C 47 61.710 60.875 0.835 1
1 527 . 7 1 1 A 47 47 VAL CB C 47 32.900 34.645 -1.745 1
1 530 . 7 1 1 A 47 47 VAL N N 47 119.860 121.728 -1.868 1
1 531 . 7 1 1 A 48 48 ILE H H 48 9.160 8.706 0.454 1
1 532 . 7 1 1 A 48 48 ILE HA H 48 4.630 5.128 -0.498 1
1 542 . 7 1 1 A 48 48 ILE C C 48 174.400 174.361 0.039 1
1 543 . 7 1 1 A 48 48 ILE CA C 48 58.990 59.219 -0.229 1
1 544 . 7 1 1 A 48 48 ILE CB C 48 41.810 42.313 -0.503 1
1 548 . 7 1 1 A 48 48 ILE N N 48 124.990 121.671 3.319 1
1 549 . 7 1 1 A 49 49 GLY H H 49 8.660 8.945 -0.285 1
1 550 . 7 1 1 A 49 49 GLY HA2 H 49 4.950 4.232 0.718 1
1 551 . 7 1 1 A 49 49 GLY HA3 H 49 3.620 4.255 -0.635 1
1 552 . 7 1 1 A 49 49 GLY C C 49 172.920 172.040 0.880 1
1 553 . 7 1 1 A 49 49 GLY CA C 49 44.580 44.388 0.192 1
1 554 . 7 1 1 A 49 49 GLY N N 49 112.060 109.676 2.384 1
1 555 . 7 1 1 A 50 50 ILE H H 50 8.810 8.794 0.016 1
1 556 . 7 1 1 A 50 50 ILE HA H 50 4.370 4.812 -0.442 1
1 566 . 7 1 1 A 50 50 ILE C C 50 174.500 174.642 -0.142 1
1 567 . 7 1 1 A 50 50 ILE CA C 50 59.550 59.893 -0.343 1
1 568 . 7 1 1 A 50 50 ILE CB C 50 41.300 42.108 -0.808 1
1 572 . 7 1 1 A 50 50 ILE N N 50 123.220 125.303 -2.083 1
1 573 . 7 1 1 A 51 51 SER H H 51 8.540 8.860 -0.320 1
1 574 . 7 1 1 A 51 51 SER HA H 51 4.830 4.997 -0.167 1
1 577 . 7 1 1 A 51 51 SER C C 51 174.130 173.867 0.263 1
1 578 . 7 1 1 A 51 51 SER CA C 51 57.770 57.178 0.592 1
1 579 . 7 1 1 A 51 51 SER CB C 51 63.040 64.071 -1.031 1
1 580 . 7 1 1 A 51 51 SER N N 51 121.430 122.538 -1.108 1
1 581 . 7 1 1 A 52 52 ILE H H 52 8.930 8.744 0.186 1
1 582 . 7 1 1 A 52 52 ILE HA H 52 4.290 4.600 -0.310 1
1 592 . 7 1 1 A 52 52 ILE C C 52 175.280 176.014 -0.734 1
1 593 . 7 1 1 A 52 52 ILE CA C 52 60.250 60.219 0.031 1
1 594 . 7 1 1 A 52 52 ILE CB C 52 39.840 40.522 -0.682 1
1 598 . 7 1 1 A 52 52 ILE N N 52 127.060 127.291 -0.231 1
1 599 . 7 1 1 A 53 53 LEU H H 53 9.380 9.450 -0.070 1
1 600 . 7 1 1 A 53 53 LEU HA H 53 3.890 4.082 -0.192 1
1 610 . 7 1 1 A 53 53 LEU C C 53 177.130 176.985 0.145 1
1 611 . 7 1 1 A 53 53 LEU CA C 53 55.560 56.196 -0.636 1
1 612 . 7 1 1 A 53 53 LEU CB C 53 39.370 40.653 -1.283 1
1 616 . 7 1 1 A 53 53 LEU N N 53 126.770 129.568 -2.798 1
1 617 . 7 1 1 A 54 54 GLY H H 54 8.310 8.693 -0.383 1
1 618 . 7 1 1 A 54 54 GLY HA2 H 54 3.490 3.898 -0.408 1
1 619 . 7 1 1 A 54 54 GLY HA3 H 54 4.080 3.900 0.180 1
1 620 . 7 1 1 A 54 54 GLY C C 54 173.690 173.926 -0.236 1
1 621 . 7 1 1 A 54 54 GLY CA C 54 45.340 45.750 -0.410 1
1 622 . 7 1 1 A 54 54 GLY N N 54 103.820 104.435 -0.615 1
1 623 . 7 1 1 A 55 55 LYS H H 55 7.730 7.770 -0.040 1
1 624 . 7 1 1 A 55 55 LYS HA H 55 4.560 4.853 -0.293 1
1 633 . 7 1 1 A 55 55 LYS C C 55 174.550 175.126 -0.576 1
1 634 . 7 1 1 A 55 55 LYS CA C 55 54.140 55.056 -0.916 1
1 635 . 7 1 1 A 55 55 LYS CB C 55 34.620 35.567 -0.947 1
1 639 . 7 1 1 A 55 55 LYS N N 55 121.160 120.186 0.974 1
1 640 . 7 1 1 A 56 56 GLU H H 56 8.490 8.796 -0.306 1
1 641 . 7 1 1 A 56 56 GLU HA H 56 4.280 4.633 -0.353 1
1 646 . 7 1 1 A 56 56 GLU C C 56 175.730 175.144 0.586 1
1 647 . 7 1 1 A 56 56 GLU CA C 56 56.730 56.274 0.456 1
1 648 . 7 1 1 A 56 56 GLU CB C 56 30.070 30.698 -0.628 1
1 650 . 7 1 1 A 56 56 GLU N N 56 124.090 128.654 -4.564 1
1 651 . 7 1 1 A 57 57 VAL H H 57 8.920 8.351 0.569 1
1 652 . 7 1 1 A 57 57 VAL HA H 57 4.030 4.702 -0.672 1
1 660 . 7 1 1 A 57 57 VAL C C 57 174.610 173.382 1.228 1
1 661 . 7 1 1 A 57 57 VAL CA C 57 61.680 59.379 2.301 1
1 662 . 7 1 1 A 57 57 VAL CB C 57 33.880 34.186 -0.306 1
1 665 . 7 1 1 A 57 57 VAL N N 57 129.960 126.575 3.385 1
1 666 . 7 1 1 A 58 58 LYS H H 58 7.860 8.564 -0.704 1
1 667 . 7 1 1 A 58 58 LYS HA H 58 5.120 4.613 0.507 1
1 676 . 7 1 1 A 58 58 LYS C C 58 175.380 175.657 -0.277 1
1 677 . 7 1 1 A 58 58 LYS CA C 58 55.200 54.730 0.470 1
1 678 . 7 1 1 A 58 58 LYS CB C 58 34.670 33.834 0.836 1
1 682 . 7 1 1 A 58 58 LYS N N 58 124.790 127.180 -2.390 1
1 683 . 7 1 1 A 59 59 PHE H H 59 9.270 8.891 0.379 1
1 684 . 7 1 1 A 59 59 PHE HA H 59 4.960 5.076 -0.116 1
1 692 . 7 1 1 A 59 59 PHE C C 59 173.950 174.444 -0.494 1
1 693 . 7 1 1 A 59 59 PHE CA C 59 55.910 56.427 -0.517 1
1 694 . 7 1 1 A 59 59 PHE CB C 59 42.950 41.914 1.036 1
1 700 . 7 1 1 A 59 59 PHE N N 59 118.270 123.032 -4.762 1
1 701 . 7 1 1 A 60 60 LYS H H 60 9.170 9.000 0.170 1
1 702 . 7 1 1 A 60 60 LYS HA H 60 4.910 4.952 -0.042 1
1 711 . 7 1 1 A 60 60 LYS C C 60 176.230 175.918 0.312 1
1 712 . 7 1 1 A 60 60 LYS CA C 60 53.910 54.636 -0.726 1
1 713 . 7 1 1 A 60 60 LYS CB C 60 35.170 34.933 0.237 1
1 717 . 7 1 1 A 60 60 LYS N N 60 121.960 124.387 -2.427 1
1 718 . 7 1 1 A 61 61 VAL H H 61 9.400 8.796 0.604 1
1 719 . 7 1 1 A 61 61 VAL HA H 61 4.170 4.001 0.169 1
1 727 . 7 1 1 A 61 61 VAL C C 61 175.500 175.222 0.278 1
1 728 . 7 1 1 A 61 61 VAL CA C 61 61.980 63.574 -1.594 1
1 729 . 7 1 1 A 61 61 VAL CB C 61 29.490 31.060 -1.570 1
1 732 . 7 1 1 A 61 61 VAL N N 61 127.140 127.210 -0.070 1
1 733 . 7 1 1 A 62 62 VAL H H 62 8.390 8.592 -0.202 1
1 734 . 7 1 1 A 62 62 VAL HA H 62 3.650 3.968 -0.318 1
1 742 . 7 1 1 A 62 62 VAL C C 62 176.440 176.069 0.371 1
1 743 . 7 1 1 A 62 62 VAL CA C 62 64.930 64.463 0.467 1
1 744 . 7 1 1 A 62 62 VAL CB C 62 32.130 32.459 -0.329 1
1 747 . 7 1 1 A 62 62 VAL N N 62 132.840 129.537 3.303 1
1 748 . 7 1 1 A 63 63 GLN H H 63 7.470 7.234 0.236 1
1 749 . 7 1 1 A 63 63 GLN HA H 63 4.270 4.641 -0.371 1
1 756 . 7 1 1 A 63 63 GLN C C 63 172.290 173.201 -0.911 1
1 757 . 7 1 1 A 63 63 GLN CA C 63 56.640 54.809 1.831 1
1 758 . 7 1 1 A 63 63 GLN CB C 63 32.630 32.650 -0.020 1
1 760 . 7 1 1 A 63 63 GLN N N 63 114.500 118.752 -4.252 1
1 762 . 7 1 1 A 64 64 ALA H H 64 8.200 8.516 -0.316 1
1 763 . 7 1 1 A 64 64 ALA HA H 64 4.830 5.364 -0.534 1
1 767 . 7 1 1 A 64 64 ALA C C 64 174.270 175.444 -1.174 1
1 768 . 7 1 1 A 64 64 ALA CA C 64 50.800 49.969 0.831 1
1 769 . 7 1 1 A 64 64 ALA CB C 64 20.100 21.723 -1.623 1
1 770 . 7 1 1 A 64 64 ALA N N 64 131.410 125.513 5.897 1
1 771 . 7 1 1 A 65 65 TYR H H 65 8.860 8.508 0.352 1
1 772 . 7 1 1 A 65 65 TYR HA H 65 4.540 4.960 -0.420 1
1 779 . 7 1 1 A 65 65 TYR CA C 65 54.270 55.128 -0.858 1
1 780 . 7 1 1 A 65 65 TYR CB C 65 41.360 40.604 0.756 1
1 785 . 7 1 1 A 65 65 TYR N N 65 124.140 120.177 3.963 1
1 786 . 7 1 1 A 66 66 PRO HA H 66 4.120 4.702 -0.582 1
1 793 . 7 1 1 A 66 66 PRO CA C 66 63.450 62.350 1.100 1
1 794 . 7 1 1 A 66 66 PRO CB C 66 34.170 32.724 1.446 1
1 797 . 7 1 1 A 67 67 SER H H 67 7.380 8.223 -0.843 1
1 798 . 7 1 1 A 67 67 SER HA H 67 4.720 4.974 -0.254 1
1 801 . 7 1 1 A 67 67 SER CA C 67 54.250 56.021 -1.771 1
1 802 . 7 1 1 A 67 67 SER CB C 67 64.530 63.819 0.711 1
1 803 . 7 1 1 A 67 67 SER N N 67 106.200 116.670 -10.470 1
1 804 . 7 1 1 A 68 68 PRO HA H 68 4.880 4.661 0.219 1
1 811 . 7 1 1 A 68 68 PRO CA C 68 62.990 62.467 0.523 1
1 812 . 7 1 1 A 68 68 PRO CB C 68 35.220 33.159 2.061 1
1 815 . 7 1 1 A 69 69 LEU H H 69 8.960 7.892 1.068 1
1 816 . 7 1 1 A 69 69 LEU HA H 69 4.430 5.117 -0.687 1
1 826 . 7 1 1 A 69 69 LEU C C 69 174.570 175.138 -0.568 1
1 827 . 7 1 1 A 69 69 LEU CA C 69 53.900 52.583 1.317 1
1 828 . 7 1 1 A 69 69 LEU CB C 69 44.210 46.127 -1.917 1
1 832 . 7 1 1 A 69 69 LEU N N 69 120.480 117.147 3.333 1
1 833 . 7 1 1 A 70 70 ARG H H 70 8.130 8.375 -0.245 1
1 834 . 7 1 1 A 70 70 ARG HA H 70 4.930 4.849 0.081 1
1 841 . 7 1 1 A 70 70 ARG C C 70 175.460 176.046 -0.586 1
1 842 . 7 1 1 A 70 70 ARG CA C 70 54.040 55.288 -1.248 1
1 843 . 7 1 1 A 70 70 ARG CB C 70 30.550 31.910 -1.360 1
1 846 . 7 1 1 A 70 70 ARG N N 70 125.180 119.645 5.535 1
1 847 . 7 1 1 A 71 71 VAL H H 71 8.450 8.162 0.288 1
1 848 . 7 1 1 A 71 71 VAL HA H 71 3.410 4.402 -0.992 1
1 856 . 7 1 1 A 71 71 VAL C C 71 175.460 175.430 0.030 1
1 857 . 7 1 1 A 71 71 VAL CA C 71 65.210 62.127 3.083 1
1 858 . 7 1 1 A 71 71 VAL CB C 71 29.840 31.517 -1.677 1
1 861 . 7 1 1 A 71 71 VAL N N 71 128.170 122.510 5.660 1
1 862 . 7 1 1 A 72 72 GLU H H 72 8.620 8.601 0.019 1
1 863 . 7 1 1 A 72 72 GLU HA H 72 4.870 4.817 0.053 1
1 868 . 7 1 1 A 72 72 GLU C C 72 176.960 176.235 0.725 1
1 869 . 7 1 1 A 72 72 GLU CA C 72 54.330 54.438 -0.108 1
1 870 . 7 1 1 A 72 72 GLU CB C 72 33.280 33.227 0.053 1
1 872 . 7 1 1 A 72 72 GLU N N 72 127.670 126.948 0.722 1
1 873 . 7 1 1 A 73 73 ASP H H 73 8.700 8.817 -0.117 1
1 874 . 7 1 1 A 73 73 ASP HA H 73 4.150 4.270 -0.120 1
1 877 . 7 1 1 A 73 73 ASP C C 73 177.460 177.704 -0.244 1
1 878 . 7 1 1 A 73 73 ASP CA C 73 57.620 57.265 0.355 1
1 879 . 7 1 1 A 73 73 ASP CB C 73 40.360 40.359 0.001 1
1 880 . 7 1 1 A 73 73 ASP N N 73 121.140 126.767 -5.627 1
1 881 . 7 1 1 A 74 74 ARG H H 74 7.760 8.183 -0.423 1
1 882 . 7 1 1 A 74 74 ARG HA H 74 4.280 4.293 -0.013 1
1 889 . 7 1 1 A 74 74 ARG C C 74 176.510 176.537 -0.027 1
1 890 . 7 1 1 A 74 74 ARG CA C 74 55.450 57.636 -2.186 1
1 891 . 7 1 1 A 74 74 ARG CB C 74 29.990 29.848 0.142 1
1 894 . 7 1 1 A 74 74 ARG N N 74 112.890 116.070 -3.180 1
1 895 . 7 1 1 A 75 75 THR H H 75 7.700 7.497 0.203 1
1 896 . 7 1 1 A 75 75 THR HA H 75 4.020 4.397 -0.377 1
1 901 . 7 1 1 A 75 75 THR C C 75 173.810 173.975 -0.165 1
1 902 . 7 1 1 A 75 75 THR CA C 75 64.060 63.465 0.595 1
1 903 . 7 1 1 A 75 75 THR CB C 75 69.350 69.765 -0.415 1
1 905 . 7 1 1 A 75 75 THR N N 75 120.650 116.391 4.259 1
1 906 . 7 1 1 A 76 76 LYS H H 76 8.520 8.263 0.257 1
1 907 . 7 1 1 A 76 76 LYS HA H 76 4.270 4.696 -0.426 1
1 916 . 7 1 1 A 76 76 LYS C C 76 174.560 175.903 -1.343 1
1 917 . 7 1 1 A 76 76 LYS CA C 76 56.280 55.980 0.300 1
1 918 . 7 1 1 A 76 76 LYS CB C 76 33.120 33.541 -0.421 1
1 922 . 7 1 1 A 76 76 LYS N N 76 130.950 126.729 4.221 1
1 923 . 7 1 1 A 77 77 ILE H H 77 8.430 8.724 -0.294 1
1 924 . 7 1 1 A 77 77 ILE HA H 77 4.850 5.232 -0.382 1
1 934 . 7 1 1 A 77 77 ILE C C 77 174.650 175.008 -0.358 1
1 935 . 7 1 1 A 77 77 ILE CA C 77 59.820 60.176 -0.356 1
1 936 . 7 1 1 A 77 77 ILE CB C 77 38.280 40.867 -2.587 1
1 940 . 7 1 1 A 77 77 ILE N N 77 128.020 123.615 4.405 1
1 941 . 7 1 1 A 78 78 THR H H 78 8.870 8.770 0.100 1
1 942 . 7 1 1 A 78 78 THR HA H 78 4.470 5.068 -0.598 1
1 947 . 7 1 1 A 78 78 THR C C 78 172.760 173.264 -0.504 1
1 948 . 7 1 1 A 78 78 THR CA C 78 60.740 61.310 -0.570 1
1 949 . 7 1 1 A 78 78 THR CB C 78 71.320 71.611 -0.291 1
1 951 . 7 1 1 A 78 78 THR N N 78 123.870 124.096 -0.226 1
1 952 . 7 1 1 A 79 79 LEU H H 79 8.820 8.930 -0.110 1
1 953 . 7 1 1 A 79 79 LEU HA H 79 5.140 4.999 0.141 1
1 963 . 7 1 1 A 79 79 LEU C C 79 176.610 175.761 0.849 1
1 964 . 7 1 1 A 79 79 LEU CA C 79 53.280 53.290 -0.010 1
1 965 . 7 1 1 A 79 79 LEU CB C 79 42.600 42.818 -0.218 1
1 969 . 7 1 1 A 79 79 LEU N N 79 127.070 126.532 0.538 1
1 970 . 7 1 1 A 80 80 VAL H H 80 8.800 8.498 0.302 1
1 971 . 7 1 1 A 80 80 VAL HA H 80 4.260 4.611 -0.351 1
1 979 . 7 1 1 A 80 80 VAL CA C 80 61.350 61.556 -0.206 1
1 980 . 7 1 1 A 80 80 VAL CB C 80 32.790 32.604 0.186 1
1 983 . 7 1 1 A 80 80 VAL N N 80 124.120 125.554 -1.434 1
1 984 . 7 1 1 A 81 81 THR H H 81 8.160 8.412 -0.252 1
1 985 . 7 1 1 A 81 81 THR HA H 81 4.410 5.220 -0.810 1
1 990 . 7 1 1 A 81 81 THR CA C 81 60.800 60.229 0.571 1
1 991 . 7 1 1 A 81 81 THR CB C 81 69.650 72.292 -2.642 1
1 993 . 7 1 1 A 81 81 THR N N 81 114.500 116.932 -2.432 1
1 1 . 8 1 1 A 9 9 GLY H H 9 8.390 8.498 -0.108 1
1 2 . 8 1 1 A 9 9 GLY HA2 H 9 3.900 4.190 -0.290 1
1 3 . 8 1 1 A 9 9 GLY HA3 H 9 3.860 4.191 -0.331 1
1 4 . 8 1 1 A 9 9 GLY CA C 9 45.150 44.458 0.692 1
1 5 . 8 1 1 A 9 9 GLY N N 9 110.000 112.523 -2.523 1
1 6 . 8 1 1 A 10 10 VAL H H 10 7.870 8.622 -0.752 1
1 7 . 8 1 1 A 10 10 VAL HA H 10 4.040 4.460 -0.420 1
1 15 . 8 1 1 A 10 10 VAL C C 10 175.880 175.015 0.865 1
1 16 . 8 1 1 A 10 10 VAL CA C 10 62.110 62.312 -0.202 1
1 17 . 8 1 1 A 10 10 VAL CB C 10 32.760 32.708 0.052 1
1 20 . 8 1 1 A 10 10 VAL N N 10 119.730 121.726 -1.996 1
1 21 . 8 1 1 A 11 11 ILE H H 11 8.230 9.019 -0.789 1
1 22 . 8 1 1 A 11 11 ILE HA H 11 4.090 4.826 -0.736 1
1 32 . 8 1 1 A 11 11 ILE C C 11 175.850 174.898 0.952 1
1 33 . 8 1 1 A 11 11 ILE CA C 11 60.800 59.786 1.014 1
1 34 . 8 1 1 A 11 11 ILE CB C 11 38.470 39.187 -0.717 1
1 38 . 8 1 1 A 11 11 ILE N N 11 125.570 128.364 -2.794 1
1 39 . 8 1 1 A 12 12 MET H H 12 8.370 8.768 -0.398 1
1 40 . 8 1 1 A 12 12 MET HA H 12 4.540 4.895 -0.355 1
1 48 . 8 1 1 A 12 12 MET C C 12 174.830 175.843 -1.013 1
1 49 . 8 1 1 A 12 12 MET CA C 12 54.790 54.195 0.595 1
1 50 . 8 1 1 A 12 12 MET CB C 12 32.640 33.548 -0.908 1
1 53 . 8 1 1 A 12 12 MET N N 12 125.930 127.240 -1.310 1
1 54 . 8 1 1 A 13 13 SER H H 13 7.990 8.736 -0.746 1
1 55 . 8 1 1 A 13 13 SER HA H 13 5.030 5.451 -0.421 1
1 58 . 8 1 1 A 13 13 SER C C 13 174.330 173.400 0.930 1
1 59 . 8 1 1 A 13 13 SER CA C 13 57.320 56.556 0.764 1
1 60 . 8 1 1 A 13 13 SER CB C 13 64.790 65.282 -0.492 1
1 61 . 8 1 1 A 13 13 SER N N 13 116.400 118.556 -2.156 1
1 62 . 8 1 1 A 14 14 GLU H H 14 9.430 8.656 0.774 1
1 63 . 8 1 1 A 14 14 GLU HA H 14 5.250 5.163 0.087 1
1 68 . 8 1 1 A 14 14 GLU C C 14 172.980 173.978 -0.998 1
1 69 . 8 1 1 A 14 14 GLU CA C 14 55.390 55.353 0.037 1
1 70 . 8 1 1 A 14 14 GLU CB C 14 33.910 34.127 -0.217 1
1 72 . 8 1 1 A 14 14 GLU N N 14 123.670 122.367 1.303 1
1 73 . 8 1 1 A 15 15 LEU H H 15 8.930 9.064 -0.134 1
1 74 . 8 1 1 A 15 15 LEU HA H 15 4.870 5.050 -0.180 1
1 84 . 8 1 1 A 15 15 LEU C C 15 174.000 174.695 -0.695 1
1 85 . 8 1 1 A 15 15 LEU CA C 15 53.020 53.681 -0.661 1
1 86 . 8 1 1 A 15 15 LEU CB C 15 46.040 45.444 0.596 1
1 90 . 8 1 1 A 15 15 LEU N N 15 125.350 126.121 -0.771 1
1 91 . 8 1 1 A 16 16 LYS H H 16 8.840 8.721 0.119 1
1 92 . 8 1 1 A 16 16 LYS HA H 16 5.360 4.984 0.376 1
1 101 . 8 1 1 A 16 16 LYS C C 16 175.660 175.706 -0.046 1
1 102 . 8 1 1 A 16 16 LYS CA C 16 54.940 55.199 -0.259 1
1 103 . 8 1 1 A 16 16 LYS CB C 16 34.280 34.449 -0.169 1
1 107 . 8 1 1 A 16 16 LYS N N 16 124.640 126.935 -2.295 1
1 108 . 8 1 1 A 17 17 LEU H H 17 8.820 8.882 -0.062 1
1 109 . 8 1 1 A 17 17 LEU HA H 17 5.430 5.186 0.244 1
1 119 . 8 1 1 A 17 17 LEU C C 17 174.630 175.681 -1.051 1
1 120 . 8 1 1 A 17 17 LEU CA C 17 52.900 53.659 -0.759 1
1 121 . 8 1 1 A 17 17 LEU CB C 17 46.910 45.872 1.038 1
1 125 . 8 1 1 A 17 17 LEU N N 17 123.460 125.707 -2.247 1
1 126 . 8 1 1 A 18 18 LYS H H 18 9.110 8.687 0.423 1
1 127 . 8 1 1 A 18 18 LYS HA H 18 5.490 5.070 0.420 1
1 136 . 8 1 1 A 18 18 LYS CA C 18 52.270 52.776 -0.506 1
1 137 . 8 1 1 A 18 18 LYS CB C 18 37.500 36.162 1.338 1
1 141 . 8 1 1 A 18 18 LYS N N 18 122.230 123.792 -1.562 1
1 142 . 8 1 1 A 19 19 PRO HA H 19 4.100 4.460 -0.360 1
1 149 . 8 1 1 A 19 19 PRO CA C 19 62.440 62.475 -0.035 1
1 150 . 8 1 1 A 19 19 PRO CB C 19 30.640 32.283 -1.643 1
1 153 . 8 1 1 A 20 20 LEU H H 20 8.490 8.356 0.134 1
1 154 . 8 1 1 A 20 20 LEU HA H 20 4.320 4.220 0.100 1
1 164 . 8 1 1 A 20 20 LEU CA C 20 57.680 58.693 -1.013 1
1 165 . 8 1 1 A 20 20 LEU CB C 20 38.760 41.022 -2.262 1
1 169 . 8 1 1 A 20 20 LEU N N 20 123.250 119.629 3.621 1
1 170 . 8 1 1 A 21 21 PRO HA H 21 4.530 4.527 0.003 1
1 177 . 8 1 1 A 21 21 PRO CA C 21 62.880 62.465 0.415 1
1 178 . 8 1 1 A 21 21 PRO CB C 21 31.420 32.261 -0.841 1
1 181 . 8 1 1 A 22 22 LYS H H 22 8.180 8.358 -0.178 1
1 182 . 8 1 1 A 22 22 LYS HA H 22 4.110 4.550 -0.440 1
1 191 . 8 1 1 A 22 22 LYS C C 22 175.680 175.346 0.334 1
1 192 . 8 1 1 A 22 22 LYS CA C 22 56.210 55.804 0.406 1
1 193 . 8 1 1 A 22 22 LYS CB C 22 30.660 32.956 -2.296 1
1 197 . 8 1 1 A 22 22 LYS N N 22 119.160 121.715 -2.555 1
1 198 . 8 1 1 A 23 23 VAL H H 23 7.530 8.501 -0.971 1
1 199 . 8 1 1 A 23 23 VAL HA H 23 4.280 4.749 -0.469 1
1 207 . 8 1 1 A 23 23 VAL C C 23 173.690 172.998 0.692 1
1 208 . 8 1 1 A 23 23 VAL CA C 23 59.830 59.607 0.223 1
1 209 . 8 1 1 A 23 23 VAL CB C 23 34.550 35.579 -1.029 1
1 212 . 8 1 1 A 23 23 VAL N N 23 121.820 125.347 -3.527 1
1 213 . 8 1 1 A 24 24 GLU H H 24 8.270 8.960 -0.690 1
1 214 . 8 1 1 A 24 24 GLU HA H 24 4.330 4.859 -0.529 1
1 219 . 8 1 1 A 24 24 GLU C C 24 175.390 174.865 0.525 1
1 220 . 8 1 1 A 24 24 GLU CA C 24 55.220 54.817 0.403 1
1 221 . 8 1 1 A 24 24 GLU CB C 24 29.970 31.648 -1.678 1
1 223 . 8 1 1 A 24 24 GLU N N 24 125.610 128.728 -3.118 1
1 224 . 8 1 1 A 25 25 LEU H H 25 8.480 8.718 -0.238 1
1 225 . 8 1 1 A 25 25 LEU HA H 25 4.520 4.471 0.049 1
1 235 . 8 1 1 A 25 25 LEU CA C 25 51.660 51.087 0.573 1
1 236 . 8 1 1 A 25 25 LEU CB C 25 41.750 41.672 0.078 1
1 240 . 8 1 1 A 25 25 LEU N N 25 125.880 129.036 -3.156 1
1 241 . 8 1 1 A 26 26 PRO HA H 26 4.760 4.676 0.084 1
1 248 . 8 1 1 A 26 26 PRO CA C 26 61.330 61.949 -0.619 1
1 249 . 8 1 1 A 26 26 PRO CB C 26 31.060 32.858 -1.798 1
1 252 . 8 1 1 A 27 27 PRO HA H 27 4.390 4.414 -0.024 1
1 259 . 8 1 1 A 27 27 PRO CA C 27 64.550 64.853 -0.303 1
1 260 . 8 1 1 A 27 27 PRO CB C 27 31.770 31.743 0.027 1
1 263 . 8 1 1 A 28 28 ASP H H 28 8.560 8.822 -0.262 1
1 264 . 8 1 1 A 28 28 ASP HA H 28 4.620 4.398 0.222 1
1 267 . 8 1 1 A 28 28 ASP C C 28 177.100 178.706 -1.606 1
1 268 . 8 1 1 A 28 28 ASP CA C 28 53.890 56.545 -2.655 1
1 269 . 8 1 1 A 28 28 ASP CB C 28 39.120 39.615 -0.495 1
1 270 . 8 1 1 A 28 28 ASP N N 28 115.820 117.838 -2.018 1
1 271 . 8 1 1 A 29 29 PHE H H 29 7.940 7.994 -0.054 1
1 272 . 8 1 1 A 29 29 PHE HA H 29 4.180 4.332 -0.152 1
1 280 . 8 1 1 A 29 29 PHE C C 29 176.740 178.233 -1.493 1
1 281 . 8 1 1 A 29 29 PHE CA C 29 61.020 61.009 0.011 1
1 282 . 8 1 1 A 29 29 PHE CB C 29 39.230 38.773 0.457 1
1 288 . 8 1 1 A 29 29 PHE N N 29 119.610 118.204 1.406 1
1 289 . 8 1 1 A 30 30 VAL H H 30 8.010 8.421 -0.411 1
1 290 . 8 1 1 A 30 30 VAL HA H 30 3.350 3.772 -0.422 1
1 298 . 8 1 1 A 30 30 VAL C C 30 176.400 177.148 -0.748 1
1 299 . 8 1 1 A 30 30 VAL CA C 30 66.510 64.826 1.684 1
1 300 . 8 1 1 A 30 30 VAL CB C 30 31.020 31.076 -0.056 1
1 303 . 8 1 1 A 30 30 VAL N N 30 116.370 119.460 -3.090 1
1 304 . 8 1 1 A 31 31 ASP H H 31 7.420 7.975 -0.555 1
1 305 . 8 1 1 A 31 31 ASP HA H 31 4.310 4.361 -0.051 1
1 308 . 8 1 1 A 31 31 ASP C C 31 178.360 178.902 -0.542 1
1 309 . 8 1 1 A 31 31 ASP CA C 31 57.110 57.108 0.002 1
1 310 . 8 1 1 A 31 31 ASP CB C 31 40.450 40.896 -0.446 1
1 311 . 8 1 1 A 31 31 ASP N N 31 119.190 121.581 -2.391 1
1 312 . 8 1 1 A 32 32 VAL H H 32 7.190 7.530 -0.340 1
1 313 . 8 1 1 A 32 32 VAL HA H 32 3.510 3.550 -0.040 1
1 321 . 8 1 1 A 32 32 VAL C C 32 178.100 178.569 -0.469 1
1 322 . 8 1 1 A 32 32 VAL CA C 32 65.570 66.401 -0.831 1
1 323 . 8 1 1 A 32 32 VAL CB C 32 31.410 31.312 0.098 1
1 326 . 8 1 1 A 32 32 VAL N N 32 119.830 120.252 -0.422 1
1 327 . 8 1 1 A 33 33 ILE H H 33 7.660 8.444 -0.784 1
1 328 . 8 1 1 A 33 33 ILE HA H 33 3.170 3.526 -0.356 1
1 338 . 8 1 1 A 33 33 ILE C C 33 176.660 178.067 -1.407 1
1 339 . 8 1 1 A 33 33 ILE CA C 33 65.220 65.223 -0.003 1
1 340 . 8 1 1 A 33 33 ILE CB C 33 37.500 37.778 -0.278 1
1 344 . 8 1 1 A 33 33 ILE N N 33 118.490 120.909 -2.419 1
1 345 . 8 1 1 A 34 34 ARG H H 34 7.830 7.734 0.096 1
1 346 . 8 1 1 A 34 34 ARG HA H 34 3.380 3.901 -0.521 1
1 354 . 8 1 1 A 34 34 ARG C C 34 178.060 177.381 0.679 1
1 355 . 8 1 1 A 34 34 ARG CA C 34 60.570 58.913 1.657 1
1 356 . 8 1 1 A 34 34 ARG CB C 34 30.070 29.715 0.355 1
1 359 . 8 1 1 A 34 34 ARG N N 34 118.260 120.009 -1.749 1
1 361 . 8 1 1 A 35 35 ILE H H 35 7.350 7.887 -0.537 1
1 362 . 8 1 1 A 35 35 ILE HA H 35 3.720 3.705 0.015 1
1 372 . 8 1 1 A 35 35 ILE C C 35 179.090 178.129 0.961 1
1 373 . 8 1 1 A 35 35 ILE CA C 35 64.060 65.370 -1.310 1
1 374 . 8 1 1 A 35 35 ILE CB C 35 38.030 37.408 0.622 1
1 378 . 8 1 1 A 35 35 ILE N N 35 116.750 119.383 -2.633 1
1 379 . 8 1 1 A 36 36 LYS H H 36 7.880 7.649 0.231 1
1 380 . 8 1 1 A 36 36 LYS HA H 36 4.090 3.943 0.147 1
1 389 . 8 1 1 A 36 36 LYS C C 36 178.560 178.956 -0.396 1
1 390 . 8 1 1 A 36 36 LYS CA C 36 57.650 59.771 -2.121 1
1 391 . 8 1 1 A 36 36 LYS CB C 36 32.090 32.171 -0.081 1
1 395 . 8 1 1 A 36 36 LYS N N 36 118.700 119.760 -1.060 1
1 396 . 8 1 1 A 37 37 LEU H H 37 7.860 7.410 0.450 1
1 397 . 8 1 1 A 37 37 LEU HA H 37 4.230 4.297 -0.067 1
1 407 . 8 1 1 A 37 37 LEU C C 37 175.880 176.768 -0.888 1
1 408 . 8 1 1 A 37 37 LEU CA C 37 54.090 55.687 -1.597 1
1 409 . 8 1 1 A 37 37 LEU CB C 37 43.310 42.515 0.795 1
1 413 . 8 1 1 A 37 37 LEU N N 37 116.380 117.584 -1.204 1
1 414 . 8 1 1 A 38 38 GLN H H 38 7.190 7.521 -0.331 1
1 415 . 8 1 1 A 38 38 GLN HA H 38 3.530 4.217 -0.687 1
1 422 . 8 1 1 A 38 38 GLN C C 38 177.480 176.261 1.219 1
1 423 . 8 1 1 A 38 38 GLN CA C 38 58.370 56.736 1.634 1
1 424 . 8 1 1 A 38 38 GLN CB C 38 28.300 28.710 -0.410 1
1 426 . 8 1 1 A 38 38 GLN N N 38 119.210 117.666 1.544 1
1 428 . 8 1 1 A 39 39 GLY H H 39 8.940 8.851 0.089 1
1 429 . 8 1 1 A 39 39 GLY HA2 H 39 3.540 3.989 -0.449 1
1 430 . 8 1 1 A 39 39 GLY HA3 H 39 4.220 3.990 0.230 1
1 431 . 8 1 1 A 39 39 GLY C C 39 174.070 174.417 -0.347 1
1 432 . 8 1 1 A 39 39 GLY CA C 39 45.280 45.034 0.246 1
1 433 . 8 1 1 A 39 39 GLY N N 39 113.490 112.156 1.334 1
1 434 . 8 1 1 A 40 40 LYS H H 40 8.350 7.603 0.747 1
1 435 . 8 1 1 A 40 40 LYS HA H 40 4.400 4.590 -0.190 1
1 444 . 8 1 1 A 40 40 LYS C C 40 175.560 175.723 -0.163 1
1 445 . 8 1 1 A 40 40 LYS CA C 40 55.660 54.749 0.911 1
1 446 . 8 1 1 A 40 40 LYS CB C 40 32.870 33.687 -0.817 1
1 450 . 8 1 1 A 40 40 LYS N N 40 122.060 119.963 2.097 1
1 451 . 8 1 1 A 41 41 THR H H 41 8.410 8.574 -0.164 1
1 452 . 8 1 1 A 41 41 THR HA H 41 5.330 4.969 0.361 1
1 457 . 8 1 1 A 41 41 THR C C 41 174.860 174.391 0.469 1
1 458 . 8 1 1 A 41 41 THR CA C 41 62.040 61.703 0.337 1
1 459 . 8 1 1 A 41 41 THR CB C 41 69.420 70.899 -1.479 1
1 461 . 8 1 1 A 41 41 THR N N 41 118.150 117.492 0.658 1
1 462 . 8 1 1 A 42 42 VAL H H 42 9.140 9.096 0.044 1
1 463 . 8 1 1 A 42 42 VAL HA H 42 4.570 5.027 -0.457 1
1 471 . 8 1 1 A 42 42 VAL C C 42 172.970 173.533 -0.563 1
1 472 . 8 1 1 A 42 42 VAL CA C 42 59.450 59.198 0.252 1
1 473 . 8 1 1 A 42 42 VAL CB C 42 35.880 35.461 0.419 1
1 476 . 8 1 1 A 42 42 VAL N N 42 122.510 120.607 1.903 1
1 477 . 8 1 1 A 43 43 ARG H H 43 8.420 8.727 -0.307 1
1 478 . 8 1 1 A 43 43 ARG HA H 43 4.750 5.000 -0.250 1
1 485 . 8 1 1 A 43 43 ARG C C 43 175.650 174.923 0.727 1
1 486 . 8 1 1 A 43 43 ARG CA C 43 53.650 54.113 -0.463 1
1 487 . 8 1 1 A 43 43 ARG CB C 43 33.870 34.012 -0.142 1
1 490 . 8 1 1 A 43 43 ARG N N 43 120.640 122.616 -1.976 1
1 491 . 8 1 1 A 44 44 THR H H 44 8.370 8.578 -0.208 1
1 492 . 8 1 1 A 44 44 THR HA H 44 3.410 3.758 -0.348 1
1 497 . 8 1 1 A 44 44 THR C C 44 175.020 175.813 -0.793 1
1 498 . 8 1 1 A 44 44 THR CA C 44 65.660 65.024 0.636 1
1 499 . 8 1 1 A 44 44 THR CB C 44 69.400 68.339 1.061 1
1 501 . 8 1 1 A 44 44 THR N N 44 118.590 119.731 -1.141 1
1 502 . 8 1 1 A 45 45 GLY H H 45 9.090 8.746 0.344 1
1 503 . 8 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 8 1 1 A 45 45 GLY HA3 H 45 4.470 4.021 0.449 1
1 505 . 8 1 1 A 45 45 GLY C C 45 174.350 173.843 0.507 1
1 506 . 8 1 1 A 45 45 GLY CA C 45 45.000 44.959 0.041 1
1 507 . 8 1 1 A 45 45 GLY N N 45 117.350 114.984 2.366 1
1 508 . 8 1 1 A 46 46 ASP H H 46 8.010 7.916 0.094 1
1 509 . 8 1 1 A 46 46 ASP HA H 46 4.470 4.623 -0.153 1
1 512 . 8 1 1 A 46 46 ASP C C 46 174.570 174.418 0.152 1
1 513 . 8 1 1 A 46 46 ASP CA C 46 55.570 55.426 0.144 1
1 514 . 8 1 1 A 46 46 ASP CB C 46 41.680 41.486 0.194 1
1 515 . 8 1 1 A 46 46 ASP N N 46 122.240 122.224 0.016 1
1 516 . 8 1 1 A 47 47 VAL H H 47 8.330 8.388 -0.058 1
1 517 . 8 1 1 A 47 47 VAL HA H 47 4.950 4.899 0.051 1
1 525 . 8 1 1 A 47 47 VAL C C 47 176.330 175.559 0.771 1
1 526 . 8 1 1 A 47 47 VAL CA C 47 61.710 60.830 0.880 1
1 527 . 8 1 1 A 47 47 VAL CB C 47 32.900 35.167 -2.267 1
1 530 . 8 1 1 A 47 47 VAL N N 47 119.860 121.781 -1.921 1
1 531 . 8 1 1 A 48 48 ILE H H 48 9.160 8.677 0.483 1
1 532 . 8 1 1 A 48 48 ILE HA H 48 4.630 5.174 -0.544 1
1 542 . 8 1 1 A 48 48 ILE C C 48 174.400 174.458 -0.058 1
1 543 . 8 1 1 A 48 48 ILE CA C 48 58.990 59.293 -0.303 1
1 544 . 8 1 1 A 48 48 ILE CB C 48 41.810 42.194 -0.384 1
1 548 . 8 1 1 A 48 48 ILE N N 48 124.990 121.630 3.360 1
1 549 . 8 1 1 A 49 49 GLY H H 49 8.660 8.955 -0.295 1
1 550 . 8 1 1 A 49 49 GLY HA2 H 49 4.950 4.303 0.647 1
1 551 . 8 1 1 A 49 49 GLY HA3 H 49 3.620 4.343 -0.723 1
1 552 . 8 1 1 A 49 49 GLY C C 49 172.920 171.857 1.063 1
1 553 . 8 1 1 A 49 49 GLY CA C 49 44.580 44.399 0.181 1
1 554 . 8 1 1 A 49 49 GLY N N 49 112.060 109.353 2.707 1
1 555 . 8 1 1 A 50 50 ILE H H 50 8.810 9.132 -0.322 1
1 556 . 8 1 1 A 50 50 ILE HA H 50 4.370 4.828 -0.458 1
1 566 . 8 1 1 A 50 50 ILE C C 50 174.500 174.864 -0.364 1
1 567 . 8 1 1 A 50 50 ILE CA C 50 59.550 59.755 -0.205 1
1 568 . 8 1 1 A 50 50 ILE CB C 50 41.300 41.326 -0.026 1
1 572 . 8 1 1 A 50 50 ILE N N 50 123.220 125.348 -2.128 1
1 573 . 8 1 1 A 51 51 SER H H 51 8.540 8.981 -0.441 1
1 574 . 8 1 1 A 51 51 SER HA H 51 4.830 5.143 -0.313 1
1 577 . 8 1 1 A 51 51 SER C C 51 174.130 173.931 0.199 1
1 578 . 8 1 1 A 51 51 SER CA C 51 57.770 56.690 1.080 1
1 579 . 8 1 1 A 51 51 SER CB C 51 63.040 64.549 -1.509 1
1 580 . 8 1 1 A 51 51 SER N N 51 121.430 121.290 0.140 1
1 581 . 8 1 1 A 52 52 ILE H H 52 8.930 8.700 0.230 1
1 582 . 8 1 1 A 52 52 ILE HA H 52 4.290 4.592 -0.302 1
1 592 . 8 1 1 A 52 52 ILE C C 52 175.280 176.059 -0.779 1
1 593 . 8 1 1 A 52 52 ILE CA C 52 60.250 60.271 -0.021 1
1 594 . 8 1 1 A 52 52 ILE CB C 52 39.840 40.523 -0.683 1
1 598 . 8 1 1 A 52 52 ILE N N 52 127.060 125.019 2.041 1
1 599 . 8 1 1 A 53 53 LEU H H 53 9.380 9.463 -0.083 1
1 600 . 8 1 1 A 53 53 LEU HA H 53 3.890 4.087 -0.197 1
1 610 . 8 1 1 A 53 53 LEU C C 53 177.130 176.988 0.142 1
1 611 . 8 1 1 A 53 53 LEU CA C 53 55.560 56.199 -0.639 1
1 612 . 8 1 1 A 53 53 LEU CB C 53 39.370 40.674 -1.304 1
1 616 . 8 1 1 A 53 53 LEU N N 53 126.770 129.911 -3.141 1
1 617 . 8 1 1 A 54 54 GLY H H 54 8.310 8.700 -0.390 1
1 618 . 8 1 1 A 54 54 GLY HA2 H 54 3.490 3.905 -0.415 1
1 619 . 8 1 1 A 54 54 GLY HA3 H 54 4.080 3.906 0.174 1
1 620 . 8 1 1 A 54 54 GLY C C 54 173.690 173.988 -0.298 1
1 621 . 8 1 1 A 54 54 GLY CA C 54 45.340 45.757 -0.417 1
1 622 . 8 1 1 A 54 54 GLY N N 54 103.820 104.376 -0.556 1
1 623 . 8 1 1 A 55 55 LYS H H 55 7.730 7.806 -0.076 1
1 624 . 8 1 1 A 55 55 LYS HA H 55 4.560 4.868 -0.308 1
1 633 . 8 1 1 A 55 55 LYS C C 55 174.550 175.088 -0.538 1
1 634 . 8 1 1 A 55 55 LYS CA C 55 54.140 54.957 -0.817 1
1 635 . 8 1 1 A 55 55 LYS CB C 55 34.620 35.589 -0.969 1
1 639 . 8 1 1 A 55 55 LYS N N 55 121.160 120.231 0.929 1
1 640 . 8 1 1 A 56 56 GLU H H 56 8.490 8.816 -0.326 1
1 641 . 8 1 1 A 56 56 GLU HA H 56 4.280 4.695 -0.415 1
1 646 . 8 1 1 A 56 56 GLU C C 56 175.730 175.203 0.527 1
1 647 . 8 1 1 A 56 56 GLU CA C 56 56.730 56.319 0.411 1
1 648 . 8 1 1 A 56 56 GLU CB C 56 30.070 30.698 -0.628 1
1 650 . 8 1 1 A 56 56 GLU N N 56 124.090 128.385 -4.295 1
1 651 . 8 1 1 A 57 57 VAL H H 57 8.920 8.419 0.501 1
1 652 . 8 1 1 A 57 57 VAL HA H 57 4.030 4.823 -0.793 1
1 660 . 8 1 1 A 57 57 VAL C C 57 174.610 173.720 0.890 1
1 661 . 8 1 1 A 57 57 VAL CA C 57 61.680 59.625 2.055 1
1 662 . 8 1 1 A 57 57 VAL CB C 57 33.880 34.581 -0.701 1
1 665 . 8 1 1 A 57 57 VAL N N 57 129.960 126.521 3.439 1
1 666 . 8 1 1 A 58 58 LYS H H 58 7.860 8.714 -0.854 1
1 667 . 8 1 1 A 58 58 LYS HA H 58 5.120 4.819 0.301 1
1 676 . 8 1 1 A 58 58 LYS C C 58 175.380 175.709 -0.329 1
1 677 . 8 1 1 A 58 58 LYS CA C 58 55.200 54.762 0.438 1
1 678 . 8 1 1 A 58 58 LYS CB C 58 34.670 34.118 0.552 1
1 682 . 8 1 1 A 58 58 LYS N N 58 124.790 127.356 -2.566 1
1 683 . 8 1 1 A 59 59 PHE H H 59 9.270 9.121 0.149 1
1 684 . 8 1 1 A 59 59 PHE HA H 59 4.960 5.128 -0.168 1
1 692 . 8 1 1 A 59 59 PHE C C 59 173.950 174.370 -0.420 1
1 693 . 8 1 1 A 59 59 PHE CA C 59 55.910 56.079 -0.169 1
1 694 . 8 1 1 A 59 59 PHE CB C 59 42.950 42.264 0.686 1
1 700 . 8 1 1 A 59 59 PHE N N 59 118.270 122.712 -4.442 1
1 701 . 8 1 1 A 60 60 LYS H H 60 9.170 8.893 0.277 1
1 702 . 8 1 1 A 60 60 LYS HA H 60 4.910 4.925 -0.015 1
1 711 . 8 1 1 A 60 60 LYS C C 60 176.230 176.001 0.229 1
1 712 . 8 1 1 A 60 60 LYS CA C 60 53.910 54.532 -0.622 1
1 713 . 8 1 1 A 60 60 LYS CB C 60 35.170 34.836 0.334 1
1 717 . 8 1 1 A 60 60 LYS N N 60 121.960 124.271 -2.311 1
1 718 . 8 1 1 A 61 61 VAL H H 61 9.400 8.840 0.560 1
1 719 . 8 1 1 A 61 61 VAL HA H 61 4.170 4.033 0.137 1
1 727 . 8 1 1 A 61 61 VAL C C 61 175.500 175.372 0.128 1
1 728 . 8 1 1 A 61 61 VAL CA C 61 61.980 63.493 -1.513 1
1 729 . 8 1 1 A 61 61 VAL CB C 61 29.490 31.100 -1.610 1
1 732 . 8 1 1 A 61 61 VAL N N 61 127.140 127.086 0.054 1
1 733 . 8 1 1 A 62 62 VAL H H 62 8.390 8.647 -0.257 1
1 734 . 8 1 1 A 62 62 VAL HA H 62 3.650 3.970 -0.320 1
1 742 . 8 1 1 A 62 62 VAL C C 62 176.440 176.060 0.380 1
1 743 . 8 1 1 A 62 62 VAL CA C 62 64.930 64.410 0.520 1
1 744 . 8 1 1 A 62 62 VAL CB C 62 32.130 32.486 -0.356 1
1 747 . 8 1 1 A 62 62 VAL N N 62 132.840 129.340 3.500 1
1 748 . 8 1 1 A 63 63 GLN H H 63 7.470 7.147 0.323 1
1 749 . 8 1 1 A 63 63 GLN HA H 63 4.270 4.459 -0.189 1
1 756 . 8 1 1 A 63 63 GLN C C 63 172.290 173.301 -1.011 1
1 757 . 8 1 1 A 63 63 GLN CA C 63 56.640 55.439 1.201 1
1 758 . 8 1 1 A 63 63 GLN CB C 63 32.630 31.704 0.926 1
1 760 . 8 1 1 A 63 63 GLN N N 63 114.500 116.866 -2.366 1
1 762 . 8 1 1 A 64 64 ALA H H 64 8.200 8.508 -0.308 1
1 763 . 8 1 1 A 64 64 ALA HA H 64 4.830 5.295 -0.465 1
1 767 . 8 1 1 A 64 64 ALA C C 64 174.270 175.705 -1.435 1
1 768 . 8 1 1 A 64 64 ALA CA C 64 50.800 49.978 0.822 1
1 769 . 8 1 1 A 64 64 ALA CB C 64 20.100 21.543 -1.443 1
1 770 . 8 1 1 A 64 64 ALA N N 64 131.410 128.704 2.706 1
1 771 . 8 1 1 A 65 65 TYR H H 65 8.860 8.504 0.356 1
1 772 . 8 1 1 A 65 65 TYR HA H 65 4.540 4.966 -0.426 1
1 779 . 8 1 1 A 65 65 TYR CA C 65 54.270 55.030 -0.760 1
1 780 . 8 1 1 A 65 65 TYR CB C 65 41.360 40.406 0.954 1
1 785 . 8 1 1 A 65 65 TYR N N 65 124.140 119.994 4.146 1
1 786 . 8 1 1 A 66 66 PRO HA H 66 4.120 4.729 -0.609 1
1 793 . 8 1 1 A 66 66 PRO CA C 66 63.450 62.340 1.110 1
1 794 . 8 1 1 A 66 66 PRO CB C 66 34.170 32.774 1.396 1
1 797 . 8 1 1 A 67 67 SER H H 67 7.380 8.242 -0.862 1
1 798 . 8 1 1 A 67 67 SER HA H 67 4.720 4.976 -0.256 1
1 801 . 8 1 1 A 67 67 SER CA C 67 54.250 56.058 -1.808 1
1 802 . 8 1 1 A 67 67 SER CB C 67 64.530 63.832 0.698 1
1 803 . 8 1 1 A 67 67 SER N N 67 106.200 116.682 -10.482 1
1 804 . 8 1 1 A 68 68 PRO HA H 68 4.880 4.679 0.201 1
1 811 . 8 1 1 A 68 68 PRO CA C 68 62.990 62.470 0.520 1
1 812 . 8 1 1 A 68 68 PRO CB C 68 35.220 33.209 2.011 1
1 815 . 8 1 1 A 69 69 LEU H H 69 8.960 8.018 0.942 1
1 816 . 8 1 1 A 69 69 LEU HA H 69 4.430 5.115 -0.685 1
1 826 . 8 1 1 A 69 69 LEU C C 69 174.570 175.296 -0.726 1
1 827 . 8 1 1 A 69 69 LEU CA C 69 53.900 52.629 1.271 1
1 828 . 8 1 1 A 69 69 LEU CB C 69 44.210 46.093 -1.883 1
1 832 . 8 1 1 A 69 69 LEU N N 69 120.480 117.107 3.373 1
1 833 . 8 1 1 A 70 70 ARG H H 70 8.130 8.372 -0.242 1
1 834 . 8 1 1 A 70 70 ARG HA H 70 4.930 4.777 0.153 1
1 841 . 8 1 1 A 70 70 ARG C C 70 175.460 176.241 -0.781 1
1 842 . 8 1 1 A 70 70 ARG CA C 70 54.040 55.639 -1.599 1
1 843 . 8 1 1 A 70 70 ARG CB C 70 30.550 31.748 -1.198 1
1 846 . 8 1 1 A 70 70 ARG N N 70 125.180 119.659 5.521 1
1 847 . 8 1 1 A 71 71 VAL H H 71 8.450 8.233 0.217 1
1 848 . 8 1 1 A 71 71 VAL HA H 71 3.410 4.463 -1.053 1
1 856 . 8 1 1 A 71 71 VAL C C 71 175.460 175.610 -0.150 1
1 857 . 8 1 1 A 71 71 VAL CA C 71 65.210 61.913 3.297 1
1 858 . 8 1 1 A 71 71 VAL CB C 71 29.840 32.183 -2.343 1
1 861 . 8 1 1 A 71 71 VAL N N 71 128.170 122.512 5.658 1
1 862 . 8 1 1 A 72 72 GLU H H 72 8.620 8.497 0.123 1
1 863 . 8 1 1 A 72 72 GLU HA H 72 4.870 4.714 0.156 1
1 868 . 8 1 1 A 72 72 GLU C C 72 176.960 176.389 0.571 1
1 869 . 8 1 1 A 72 72 GLU CA C 72 54.330 54.108 0.222 1
1 870 . 8 1 1 A 72 72 GLU CB C 72 33.280 32.123 1.157 1
1 872 . 8 1 1 A 72 72 GLU N N 72 127.670 126.720 0.950 1
1 873 . 8 1 1 A 73 73 ASP H H 73 8.700 8.800 -0.100 1
1 874 . 8 1 1 A 73 73 ASP HA H 73 4.150 4.299 -0.149 1
1 877 . 8 1 1 A 73 73 ASP C C 73 177.460 177.671 -0.211 1
1 878 . 8 1 1 A 73 73 ASP CA C 73 57.620 57.311 0.309 1
1 879 . 8 1 1 A 73 73 ASP CB C 73 40.360 40.417 -0.057 1
1 880 . 8 1 1 A 73 73 ASP N N 73 121.140 123.264 -2.124 1
1 881 . 8 1 1 A 74 74 ARG H H 74 7.760 8.170 -0.410 1
1 882 . 8 1 1 A 74 74 ARG HA H 74 4.280 4.289 -0.009 1
1 889 . 8 1 1 A 74 74 ARG C C 74 176.510 176.575 -0.065 1
1 890 . 8 1 1 A 74 74 ARG CA C 74 55.450 57.393 -1.943 1
1 891 . 8 1 1 A 74 74 ARG CB C 74 29.990 30.066 -0.076 1
1 894 . 8 1 1 A 74 74 ARG N N 74 112.890 115.714 -2.824 1
1 895 . 8 1 1 A 75 75 THR H H 75 7.700 7.554 0.146 1
1 896 . 8 1 1 A 75 75 THR HA H 75 4.020 4.249 -0.229 1
1 901 . 8 1 1 A 75 75 THR C C 75 173.810 173.936 -0.126 1
1 902 . 8 1 1 A 75 75 THR CA C 75 64.060 63.891 0.169 1
1 903 . 8 1 1 A 75 75 THR CB C 75 69.350 69.581 -0.231 1
1 905 . 8 1 1 A 75 75 THR N N 75 120.650 117.393 3.257 1
1 906 . 8 1 1 A 76 76 LYS H H 76 8.520 8.213 0.307 1
1 907 . 8 1 1 A 76 76 LYS HA H 76 4.270 4.647 -0.377 1
1 916 . 8 1 1 A 76 76 LYS C C 76 174.560 175.889 -1.329 1
1 917 . 8 1 1 A 76 76 LYS CA C 76 56.280 56.035 0.245 1
1 918 . 8 1 1 A 76 76 LYS CB C 76 33.120 33.615 -0.495 1
1 922 . 8 1 1 A 76 76 LYS N N 76 130.950 127.222 3.728 1
1 923 . 8 1 1 A 77 77 ILE H H 77 8.430 8.665 -0.235 1
1 924 . 8 1 1 A 77 77 ILE HA H 77 4.850 5.213 -0.363 1
1 934 . 8 1 1 A 77 77 ILE C C 77 174.650 175.116 -0.466 1
1 935 . 8 1 1 A 77 77 ILE CA C 77 59.820 60.034 -0.214 1
1 936 . 8 1 1 A 77 77 ILE CB C 77 38.280 40.858 -2.578 1
1 940 . 8 1 1 A 77 77 ILE N N 77 128.020 123.701 4.319 1
1 941 . 8 1 1 A 78 78 THR H H 78 8.870 8.800 0.070 1
1 942 . 8 1 1 A 78 78 THR HA H 78 4.470 5.100 -0.630 1
1 947 . 8 1 1 A 78 78 THR C C 78 172.760 173.016 -0.256 1
1 948 . 8 1 1 A 78 78 THR CA C 78 60.740 61.344 -0.604 1
1 949 . 8 1 1 A 78 78 THR CB C 78 71.320 72.069 -0.749 1
1 951 . 8 1 1 A 78 78 THR N N 78 123.870 123.672 0.198 1
1 952 . 8 1 1 A 79 79 LEU H H 79 8.820 8.926 -0.106 1
1 953 . 8 1 1 A 79 79 LEU HA H 79 5.140 5.054 0.086 1
1 963 . 8 1 1 A 79 79 LEU C C 79 176.610 176.179 0.431 1
1 964 . 8 1 1 A 79 79 LEU CA C 79 53.280 53.360 -0.080 1
1 965 . 8 1 1 A 79 79 LEU CB C 79 42.600 42.860 -0.260 1
1 969 . 8 1 1 A 79 79 LEU N N 79 127.070 126.491 0.579 1
1 970 . 8 1 1 A 80 80 VAL H H 80 8.800 8.696 0.104 1
1 971 . 8 1 1 A 80 80 VAL HA H 80 4.260 4.779 -0.519 1
1 979 . 8 1 1 A 80 80 VAL CA C 80 61.350 61.504 -0.154 1
1 980 . 8 1 1 A 80 80 VAL CB C 80 32.790 33.187 -0.397 1
1 983 . 8 1 1 A 80 80 VAL N N 80 124.120 125.368 -1.248 1
1 984 . 8 1 1 A 81 81 THR H H 81 8.160 8.767 -0.607 1
1 985 . 8 1 1 A 81 81 THR HA H 81 4.410 5.314 -0.904 1
1 990 . 8 1 1 A 81 81 THR CA C 81 60.800 60.020 0.780 1
1 991 . 8 1 1 A 81 81 THR CB C 81 69.650 72.557 -2.907 1
1 993 . 8 1 1 A 81 81 THR N N 81 114.500 116.501 -2.001 1
1 1 . 9 1 1 A 9 9 GLY H H 9 8.390 7.378 1.012 1
1 2 . 9 1 1 A 9 9 GLY HA2 H 9 3.900 4.091 -0.191 1
1 3 . 9 1 1 A 9 9 GLY HA3 H 9 3.860 4.092 -0.232 1
1 4 . 9 1 1 A 9 9 GLY CA C 9 45.150 44.659 0.491 1
1 5 . 9 1 1 A 9 9 GLY N N 9 110.000 105.347 4.653 1
1 6 . 9 1 1 A 10 10 VAL H H 10 7.870 8.290 -0.420 1
1 7 . 9 1 1 A 10 10 VAL HA H 10 4.040 4.431 -0.391 1
1 15 . 9 1 1 A 10 10 VAL C C 10 175.880 175.433 0.447 1
1 16 . 9 1 1 A 10 10 VAL CA C 10 62.110 61.878 0.232 1
1 17 . 9 1 1 A 10 10 VAL CB C 10 32.760 32.736 0.024 1
1 20 . 9 1 1 A 10 10 VAL N N 10 119.730 120.516 -0.786 1
1 21 . 9 1 1 A 11 11 ILE H H 11 8.230 8.760 -0.530 1
1 22 . 9 1 1 A 11 11 ILE HA H 11 4.090 4.492 -0.402 1
1 32 . 9 1 1 A 11 11 ILE C C 11 175.850 175.227 0.623 1
1 33 . 9 1 1 A 11 11 ILE CA C 11 60.800 60.292 0.508 1
1 34 . 9 1 1 A 11 11 ILE CB C 11 38.470 38.794 -0.324 1
1 38 . 9 1 1 A 11 11 ILE N N 11 125.570 128.038 -2.468 1
1 39 . 9 1 1 A 12 12 MET H H 12 8.370 8.737 -0.367 1
1 40 . 9 1 1 A 12 12 MET HA H 12 4.540 4.938 -0.398 1
1 48 . 9 1 1 A 12 12 MET C C 12 174.830 175.807 -0.977 1
1 49 . 9 1 1 A 12 12 MET CA C 12 54.790 54.231 0.559 1
1 50 . 9 1 1 A 12 12 MET CB C 12 32.640 33.548 -0.908 1
1 53 . 9 1 1 A 12 12 MET N N 12 125.930 127.248 -1.318 1
1 54 . 9 1 1 A 13 13 SER H H 13 7.990 8.746 -0.756 1
1 55 . 9 1 1 A 13 13 SER HA H 13 5.030 5.450 -0.420 1
1 58 . 9 1 1 A 13 13 SER C C 13 174.330 173.246 1.084 1
1 59 . 9 1 1 A 13 13 SER CA C 13 57.320 55.817 1.503 1
1 60 . 9 1 1 A 13 13 SER CB C 13 64.790 66.278 -1.488 1
1 61 . 9 1 1 A 13 13 SER N N 13 116.400 117.885 -1.485 1
1 62 . 9 1 1 A 14 14 GLU H H 14 9.430 8.783 0.647 1
1 63 . 9 1 1 A 14 14 GLU HA H 14 5.250 5.134 0.116 1
1 68 . 9 1 1 A 14 14 GLU C C 14 172.980 174.010 -1.030 1
1 69 . 9 1 1 A 14 14 GLU CA C 14 55.390 55.397 -0.007 1
1 70 . 9 1 1 A 14 14 GLU CB C 14 33.910 34.209 -0.299 1
1 72 . 9 1 1 A 14 14 GLU N N 14 123.670 121.652 2.018 1
1 73 . 9 1 1 A 15 15 LEU H H 15 8.930 8.902 0.028 1
1 74 . 9 1 1 A 15 15 LEU HA H 15 4.870 5.144 -0.274 1
1 84 . 9 1 1 A 15 15 LEU C C 15 174.000 174.564 -0.564 1
1 85 . 9 1 1 A 15 15 LEU CA C 15 53.020 53.786 -0.766 1
1 86 . 9 1 1 A 15 15 LEU CB C 15 46.040 46.120 -0.080 1
1 90 . 9 1 1 A 15 15 LEU N N 15 125.350 125.875 -0.525 1
1 91 . 9 1 1 A 16 16 LYS H H 16 8.840 8.827 0.013 1
1 92 . 9 1 1 A 16 16 LYS HA H 16 5.360 4.993 0.367 1
1 101 . 9 1 1 A 16 16 LYS C C 16 175.660 175.780 -0.120 1
1 102 . 9 1 1 A 16 16 LYS CA C 16 54.940 55.262 -0.322 1
1 103 . 9 1 1 A 16 16 LYS CB C 16 34.280 34.322 -0.042 1
1 107 . 9 1 1 A 16 16 LYS N N 16 124.640 126.928 -2.288 1
1 108 . 9 1 1 A 17 17 LEU H H 17 8.820 8.919 -0.099 1
1 109 . 9 1 1 A 17 17 LEU HA H 17 5.430 5.245 0.185 1
1 119 . 9 1 1 A 17 17 LEU C C 17 174.630 175.588 -0.958 1
1 120 . 9 1 1 A 17 17 LEU CA C 17 52.900 53.665 -0.765 1
1 121 . 9 1 1 A 17 17 LEU CB C 17 46.910 45.775 1.135 1
1 125 . 9 1 1 A 17 17 LEU N N 17 123.460 126.073 -2.613 1
1 126 . 9 1 1 A 18 18 LYS H H 18 9.110 8.692 0.418 1
1 127 . 9 1 1 A 18 18 LYS HA H 18 5.490 5.081 0.409 1
1 136 . 9 1 1 A 18 18 LYS CA C 18 52.270 52.852 -0.582 1
1 137 . 9 1 1 A 18 18 LYS CB C 18 37.500 36.131 1.369 1
1 141 . 9 1 1 A 18 18 LYS N N 18 122.230 123.825 -1.595 1
1 142 . 9 1 1 A 19 19 PRO HA H 19 4.100 4.370 -0.270 1
1 149 . 9 1 1 A 19 19 PRO CA C 19 62.440 62.340 0.100 1
1 150 . 9 1 1 A 19 19 PRO CB C 19 30.640 32.215 -1.575 1
1 153 . 9 1 1 A 20 20 LEU H H 20 8.490 8.270 0.220 1
1 154 . 9 1 1 A 20 20 LEU HA H 20 4.320 4.147 0.173 1
1 164 . 9 1 1 A 20 20 LEU CA C 20 57.680 58.708 -1.028 1
1 165 . 9 1 1 A 20 20 LEU CB C 20 38.760 40.561 -1.801 1
1 169 . 9 1 1 A 20 20 LEU N N 20 123.250 119.690 3.560 1
1 170 . 9 1 1 A 21 21 PRO HA H 21 4.530 4.535 -0.005 1
1 177 . 9 1 1 A 21 21 PRO CA C 21 62.880 62.561 0.319 1
1 178 . 9 1 1 A 21 21 PRO CB C 21 31.420 31.890 -0.470 1
1 181 . 9 1 1 A 22 22 LYS H H 22 8.180 8.433 -0.253 1
1 182 . 9 1 1 A 22 22 LYS HA H 22 4.110 4.552 -0.442 1
1 191 . 9 1 1 A 22 22 LYS C C 22 175.680 175.459 0.221 1
1 192 . 9 1 1 A 22 22 LYS CA C 22 56.210 55.772 0.438 1
1 193 . 9 1 1 A 22 22 LYS CB C 22 30.660 32.704 -2.044 1
1 197 . 9 1 1 A 22 22 LYS N N 22 119.160 121.803 -2.643 1
1 198 . 9 1 1 A 23 23 VAL H H 23 7.530 8.565 -1.035 1
1 199 . 9 1 1 A 23 23 VAL HA H 23 4.280 4.774 -0.494 1
1 207 . 9 1 1 A 23 23 VAL C C 23 173.690 173.536 0.154 1
1 208 . 9 1 1 A 23 23 VAL CA C 23 59.830 59.539 0.291 1
1 209 . 9 1 1 A 23 23 VAL CB C 23 34.550 35.542 -0.992 1
1 212 . 9 1 1 A 23 23 VAL N N 23 121.820 122.475 -0.655 1
1 213 . 9 1 1 A 24 24 GLU H H 24 8.270 8.818 -0.548 1
1 214 . 9 1 1 A 24 24 GLU HA H 24 4.330 4.798 -0.468 1
1 219 . 9 1 1 A 24 24 GLU C C 24 175.390 175.255 0.135 1
1 220 . 9 1 1 A 24 24 GLU CA C 24 55.220 55.401 -0.181 1
1 221 . 9 1 1 A 24 24 GLU CB C 24 29.970 30.765 -0.795 1
1 223 . 9 1 1 A 24 24 GLU N N 24 125.610 126.969 -1.359 1
1 224 . 9 1 1 A 25 25 LEU H H 25 8.480 8.721 -0.241 1
1 225 . 9 1 1 A 25 25 LEU HA H 25 4.520 4.431 0.089 1
1 235 . 9 1 1 A 25 25 LEU CA C 25 51.660 51.459 0.201 1
1 236 . 9 1 1 A 25 25 LEU CB C 25 41.750 41.117 0.633 1
1 240 . 9 1 1 A 25 25 LEU N N 25 125.880 126.446 -0.566 1
1 241 . 9 1 1 A 26 26 PRO HA H 26 4.760 4.622 0.138 1
1 248 . 9 1 1 A 26 26 PRO CA C 26 61.330 61.882 -0.552 1
1 249 . 9 1 1 A 26 26 PRO CB C 26 31.060 32.838 -1.778 1
1 252 . 9 1 1 A 27 27 PRO HA H 27 4.390 4.423 -0.033 1
1 259 . 9 1 1 A 27 27 PRO CA C 27 64.550 64.842 -0.292 1
1 260 . 9 1 1 A 27 27 PRO CB C 27 31.770 31.742 0.028 1
1 263 . 9 1 1 A 28 28 ASP H H 28 8.560 8.785 -0.225 1
1 264 . 9 1 1 A 28 28 ASP HA H 28 4.620 4.432 0.188 1
1 267 . 9 1 1 A 28 28 ASP C C 28 177.100 178.672 -1.572 1
1 268 . 9 1 1 A 28 28 ASP CA C 28 53.890 56.263 -2.373 1
1 269 . 9 1 1 A 28 28 ASP CB C 28 39.120 39.588 -0.468 1
1 270 . 9 1 1 A 28 28 ASP N N 28 115.820 117.845 -2.025 1
1 271 . 9 1 1 A 29 29 PHE H H 29 7.940 7.895 0.045 1
1 272 . 9 1 1 A 29 29 PHE HA H 29 4.180 4.326 -0.146 1
1 280 . 9 1 1 A 29 29 PHE C C 29 176.740 178.222 -1.482 1
1 281 . 9 1 1 A 29 29 PHE CA C 29 61.020 61.050 -0.030 1
1 282 . 9 1 1 A 29 29 PHE CB C 29 39.230 38.646 0.584 1
1 288 . 9 1 1 A 29 29 PHE N N 29 119.610 118.367 1.243 1
1 289 . 9 1 1 A 30 30 VAL H H 30 8.010 8.437 -0.427 1
1 290 . 9 1 1 A 30 30 VAL HA H 30 3.350 3.783 -0.433 1
1 298 . 9 1 1 A 30 30 VAL C C 30 176.400 177.280 -0.880 1
1 299 . 9 1 1 A 30 30 VAL CA C 30 66.510 64.816 1.694 1
1 300 . 9 1 1 A 30 30 VAL CB C 30 31.020 31.099 -0.079 1
1 303 . 9 1 1 A 30 30 VAL N N 30 116.370 119.604 -3.234 1
1 304 . 9 1 1 A 31 31 ASP H H 31 7.420 8.142 -0.722 1
1 305 . 9 1 1 A 31 31 ASP HA H 31 4.310 4.369 -0.059 1
1 308 . 9 1 1 A 31 31 ASP C C 31 178.360 178.650 -0.290 1
1 309 . 9 1 1 A 31 31 ASP CA C 31 57.110 57.444 -0.334 1
1 310 . 9 1 1 A 31 31 ASP CB C 31 40.450 41.142 -0.692 1
1 311 . 9 1 1 A 31 31 ASP N N 31 119.190 121.635 -2.445 1
1 312 . 9 1 1 A 32 32 VAL H H 32 7.190 7.383 -0.193 1
1 313 . 9 1 1 A 32 32 VAL HA H 32 3.510 3.549 -0.039 1
1 321 . 9 1 1 A 32 32 VAL C C 32 178.100 178.504 -0.404 1
1 322 . 9 1 1 A 32 32 VAL CA C 32 65.570 66.380 -0.810 1
1 323 . 9 1 1 A 32 32 VAL CB C 32 31.410 31.345 0.065 1
1 326 . 9 1 1 A 32 32 VAL N N 32 119.830 119.097 0.733 1
1 327 . 9 1 1 A 33 33 ILE H H 33 7.660 8.445 -0.785 1
1 328 . 9 1 1 A 33 33 ILE HA H 33 3.170 3.522 -0.352 1
1 338 . 9 1 1 A 33 33 ILE C C 33 176.660 178.138 -1.478 1
1 339 . 9 1 1 A 33 33 ILE CA C 33 65.220 65.217 0.003 1
1 340 . 9 1 1 A 33 33 ILE CB C 33 37.500 37.630 -0.130 1
1 344 . 9 1 1 A 33 33 ILE N N 33 118.490 120.801 -2.311 1
1 345 . 9 1 1 A 34 34 ARG H H 34 7.830 7.737 0.093 1
1 346 . 9 1 1 A 34 34 ARG HA H 34 3.380 3.895 -0.515 1
1 354 . 9 1 1 A 34 34 ARG C C 34 178.060 177.427 0.633 1
1 355 . 9 1 1 A 34 34 ARG CA C 34 60.570 58.861 1.709 1
1 356 . 9 1 1 A 34 34 ARG CB C 34 30.070 29.700 0.370 1
1 359 . 9 1 1 A 34 34 ARG N N 34 118.260 119.957 -1.697 1
1 361 . 9 1 1 A 35 35 ILE H H 35 7.350 7.836 -0.486 1
1 362 . 9 1 1 A 35 35 ILE HA H 35 3.720 3.718 0.002 1
1 372 . 9 1 1 A 35 35 ILE C C 35 179.090 178.036 1.054 1
1 373 . 9 1 1 A 35 35 ILE CA C 35 64.060 65.324 -1.264 1
1 374 . 9 1 1 A 35 35 ILE CB C 35 38.030 37.560 0.470 1
1 378 . 9 1 1 A 35 35 ILE N N 35 116.750 119.556 -2.806 1
1 379 . 9 1 1 A 36 36 LYS H H 36 7.880 7.625 0.255 1
1 380 . 9 1 1 A 36 36 LYS HA H 36 4.090 3.952 0.138 1
1 389 . 9 1 1 A 36 36 LYS C C 36 178.560 178.870 -0.310 1
1 390 . 9 1 1 A 36 36 LYS CA C 36 57.650 59.801 -2.151 1
1 391 . 9 1 1 A 36 36 LYS CB C 36 32.090 32.196 -0.106 1
1 395 . 9 1 1 A 36 36 LYS N N 36 118.700 119.722 -1.022 1
1 396 . 9 1 1 A 37 37 LEU H H 37 7.860 7.418 0.442 1
1 397 . 9 1 1 A 37 37 LEU HA H 37 4.230 4.262 -0.032 1
1 407 . 9 1 1 A 37 37 LEU C C 37 175.880 176.791 -0.911 1
1 408 . 9 1 1 A 37 37 LEU CA C 37 54.090 56.133 -2.043 1
1 409 . 9 1 1 A 37 37 LEU CB C 37 43.310 42.737 0.573 1
1 413 . 9 1 1 A 37 37 LEU N N 37 116.380 117.329 -0.949 1
1 414 . 9 1 1 A 38 38 GLN H H 38 7.190 7.583 -0.393 1
1 415 . 9 1 1 A 38 38 GLN HA H 38 3.530 4.465 -0.935 1
1 422 . 9 1 1 A 38 38 GLN C C 38 177.480 176.272 1.208 1
1 423 . 9 1 1 A 38 38 GLN CA C 38 58.370 56.838 1.532 1
1 424 . 9 1 1 A 38 38 GLN CB C 38 28.300 28.694 -0.394 1
1 426 . 9 1 1 A 38 38 GLN N N 38 119.210 117.653 1.557 1
1 428 . 9 1 1 A 39 39 GLY H H 39 8.940 8.884 0.056 1
1 429 . 9 1 1 A 39 39 GLY HA2 H 39 3.540 3.987 -0.447 1
1 430 . 9 1 1 A 39 39 GLY HA3 H 39 4.220 3.988 0.232 1
1 431 . 9 1 1 A 39 39 GLY C C 39 174.070 174.419 -0.349 1
1 432 . 9 1 1 A 39 39 GLY CA C 39 45.280 45.061 0.219 1
1 433 . 9 1 1 A 39 39 GLY N N 39 113.490 112.399 1.091 1
1 434 . 9 1 1 A 40 40 LYS H H 40 8.350 7.641 0.709 1
1 435 . 9 1 1 A 40 40 LYS HA H 40 4.400 4.604 -0.204 1
1 444 . 9 1 1 A 40 40 LYS C C 40 175.560 175.770 -0.210 1
1 445 . 9 1 1 A 40 40 LYS CA C 40 55.660 54.640 1.020 1
1 446 . 9 1 1 A 40 40 LYS CB C 40 32.870 33.762 -0.892 1
1 450 . 9 1 1 A 40 40 LYS N N 40 122.060 119.985 2.075 1
1 451 . 9 1 1 A 41 41 THR H H 41 8.410 8.572 -0.162 1
1 452 . 9 1 1 A 41 41 THR HA H 41 5.330 4.979 0.351 1
1 457 . 9 1 1 A 41 41 THR C C 41 174.860 174.480 0.380 1
1 458 . 9 1 1 A 41 41 THR CA C 41 62.040 61.664 0.376 1
1 459 . 9 1 1 A 41 41 THR CB C 41 69.420 70.886 -1.466 1
1 461 . 9 1 1 A 41 41 THR N N 41 118.150 117.345 0.805 1
1 462 . 9 1 1 A 42 42 VAL H H 42 9.140 9.142 -0.002 1
1 463 . 9 1 1 A 42 42 VAL HA H 42 4.570 4.992 -0.422 1
1 471 . 9 1 1 A 42 42 VAL C C 42 172.970 173.674 -0.704 1
1 472 . 9 1 1 A 42 42 VAL CA C 42 59.450 59.245 0.205 1
1 473 . 9 1 1 A 42 42 VAL CB C 42 35.880 35.084 0.796 1
1 476 . 9 1 1 A 42 42 VAL N N 42 122.510 120.651 1.859 1
1 477 . 9 1 1 A 43 43 ARG H H 43 8.420 8.758 -0.338 1
1 478 . 9 1 1 A 43 43 ARG HA H 43 4.750 4.990 -0.240 1
1 485 . 9 1 1 A 43 43 ARG C C 43 175.650 174.912 0.738 1
1 486 . 9 1 1 A 43 43 ARG CA C 43 53.650 53.960 -0.310 1
1 487 . 9 1 1 A 43 43 ARG CB C 43 33.870 33.901 -0.031 1
1 490 . 9 1 1 A 43 43 ARG N N 43 120.640 122.800 -2.160 1
1 491 . 9 1 1 A 44 44 THR H H 44 8.370 8.565 -0.195 1
1 492 . 9 1 1 A 44 44 THR HA H 44 3.410 3.773 -0.363 1
1 497 . 9 1 1 A 44 44 THR C C 44 175.020 175.809 -0.789 1
1 498 . 9 1 1 A 44 44 THR CA C 44 65.660 65.089 0.571 1
1 499 . 9 1 1 A 44 44 THR CB C 44 69.400 68.307 1.093 1
1 501 . 9 1 1 A 44 44 THR N N 44 118.590 119.281 -0.691 1
1 502 . 9 1 1 A 45 45 GLY H H 45 9.090 8.714 0.376 1
1 503 . 9 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 9 1 1 A 45 45 GLY HA3 H 45 4.470 4.020 0.450 1
1 505 . 9 1 1 A 45 45 GLY C C 45 174.350 173.847 0.503 1
1 506 . 9 1 1 A 45 45 GLY CA C 45 45.000 44.945 0.055 1
1 507 . 9 1 1 A 45 45 GLY N N 45 117.350 115.028 2.322 1
1 508 . 9 1 1 A 46 46 ASP H H 46 8.010 7.904 0.106 1
1 509 . 9 1 1 A 46 46 ASP HA H 46 4.470 4.608 -0.138 1
1 512 . 9 1 1 A 46 46 ASP C C 46 174.570 174.498 0.072 1
1 513 . 9 1 1 A 46 46 ASP CA C 46 55.570 55.478 0.092 1
1 514 . 9 1 1 A 46 46 ASP CB C 46 41.680 41.580 0.100 1
1 515 . 9 1 1 A 46 46 ASP N N 46 122.240 122.282 -0.042 1
1 516 . 9 1 1 A 47 47 VAL H H 47 8.330 8.437 -0.107 1
1 517 . 9 1 1 A 47 47 VAL HA H 47 4.950 4.911 0.039 1
1 525 . 9 1 1 A 47 47 VAL C C 47 176.330 175.551 0.779 1
1 526 . 9 1 1 A 47 47 VAL CA C 47 61.710 60.890 0.820 1
1 527 . 9 1 1 A 47 47 VAL CB C 47 32.900 35.247 -2.347 1
1 530 . 9 1 1 A 47 47 VAL N N 47 119.860 121.775 -1.915 1
1 531 . 9 1 1 A 48 48 ILE H H 48 9.160 8.685 0.475 1
1 532 . 9 1 1 A 48 48 ILE HA H 48 4.630 5.166 -0.536 1
1 542 . 9 1 1 A 48 48 ILE C C 48 174.400 174.437 -0.037 1
1 543 . 9 1 1 A 48 48 ILE CA C 48 58.990 59.281 -0.291 1
1 544 . 9 1 1 A 48 48 ILE CB C 48 41.810 42.146 -0.336 1
1 548 . 9 1 1 A 48 48 ILE N N 48 124.990 121.629 3.361 1
1 549 . 9 1 1 A 49 49 GLY H H 49 8.660 8.964 -0.304 1
1 550 . 9 1 1 A 49 49 GLY HA2 H 49 4.950 4.312 0.638 1
1 551 . 9 1 1 A 49 49 GLY HA3 H 49 3.620 4.353 -0.733 1
1 552 . 9 1 1 A 49 49 GLY C C 49 172.920 171.998 0.922 1
1 553 . 9 1 1 A 49 49 GLY CA C 49 44.580 44.469 0.111 1
1 554 . 9 1 1 A 49 49 GLY N N 49 112.060 109.397 2.663 1
1 555 . 9 1 1 A 50 50 ILE H H 50 8.810 9.107 -0.297 1
1 556 . 9 1 1 A 50 50 ILE HA H 50 4.370 4.780 -0.410 1
1 566 . 9 1 1 A 50 50 ILE C C 50 174.500 174.823 -0.323 1
1 567 . 9 1 1 A 50 50 ILE CA C 50 59.550 59.814 -0.264 1
1 568 . 9 1 1 A 50 50 ILE CB C 50 41.300 41.809 -0.509 1
1 572 . 9 1 1 A 50 50 ILE N N 50 123.220 125.459 -2.239 1
1 573 . 9 1 1 A 51 51 SER H H 51 8.540 8.849 -0.309 1
1 574 . 9 1 1 A 51 51 SER HA H 51 4.830 4.987 -0.157 1
1 577 . 9 1 1 A 51 51 SER C C 51 174.130 173.781 0.349 1
1 578 . 9 1 1 A 51 51 SER CA C 51 57.770 57.057 0.713 1
1 579 . 9 1 1 A 51 51 SER CB C 51 63.040 64.171 -1.131 1
1 580 . 9 1 1 A 51 51 SER N N 51 121.430 122.554 -1.124 1
1 581 . 9 1 1 A 52 52 ILE H H 52 8.930 8.706 0.224 1
1 582 . 9 1 1 A 52 52 ILE HA H 52 4.290 4.597 -0.307 1
1 592 . 9 1 1 A 52 52 ILE C C 52 175.280 176.301 -1.021 1
1 593 . 9 1 1 A 52 52 ILE CA C 52 60.250 59.981 0.269 1
1 594 . 9 1 1 A 52 52 ILE CB C 52 39.840 40.467 -0.627 1
1 598 . 9 1 1 A 52 52 ILE N N 52 127.060 127.696 -0.636 1
1 599 . 9 1 1 A 53 53 LEU H H 53 9.380 9.400 -0.020 1
1 600 . 9 1 1 A 53 53 LEU HA H 53 3.890 3.986 -0.096 1
1 610 . 9 1 1 A 53 53 LEU C C 53 177.130 176.011 1.119 1
1 611 . 9 1 1 A 53 53 LEU CA C 53 55.560 55.962 -0.402 1
1 612 . 9 1 1 A 53 53 LEU CB C 53 39.370 41.051 -1.681 1
1 616 . 9 1 1 A 53 53 LEU N N 53 126.770 128.376 -1.606 1
1 617 . 9 1 1 A 54 54 GLY H H 54 8.310 8.700 -0.390 1
1 618 . 9 1 1 A 54 54 GLY HA2 H 54 3.490 3.899 -0.409 1
1 619 . 9 1 1 A 54 54 GLY HA3 H 54 4.080 3.899 0.181 1
1 620 . 9 1 1 A 54 54 GLY C C 54 173.690 173.820 -0.130 1
1 621 . 9 1 1 A 54 54 GLY CA C 54 45.340 45.687 -0.347 1
1 622 . 9 1 1 A 54 54 GLY N N 54 103.820 104.979 -1.159 1
1 623 . 9 1 1 A 55 55 LYS H H 55 7.730 7.955 -0.225 1
1 624 . 9 1 1 A 55 55 LYS HA H 55 4.560 4.834 -0.274 1
1 633 . 9 1 1 A 55 55 LYS C C 55 174.550 175.005 -0.455 1
1 634 . 9 1 1 A 55 55 LYS CA C 55 54.140 54.280 -0.140 1
1 635 . 9 1 1 A 55 55 LYS CB C 55 34.620 35.834 -1.214 1
1 639 . 9 1 1 A 55 55 LYS N N 55 121.160 119.942 1.218 1
1 640 . 9 1 1 A 56 56 GLU H H 56 8.490 8.791 -0.301 1
1 641 . 9 1 1 A 56 56 GLU HA H 56 4.280 4.689 -0.409 1
1 646 . 9 1 1 A 56 56 GLU C C 56 175.730 175.202 0.528 1
1 647 . 9 1 1 A 56 56 GLU CA C 56 56.730 56.334 0.396 1
1 648 . 9 1 1 A 56 56 GLU CB C 56 30.070 30.684 -0.614 1
1 650 . 9 1 1 A 56 56 GLU N N 56 124.090 123.911 0.179 1
1 651 . 9 1 1 A 57 57 VAL H H 57 8.920 8.489 0.431 1
1 652 . 9 1 1 A 57 57 VAL HA H 57 4.030 4.831 -0.801 1
1 660 . 9 1 1 A 57 57 VAL C C 57 174.610 173.730 0.880 1
1 661 . 9 1 1 A 57 57 VAL CA C 57 61.680 59.545 2.135 1
1 662 . 9 1 1 A 57 57 VAL CB C 57 33.880 34.569 -0.689 1
1 665 . 9 1 1 A 57 57 VAL N N 57 129.960 126.546 3.414 1
1 666 . 9 1 1 A 58 58 LYS H H 58 7.860 8.715 -0.855 1
1 667 . 9 1 1 A 58 58 LYS HA H 58 5.120 4.833 0.287 1
1 676 . 9 1 1 A 58 58 LYS C C 58 175.380 175.698 -0.318 1
1 677 . 9 1 1 A 58 58 LYS CA C 58 55.200 54.706 0.494 1
1 678 . 9 1 1 A 58 58 LYS CB C 58 34.670 34.018 0.652 1
1 682 . 9 1 1 A 58 58 LYS N N 58 124.790 127.353 -2.563 1
1 683 . 9 1 1 A 59 59 PHE H H 59 9.270 9.091 0.179 1
1 684 . 9 1 1 A 59 59 PHE HA H 59 4.960 5.080 -0.120 1
1 692 . 9 1 1 A 59 59 PHE C C 59 173.950 174.449 -0.499 1
1 693 . 9 1 1 A 59 59 PHE CA C 59 55.910 56.425 -0.515 1
1 694 . 9 1 1 A 59 59 PHE CB C 59 42.950 41.970 0.980 1
1 700 . 9 1 1 A 59 59 PHE N N 59 118.270 122.844 -4.574 1
1 701 . 9 1 1 A 60 60 LYS H H 60 9.170 8.946 0.224 1
1 702 . 9 1 1 A 60 60 LYS HA H 60 4.910 4.929 -0.019 1
1 711 . 9 1 1 A 60 60 LYS C C 60 176.230 175.870 0.360 1
1 712 . 9 1 1 A 60 60 LYS CA C 60 53.910 54.538 -0.628 1
1 713 . 9 1 1 A 60 60 LYS CB C 60 35.170 34.776 0.394 1
1 717 . 9 1 1 A 60 60 LYS N N 60 121.960 124.439 -2.479 1
1 718 . 9 1 1 A 61 61 VAL H H 61 9.400 8.839 0.561 1
1 719 . 9 1 1 A 61 61 VAL HA H 61 4.170 4.042 0.128 1
1 727 . 9 1 1 A 61 61 VAL C C 61 175.500 175.334 0.166 1
1 728 . 9 1 1 A 61 61 VAL CA C 61 61.980 63.371 -1.391 1
1 729 . 9 1 1 A 61 61 VAL CB C 61 29.490 31.191 -1.701 1
1 732 . 9 1 1 A 61 61 VAL N N 61 127.140 127.067 0.073 1
1 733 . 9 1 1 A 62 62 VAL H H 62 8.390 8.583 -0.193 1
1 734 . 9 1 1 A 62 62 VAL HA H 62 3.650 3.968 -0.318 1
1 742 . 9 1 1 A 62 62 VAL C C 62 176.440 176.060 0.380 1
1 743 . 9 1 1 A 62 62 VAL CA C 62 64.930 64.408 0.522 1
1 744 . 9 1 1 A 62 62 VAL CB C 62 32.130 32.483 -0.353 1
1 747 . 9 1 1 A 62 62 VAL N N 62 132.840 129.474 3.366 1
1 748 . 9 1 1 A 63 63 GLN H H 63 7.470 7.137 0.333 1
1 749 . 9 1 1 A 63 63 GLN HA H 63 4.270 4.467 -0.197 1
1 756 . 9 1 1 A 63 63 GLN C C 63 172.290 173.386 -1.096 1
1 757 . 9 1 1 A 63 63 GLN CA C 63 56.640 55.473 1.167 1
1 758 . 9 1 1 A 63 63 GLN CB C 63 32.630 31.946 0.684 1
1 760 . 9 1 1 A 63 63 GLN N N 63 114.500 116.786 -2.286 1
1 762 . 9 1 1 A 64 64 ALA H H 64 8.200 8.580 -0.380 1
1 763 . 9 1 1 A 64 64 ALA HA H 64 4.830 5.404 -0.574 1
1 767 . 9 1 1 A 64 64 ALA C C 64 174.270 175.602 -1.332 1
1 768 . 9 1 1 A 64 64 ALA CA C 64 50.800 50.010 0.790 1
1 769 . 9 1 1 A 64 64 ALA CB C 64 20.100 22.035 -1.935 1
1 770 . 9 1 1 A 64 64 ALA N N 64 131.410 128.757 2.653 1
1 771 . 9 1 1 A 65 65 TYR H H 65 8.860 8.588 0.272 1
1 772 . 9 1 1 A 65 65 TYR HA H 65 4.540 4.966 -0.426 1
1 779 . 9 1 1 A 65 65 TYR CA C 65 54.270 55.142 -0.872 1
1 780 . 9 1 1 A 65 65 TYR CB C 65 41.360 40.681 0.679 1
1 785 . 9 1 1 A 65 65 TYR N N 65 124.140 120.061 4.079 1
1 786 . 9 1 1 A 66 66 PRO HA H 66 4.120 4.741 -0.621 1
1 793 . 9 1 1 A 66 66 PRO CA C 66 63.450 62.362 1.088 1
1 794 . 9 1 1 A 66 66 PRO CB C 66 34.170 32.836 1.334 1
1 797 . 9 1 1 A 67 67 SER H H 67 7.380 8.238 -0.858 1
1 798 . 9 1 1 A 67 67 SER HA H 67 4.720 4.980 -0.260 1
1 801 . 9 1 1 A 67 67 SER CA C 67 54.250 56.056 -1.806 1
1 802 . 9 1 1 A 67 67 SER CB C 67 64.530 63.738 0.792 1
1 803 . 9 1 1 A 67 67 SER N N 67 106.200 116.670 -10.470 1
1 804 . 9 1 1 A 68 68 PRO HA H 68 4.880 4.629 0.251 1
1 811 . 9 1 1 A 68 68 PRO CA C 68 62.990 62.491 0.499 1
1 812 . 9 1 1 A 68 68 PRO CB C 68 35.220 33.172 2.048 1
1 815 . 9 1 1 A 69 69 LEU H H 69 8.960 7.984 0.976 1
1 816 . 9 1 1 A 69 69 LEU HA H 69 4.430 5.074 -0.644 1
1 826 . 9 1 1 A 69 69 LEU C C 69 174.570 175.291 -0.721 1
1 827 . 9 1 1 A 69 69 LEU CA C 69 53.900 52.663 1.237 1
1 828 . 9 1 1 A 69 69 LEU CB C 69 44.210 45.902 -1.692 1
1 832 . 9 1 1 A 69 69 LEU N N 69 120.480 117.113 3.367 1
1 833 . 9 1 1 A 70 70 ARG H H 70 8.130 8.372 -0.242 1
1 834 . 9 1 1 A 70 70 ARG HA H 70 4.930 4.779 0.151 1
1 841 . 9 1 1 A 70 70 ARG C C 70 175.460 176.230 -0.770 1
1 842 . 9 1 1 A 70 70 ARG CA C 70 54.040 55.682 -1.642 1
1 843 . 9 1 1 A 70 70 ARG CB C 70 30.550 31.593 -1.043 1
1 846 . 9 1 1 A 70 70 ARG N N 70 125.180 119.655 5.525 1
1 847 . 9 1 1 A 71 71 VAL H H 71 8.450 8.168 0.282 1
1 848 . 9 1 1 A 71 71 VAL HA H 71 3.410 4.434 -1.024 1
1 856 . 9 1 1 A 71 71 VAL C C 71 175.460 175.463 -0.003 1
1 857 . 9 1 1 A 71 71 VAL CA C 71 65.210 62.146 3.064 1
1 858 . 9 1 1 A 71 71 VAL CB C 71 29.840 32.091 -2.251 1
1 861 . 9 1 1 A 71 71 VAL N N 71 128.170 122.873 5.297 1
1 862 . 9 1 1 A 72 72 GLU H H 72 8.620 8.475 0.145 1
1 863 . 9 1 1 A 72 72 GLU HA H 72 4.870 4.849 0.021 1
1 868 . 9 1 1 A 72 72 GLU C C 72 176.960 176.296 0.664 1
1 869 . 9 1 1 A 72 72 GLU CA C 72 54.330 54.434 -0.104 1
1 870 . 9 1 1 A 72 72 GLU CB C 72 33.280 33.130 0.150 1
1 872 . 9 1 1 A 72 72 GLU N N 72 127.670 126.636 1.034 1
1 873 . 9 1 1 A 73 73 ASP H H 73 8.700 8.842 -0.142 1
1 874 . 9 1 1 A 73 73 ASP HA H 73 4.150 4.279 -0.129 1
1 877 . 9 1 1 A 73 73 ASP C C 73 177.460 177.771 -0.311 1
1 878 . 9 1 1 A 73 73 ASP CA C 73 57.620 57.296 0.324 1
1 879 . 9 1 1 A 73 73 ASP CB C 73 40.360 40.431 -0.071 1
1 880 . 9 1 1 A 73 73 ASP N N 73 121.140 126.993 -5.853 1
1 881 . 9 1 1 A 74 74 ARG H H 74 7.760 7.723 0.037 1
1 882 . 9 1 1 A 74 74 ARG HA H 74 4.280 4.352 -0.072 1
1 889 . 9 1 1 A 74 74 ARG C C 74 176.510 176.786 -0.276 1
1 890 . 9 1 1 A 74 74 ARG CA C 74 55.450 56.866 -1.416 1
1 891 . 9 1 1 A 74 74 ARG CB C 74 29.990 30.837 -0.847 1
1 894 . 9 1 1 A 74 74 ARG N N 74 112.890 116.309 -3.419 1
1 895 . 9 1 1 A 75 75 THR H H 75 7.700 7.410 0.290 1
1 896 . 9 1 1 A 75 75 THR HA H 75 4.020 4.258 -0.238 1
1 901 . 9 1 1 A 75 75 THR C C 75 173.810 174.072 -0.262 1
1 902 . 9 1 1 A 75 75 THR CA C 75 64.060 63.550 0.510 1
1 903 . 9 1 1 A 75 75 THR CB C 75 69.350 70.051 -0.701 1
1 905 . 9 1 1 A 75 75 THR N N 75 120.650 116.658 3.992 1
1 906 . 9 1 1 A 76 76 LYS H H 76 8.520 8.276 0.244 1
1 907 . 9 1 1 A 76 76 LYS HA H 76 4.270 4.670 -0.400 1
1 916 . 9 1 1 A 76 76 LYS C C 76 174.560 175.842 -1.282 1
1 917 . 9 1 1 A 76 76 LYS CA C 76 56.280 56.034 0.246 1
1 918 . 9 1 1 A 76 76 LYS CB C 76 33.120 33.622 -0.502 1
1 922 . 9 1 1 A 76 76 LYS N N 76 130.950 126.827 4.123 1
1 923 . 9 1 1 A 77 77 ILE H H 77 8.430 8.739 -0.309 1
1 924 . 9 1 1 A 77 77 ILE HA H 77 4.850 5.201 -0.351 1
1 934 . 9 1 1 A 77 77 ILE C C 77 174.650 174.955 -0.305 1
1 935 . 9 1 1 A 77 77 ILE CA C 77 59.820 60.091 -0.271 1
1 936 . 9 1 1 A 77 77 ILE CB C 77 38.280 40.891 -2.611 1
1 940 . 9 1 1 A 77 77 ILE N N 77 128.020 123.659 4.361 1
1 941 . 9 1 1 A 78 78 THR H H 78 8.870 8.740 0.130 1
1 942 . 9 1 1 A 78 78 THR HA H 78 4.470 5.115 -0.645 1
1 947 . 9 1 1 A 78 78 THR C C 78 172.760 173.360 -0.600 1
1 948 . 9 1 1 A 78 78 THR CA C 78 60.740 61.335 -0.595 1
1 949 . 9 1 1 A 78 78 THR CB C 78 71.320 71.483 -0.163 1
1 951 . 9 1 1 A 78 78 THR N N 78 123.870 124.015 -0.145 1
1 952 . 9 1 1 A 79 79 LEU H H 79 8.820 8.975 -0.155 1
1 953 . 9 1 1 A 79 79 LEU HA H 79 5.140 5.065 0.075 1
1 963 . 9 1 1 A 79 79 LEU C C 79 176.610 175.910 0.700 1
1 964 . 9 1 1 A 79 79 LEU CA C 79 53.280 53.391 -0.111 1
1 965 . 9 1 1 A 79 79 LEU CB C 79 42.600 42.858 -0.258 1
1 969 . 9 1 1 A 79 79 LEU N N 79 127.070 126.700 0.370 1
1 970 . 9 1 1 A 80 80 VAL H H 80 8.800 8.859 -0.059 1
1 971 . 9 1 1 A 80 80 VAL HA H 80 4.260 4.360 -0.100 1
1 979 . 9 1 1 A 80 80 VAL CA C 80 61.350 62.067 -0.717 1
1 980 . 9 1 1 A 80 80 VAL CB C 80 32.790 32.307 0.483 1
1 983 . 9 1 1 A 80 80 VAL N N 80 124.120 124.707 -0.587 1
1 984 . 9 1 1 A 81 81 THR H H 81 8.160 8.873 -0.713 1
1 985 . 9 1 1 A 81 81 THR HA H 81 4.410 4.630 -0.220 1
1 990 . 9 1 1 A 81 81 THR CA C 81 60.800 62.280 -1.480 1
1 991 . 9 1 1 A 81 81 THR CB C 81 69.650 70.290 -0.640 1
1 993 . 9 1 1 A 81 81 THR N N 81 114.500 115.434 -0.934 1
1 1 . 10 1 1 A 9 9 GLY H H 9 8.390 7.928 0.462 1
1 2 . 10 1 1 A 9 9 GLY HA2 H 9 3.900 4.056 -0.156 1
1 3 . 10 1 1 A 9 9 GLY HA3 H 9 3.860 4.057 -0.197 1
1 4 . 10 1 1 A 9 9 GLY CA C 9 45.150 44.156 0.994 1
1 5 . 10 1 1 A 9 9 GLY N N 9 110.000 106.376 3.624 1
1 6 . 10 1 1 A 10 10 VAL H H 10 7.870 8.361 -0.491 1
1 7 . 10 1 1 A 10 10 VAL HA H 10 4.040 4.437 -0.397 1
1 15 . 10 1 1 A 10 10 VAL C C 10 175.880 174.868 1.012 1
1 16 . 10 1 1 A 10 10 VAL CA C 10 62.110 62.426 -0.316 1
1 17 . 10 1 1 A 10 10 VAL CB C 10 32.760 32.508 0.252 1
1 20 . 10 1 1 A 10 10 VAL N N 10 119.730 120.015 -0.285 1
1 21 . 10 1 1 A 11 11 ILE H H 11 8.230 8.835 -0.605 1
1 22 . 10 1 1 A 11 11 ILE HA H 11 4.090 4.908 -0.818 1
1 32 . 10 1 1 A 11 11 ILE C C 11 175.850 175.163 0.687 1
1 33 . 10 1 1 A 11 11 ILE CA C 11 60.800 59.925 0.875 1
1 34 . 10 1 1 A 11 11 ILE CB C 11 38.470 40.103 -1.633 1
1 38 . 10 1 1 A 11 11 ILE N N 11 125.570 128.023 -2.453 1
1 39 . 10 1 1 A 12 12 MET H H 12 8.370 8.944 -0.574 1
1 40 . 10 1 1 A 12 12 MET HA H 12 4.540 5.395 -0.855 1
1 48 . 10 1 1 A 12 12 MET C C 12 174.830 175.145 -0.315 1
1 49 . 10 1 1 A 12 12 MET CA C 12 54.790 53.618 1.172 1
1 50 . 10 1 1 A 12 12 MET CB C 12 32.640 35.519 -2.879 1
1 53 . 10 1 1 A 12 12 MET N N 12 125.930 124.424 1.506 1
1 54 . 10 1 1 A 13 13 SER H H 13 7.990 8.965 -0.975 1
1 55 . 10 1 1 A 13 13 SER HA H 13 5.030 5.453 -0.423 1
1 58 . 10 1 1 A 13 13 SER C C 13 174.330 173.750 0.580 1
1 59 . 10 1 1 A 13 13 SER CA C 13 57.320 55.718 1.602 1
1 60 . 10 1 1 A 13 13 SER CB C 13 64.790 66.225 -1.435 1
1 61 . 10 1 1 A 13 13 SER N N 13 116.400 117.231 -0.831 1
1 62 . 10 1 1 A 14 14 GLU H H 14 9.430 8.606 0.824 1
1 63 . 10 1 1 A 14 14 GLU HA H 14 5.250 5.424 -0.174 1
1 68 . 10 1 1 A 14 14 GLU C C 14 172.980 174.838 -1.858 1
1 69 . 10 1 1 A 14 14 GLU CA C 14 55.390 55.060 0.330 1
1 70 . 10 1 1 A 14 14 GLU CB C 14 33.910 34.442 -0.532 1
1 72 . 10 1 1 A 14 14 GLU N N 14 123.670 119.530 4.140 1
1 73 . 10 1 1 A 15 15 LEU H H 15 8.930 8.872 0.058 1
1 74 . 10 1 1 A 15 15 LEU HA H 15 4.870 5.145 -0.275 1
1 84 . 10 1 1 A 15 15 LEU C C 15 174.000 174.576 -0.576 1
1 85 . 10 1 1 A 15 15 LEU CA C 15 53.020 53.923 -0.903 1
1 86 . 10 1 1 A 15 15 LEU CB C 15 46.040 46.074 -0.034 1
1 90 . 10 1 1 A 15 15 LEU N N 15 125.350 125.781 -0.431 1
1 91 . 10 1 1 A 16 16 LYS H H 16 8.840 8.775 0.065 1
1 92 . 10 1 1 A 16 16 LYS HA H 16 5.360 4.965 0.395 1
1 101 . 10 1 1 A 16 16 LYS C C 16 175.660 175.884 -0.224 1
1 102 . 10 1 1 A 16 16 LYS CA C 16 54.940 55.275 -0.335 1
1 103 . 10 1 1 A 16 16 LYS CB C 16 34.280 34.322 -0.042 1
1 107 . 10 1 1 A 16 16 LYS N N 16 124.640 126.933 -2.293 1
1 108 . 10 1 1 A 17 17 LEU H H 17 8.820 9.045 -0.225 1
1 109 . 10 1 1 A 17 17 LEU HA H 17 5.430 5.168 0.262 1
1 119 . 10 1 1 A 17 17 LEU C C 17 174.630 175.772 -1.142 1
1 120 . 10 1 1 A 17 17 LEU CA C 17 52.900 53.604 -0.704 1
1 121 . 10 1 1 A 17 17 LEU CB C 17 46.910 45.776 1.134 1
1 125 . 10 1 1 A 17 17 LEU N N 17 123.460 126.433 -2.973 1
1 126 . 10 1 1 A 18 18 LYS H H 18 9.110 8.641 0.469 1
1 127 . 10 1 1 A 18 18 LYS HA H 18 5.490 4.985 0.505 1
1 136 . 10 1 1 A 18 18 LYS CA C 18 52.270 52.933 -0.663 1
1 137 . 10 1 1 A 18 18 LYS CB C 18 37.500 36.280 1.220 1
1 141 . 10 1 1 A 18 18 LYS N N 18 122.230 123.404 -1.174 1
1 142 . 10 1 1 A 19 19 PRO HA H 19 4.100 4.475 -0.375 1
1 149 . 10 1 1 A 19 19 PRO CA C 19 62.440 62.603 -0.163 1
1 150 . 10 1 1 A 19 19 PRO CB C 19 30.640 32.193 -1.553 1
1 153 . 10 1 1 A 20 20 LEU H H 20 8.490 8.428 0.062 1
1 154 . 10 1 1 A 20 20 LEU HA H 20 4.320 4.275 0.045 1
1 164 . 10 1 1 A 20 20 LEU CA C 20 57.680 58.585 -0.905 1
1 165 . 10 1 1 A 20 20 LEU CB C 20 38.760 41.639 -2.879 1
1 169 . 10 1 1 A 20 20 LEU N N 20 123.250 119.571 3.679 1
1 170 . 10 1 1 A 21 21 PRO HA H 21 4.530 4.531 -0.001 1
1 177 . 10 1 1 A 21 21 PRO CA C 21 62.880 62.489 0.391 1
1 178 . 10 1 1 A 21 21 PRO CB C 21 31.420 32.229 -0.809 1
1 181 . 10 1 1 A 22 22 LYS H H 22 8.180 8.405 -0.225 1
1 182 . 10 1 1 A 22 22 LYS HA H 22 4.110 4.428 -0.318 1
1 191 . 10 1 1 A 22 22 LYS C C 22 175.680 175.468 0.212 1
1 192 . 10 1 1 A 22 22 LYS CA C 22 56.210 55.744 0.466 1
1 193 . 10 1 1 A 22 22 LYS CB C 22 30.660 31.881 -1.221 1
1 197 . 10 1 1 A 22 22 LYS N N 22 119.160 121.910 -2.750 1
1 198 . 10 1 1 A 23 23 VAL H H 23 7.530 8.021 -0.491 1
1 199 . 10 1 1 A 23 23 VAL HA H 23 4.280 4.762 -0.482 1
1 207 . 10 1 1 A 23 23 VAL C C 23 173.690 173.437 0.253 1
1 208 . 10 1 1 A 23 23 VAL CA C 23 59.830 59.559 0.271 1
1 209 . 10 1 1 A 23 23 VAL CB C 23 34.550 35.527 -0.977 1
1 212 . 10 1 1 A 23 23 VAL N N 23 121.820 122.974 -1.154 1
1 213 . 10 1 1 A 24 24 GLU H H 24 8.270 8.816 -0.546 1
1 214 . 10 1 1 A 24 24 GLU HA H 24 4.330 4.816 -0.486 1
1 219 . 10 1 1 A 24 24 GLU C C 24 175.390 175.250 0.140 1
1 220 . 10 1 1 A 24 24 GLU CA C 24 55.220 55.400 -0.180 1
1 221 . 10 1 1 A 24 24 GLU CB C 24 29.970 31.032 -1.062 1
1 223 . 10 1 1 A 24 24 GLU N N 24 125.610 126.976 -1.366 1
1 224 . 10 1 1 A 25 25 LEU H H 25 8.480 8.750 -0.270 1
1 225 . 10 1 1 A 25 25 LEU HA H 25 4.520 4.451 0.069 1
1 235 . 10 1 1 A 25 25 LEU CA C 25 51.660 51.166 0.494 1
1 236 . 10 1 1 A 25 25 LEU CB C 25 41.750 41.190 0.560 1
1 240 . 10 1 1 A 25 25 LEU N N 25 125.880 126.661 -0.781 1
1 241 . 10 1 1 A 26 26 PRO HA H 26 4.760 4.645 0.115 1
1 248 . 10 1 1 A 26 26 PRO CA C 26 61.330 61.913 -0.583 1
1 249 . 10 1 1 A 26 26 PRO CB C 26 31.060 32.838 -1.778 1
1 252 . 10 1 1 A 27 27 PRO HA H 27 4.390 4.413 -0.023 1
1 259 . 10 1 1 A 27 27 PRO CA C 27 64.550 64.885 -0.335 1
1 260 . 10 1 1 A 27 27 PRO CB C 27 31.770 31.741 0.029 1
1 263 . 10 1 1 A 28 28 ASP H H 28 8.560 8.830 -0.270 1
1 264 . 10 1 1 A 28 28 ASP HA H 28 4.620 4.410 0.210 1
1 267 . 10 1 1 A 28 28 ASP C C 28 177.100 178.817 -1.717 1
1 268 . 10 1 1 A 28 28 ASP CA C 28 53.890 56.528 -2.638 1
1 269 . 10 1 1 A 28 28 ASP CB C 28 39.120 39.520 -0.400 1
1 270 . 10 1 1 A 28 28 ASP N N 28 115.820 117.841 -2.021 1
1 271 . 10 1 1 A 29 29 PHE H H 29 7.940 7.918 0.022 1
1 272 . 10 1 1 A 29 29 PHE HA H 29 4.180 4.339 -0.159 1
1 280 . 10 1 1 A 29 29 PHE C C 29 176.740 178.270 -1.530 1
1 281 . 10 1 1 A 29 29 PHE CA C 29 61.020 61.034 -0.014 1
1 282 . 10 1 1 A 29 29 PHE CB C 29 39.230 38.767 0.463 1
1 288 . 10 1 1 A 29 29 PHE N N 29 119.610 118.209 1.401 1
1 289 . 10 1 1 A 30 30 VAL H H 30 8.010 8.457 -0.447 1
1 290 . 10 1 1 A 30 30 VAL HA H 30 3.350 3.771 -0.421 1
1 298 . 10 1 1 A 30 30 VAL C C 30 176.400 177.112 -0.712 1
1 299 . 10 1 1 A 30 30 VAL CA C 30 66.510 64.822 1.688 1
1 300 . 10 1 1 A 30 30 VAL CB C 30 31.020 31.049 -0.029 1
1 303 . 10 1 1 A 30 30 VAL N N 30 116.370 119.564 -3.194 1
1 304 . 10 1 1 A 31 31 ASP H H 31 7.420 7.982 -0.562 1
1 305 . 10 1 1 A 31 31 ASP HA H 31 4.310 4.366 -0.056 1
1 308 . 10 1 1 A 31 31 ASP C C 31 178.360 178.891 -0.531 1
1 309 . 10 1 1 A 31 31 ASP CA C 31 57.110 57.101 0.009 1
1 310 . 10 1 1 A 31 31 ASP CB C 31 40.450 40.895 -0.445 1
1 311 . 10 1 1 A 31 31 ASP N N 31 119.190 121.600 -2.410 1
1 312 . 10 1 1 A 32 32 VAL H H 32 7.190 7.377 -0.187 1
1 313 . 10 1 1 A 32 32 VAL HA H 32 3.510 3.548 -0.038 1
1 321 . 10 1 1 A 32 32 VAL C C 32 178.100 178.533 -0.433 1
1 322 . 10 1 1 A 32 32 VAL CA C 32 65.570 66.374 -0.804 1
1 323 . 10 1 1 A 32 32 VAL CB C 32 31.410 31.293 0.117 1
1 326 . 10 1 1 A 32 32 VAL N N 32 119.830 120.236 -0.406 1
1 327 . 10 1 1 A 33 33 ILE H H 33 7.660 8.456 -0.796 1
1 328 . 10 1 1 A 33 33 ILE HA H 33 3.170 3.523 -0.353 1
1 338 . 10 1 1 A 33 33 ILE C C 33 176.660 178.139 -1.479 1
1 339 . 10 1 1 A 33 33 ILE CA C 33 65.220 65.221 -0.001 1
1 340 . 10 1 1 A 33 33 ILE CB C 33 37.500 37.652 -0.152 1
1 344 . 10 1 1 A 33 33 ILE N N 33 118.490 120.826 -2.336 1
1 345 . 10 1 1 A 34 34 ARG H H 34 7.830 7.718 0.112 1
1 346 . 10 1 1 A 34 34 ARG HA H 34 3.380 3.896 -0.516 1
1 354 . 10 1 1 A 34 34 ARG C C 34 178.060 177.488 0.572 1
1 355 . 10 1 1 A 34 34 ARG CA C 34 60.570 58.896 1.674 1
1 356 . 10 1 1 A 34 34 ARG CB C 34 30.070 29.788 0.282 1
1 359 . 10 1 1 A 34 34 ARG N N 34 118.260 119.960 -1.700 1
1 361 . 10 1 1 A 35 35 ILE H H 35 7.350 7.839 -0.489 1
1 362 . 10 1 1 A 35 35 ILE HA H 35 3.720 3.703 0.017 1
1 372 . 10 1 1 A 35 35 ILE C C 35 179.090 178.050 1.040 1
1 373 . 10 1 1 A 35 35 ILE CA C 35 64.060 65.376 -1.316 1
1 374 . 10 1 1 A 35 35 ILE CB C 35 38.030 37.406 0.624 1
1 378 . 10 1 1 A 35 35 ILE N N 35 116.750 119.573 -2.823 1
1 379 . 10 1 1 A 36 36 LYS H H 36 7.880 7.637 0.243 1
1 380 . 10 1 1 A 36 36 LYS HA H 36 4.090 3.963 0.127 1
1 389 . 10 1 1 A 36 36 LYS C C 36 178.560 178.973 -0.413 1
1 390 . 10 1 1 A 36 36 LYS CA C 36 57.650 59.768 -2.118 1
1 391 . 10 1 1 A 36 36 LYS CB C 36 32.090 32.246 -0.156 1
1 395 . 10 1 1 A 36 36 LYS N N 36 118.700 119.807 -1.107 1
1 396 . 10 1 1 A 37 37 LEU H H 37 7.860 7.401 0.459 1
1 397 . 10 1 1 A 37 37 LEU HA H 37 4.230 4.280 -0.050 1
1 407 . 10 1 1 A 37 37 LEU C C 37 175.880 176.783 -0.903 1
1 408 . 10 1 1 A 37 37 LEU CA C 37 54.090 55.996 -1.906 1
1 409 . 10 1 1 A 37 37 LEU CB C 37 43.310 42.682 0.628 1
1 413 . 10 1 1 A 37 37 LEU N N 37 116.380 117.461 -1.081 1
1 414 . 10 1 1 A 38 38 GLN H H 38 7.190 7.568 -0.378 1
1 415 . 10 1 1 A 38 38 GLN HA H 38 3.530 4.502 -0.972 1
1 422 . 10 1 1 A 38 38 GLN C C 38 177.480 176.270 1.210 1
1 423 . 10 1 1 A 38 38 GLN CA C 38 58.370 56.839 1.531 1
1 424 . 10 1 1 A 38 38 GLN CB C 38 28.300 28.694 -0.394 1
1 426 . 10 1 1 A 38 38 GLN N N 38 119.210 117.619 1.591 1
1 428 . 10 1 1 A 39 39 GLY H H 39 8.940 8.880 0.060 1
1 429 . 10 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 10 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 10 1 1 A 39 39 GLY C C 39 174.070 174.390 -0.320 1
1 432 . 10 1 1 A 39 39 GLY CA C 39 45.280 45.064 0.216 1
1 433 . 10 1 1 A 39 39 GLY N N 39 113.490 112.403 1.087 1
1 434 . 10 1 1 A 40 40 LYS H H 40 8.350 7.655 0.695 1
1 435 . 10 1 1 A 40 40 LYS HA H 40 4.400 4.604 -0.204 1
1 444 . 10 1 1 A 40 40 LYS C C 40 175.560 175.774 -0.214 1
1 445 . 10 1 1 A 40 40 LYS CA C 40 55.660 54.638 1.022 1
1 446 . 10 1 1 A 40 40 LYS CB C 40 32.870 33.771 -0.901 1
1 450 . 10 1 1 A 40 40 LYS N N 40 122.060 119.990 2.070 1
1 451 . 10 1 1 A 41 41 THR H H 41 8.410 8.541 -0.131 1
1 452 . 10 1 1 A 41 41 THR HA H 41 5.330 4.978 0.352 1
1 457 . 10 1 1 A 41 41 THR C C 41 174.860 174.463 0.397 1
1 458 . 10 1 1 A 41 41 THR CA C 41 62.040 61.683 0.357 1
1 459 . 10 1 1 A 41 41 THR CB C 41 69.420 70.865 -1.445 1
1 461 . 10 1 1 A 41 41 THR N N 41 118.150 117.344 0.806 1
1 462 . 10 1 1 A 42 42 VAL H H 42 9.140 9.075 0.065 1
1 463 . 10 1 1 A 42 42 VAL HA H 42 4.570 5.038 -0.468 1
1 471 . 10 1 1 A 42 42 VAL C C 42 172.970 174.287 -1.317 1
1 472 . 10 1 1 A 42 42 VAL CA C 42 59.450 59.131 0.319 1
1 473 . 10 1 1 A 42 42 VAL CB C 42 35.880 35.510 0.370 1
1 476 . 10 1 1 A 42 42 VAL N N 42 122.510 120.243 2.267 1
1 477 . 10 1 1 A 43 43 ARG H H 43 8.420 8.701 -0.281 1
1 478 . 10 1 1 A 43 43 ARG HA H 43 4.750 4.850 -0.100 1
1 485 . 10 1 1 A 43 43 ARG C C 43 175.650 175.805 -0.155 1
1 486 . 10 1 1 A 43 43 ARG CA C 43 53.650 53.839 -0.189 1
1 487 . 10 1 1 A 43 43 ARG CB C 43 33.870 34.082 -0.212 1
1 490 . 10 1 1 A 43 43 ARG N N 43 120.640 122.877 -2.237 1
1 491 . 10 1 1 A 44 44 THR H H 44 8.370 8.558 -0.188 1
1 492 . 10 1 1 A 44 44 THR HA H 44 3.410 3.759 -0.349 1
1 497 . 10 1 1 A 44 44 THR C C 44 175.020 175.806 -0.786 1
1 498 . 10 1 1 A 44 44 THR CA C 44 65.660 65.042 0.618 1
1 499 . 10 1 1 A 44 44 THR CB C 44 69.400 68.323 1.077 1
1 501 . 10 1 1 A 44 44 THR N N 44 118.590 117.534 1.056 1
1 502 . 10 1 1 A 45 45 GLY H H 45 9.090 8.780 0.310 1
1 503 . 10 1 1 A 45 45 GLY HA2 H 45 3.470 4.013 -0.543 1
1 504 . 10 1 1 A 45 45 GLY HA3 H 45 4.470 4.016 0.454 1
1 505 . 10 1 1 A 45 45 GLY C C 45 174.350 173.840 0.510 1
1 506 . 10 1 1 A 45 45 GLY CA C 45 45.000 44.938 0.062 1
1 507 . 10 1 1 A 45 45 GLY N N 45 117.350 115.005 2.345 1
1 508 . 10 1 1 A 46 46 ASP H H 46 8.010 7.874 0.136 1
1 509 . 10 1 1 A 46 46 ASP HA H 46 4.470 4.623 -0.153 1
1 512 . 10 1 1 A 46 46 ASP C C 46 174.570 174.419 0.151 1
1 513 . 10 1 1 A 46 46 ASP CA C 46 55.570 55.440 0.130 1
1 514 . 10 1 1 A 46 46 ASP CB C 46 41.680 41.555 0.125 1
1 515 . 10 1 1 A 46 46 ASP N N 46 122.240 122.242 -0.002 1
1 516 . 10 1 1 A 47 47 VAL H H 47 8.330 8.382 -0.052 1
1 517 . 10 1 1 A 47 47 VAL HA H 47 4.950 4.899 0.051 1
1 525 . 10 1 1 A 47 47 VAL C C 47 176.330 175.609 0.721 1
1 526 . 10 1 1 A 47 47 VAL CA C 47 61.710 61.046 0.664 1
1 527 . 10 1 1 A 47 47 VAL CB C 47 32.900 35.133 -2.233 1
1 530 . 10 1 1 A 47 47 VAL N N 47 119.860 121.887 -2.027 1
1 531 . 10 1 1 A 48 48 ILE H H 48 9.160 8.712 0.448 1
1 532 . 10 1 1 A 48 48 ILE HA H 48 4.630 5.189 -0.559 1
1 542 . 10 1 1 A 48 48 ILE C C 48 174.400 174.395 0.005 1
1 543 . 10 1 1 A 48 48 ILE CA C 48 58.990 59.308 -0.318 1
1 544 . 10 1 1 A 48 48 ILE CB C 48 41.810 42.150 -0.340 1
1 548 . 10 1 1 A 48 48 ILE N N 48 124.990 121.538 3.452 1
1 549 . 10 1 1 A 49 49 GLY H H 49 8.660 8.907 -0.247 1
1 550 . 10 1 1 A 49 49 GLY HA2 H 49 4.950 4.309 0.641 1
1 551 . 10 1 1 A 49 49 GLY HA3 H 49 3.620 4.352 -0.732 1
1 552 . 10 1 1 A 49 49 GLY C C 49 172.920 171.902 1.018 1
1 553 . 10 1 1 A 49 49 GLY CA C 49 44.580 44.373 0.207 1
1 554 . 10 1 1 A 49 49 GLY N N 49 112.060 109.287 2.773 1
1 555 . 10 1 1 A 50 50 ILE H H 50 8.810 9.078 -0.268 1
1 556 . 10 1 1 A 50 50 ILE HA H 50 4.370 4.827 -0.457 1
1 566 . 10 1 1 A 50 50 ILE C C 50 174.500 174.641 -0.141 1
1 567 . 10 1 1 A 50 50 ILE CA C 50 59.550 59.870 -0.320 1
1 568 . 10 1 1 A 50 50 ILE CB C 50 41.300 41.376 -0.076 1
1 572 . 10 1 1 A 50 50 ILE N N 50 123.220 124.955 -1.735 1
1 573 . 10 1 1 A 51 51 SER H H 51 8.540 8.837 -0.297 1
1 574 . 10 1 1 A 51 51 SER HA H 51 4.830 5.019 -0.189 1
1 577 . 10 1 1 A 51 51 SER C C 51 174.130 173.851 0.279 1
1 578 . 10 1 1 A 51 51 SER CA C 51 57.770 57.075 0.695 1
1 579 . 10 1 1 A 51 51 SER CB C 51 63.040 64.138 -1.098 1
1 580 . 10 1 1 A 51 51 SER N N 51 121.430 122.502 -1.072 1
1 581 . 10 1 1 A 52 52 ILE H H 52 8.930 8.714 0.216 1
1 582 . 10 1 1 A 52 52 ILE HA H 52 4.290 4.581 -0.291 1
1 592 . 10 1 1 A 52 52 ILE C C 52 175.280 176.060 -0.780 1
1 593 . 10 1 1 A 52 52 ILE CA C 52 60.250 60.278 -0.028 1
1 594 . 10 1 1 A 52 52 ILE CB C 52 39.840 40.459 -0.619 1
1 598 . 10 1 1 A 52 52 ILE N N 52 127.060 127.819 -0.759 1
1 599 . 10 1 1 A 53 53 LEU H H 53 9.380 9.451 -0.071 1
1 600 . 10 1 1 A 53 53 LEU HA H 53 3.890 4.079 -0.189 1
1 610 . 10 1 1 A 53 53 LEU C C 53 177.130 176.987 0.143 1
1 611 . 10 1 1 A 53 53 LEU CA C 53 55.560 56.192 -0.632 1
1 612 . 10 1 1 A 53 53 LEU CB C 53 39.370 40.666 -1.296 1
1 616 . 10 1 1 A 53 53 LEU N N 53 126.770 129.907 -3.137 1
1 617 . 10 1 1 A 54 54 GLY H H 54 8.310 8.706 -0.396 1
1 618 . 10 1 1 A 54 54 GLY HA2 H 54 3.490 3.905 -0.415 1
1 619 . 10 1 1 A 54 54 GLY HA3 H 54 4.080 3.906 0.174 1
1 620 . 10 1 1 A 54 54 GLY C C 54 173.690 173.980 -0.290 1
1 621 . 10 1 1 A 54 54 GLY CA C 54 45.340 45.784 -0.444 1
1 622 . 10 1 1 A 54 54 GLY N N 54 103.820 104.379 -0.559 1
1 623 . 10 1 1 A 55 55 LYS H H 55 7.730 7.804 -0.074 1
1 624 . 10 1 1 A 55 55 LYS HA H 55 4.560 4.827 -0.267 1
1 633 . 10 1 1 A 55 55 LYS C C 55 174.550 175.062 -0.512 1
1 634 . 10 1 1 A 55 55 LYS CA C 55 54.140 54.963 -0.823 1
1 635 . 10 1 1 A 55 55 LYS CB C 55 34.620 35.562 -0.942 1
1 639 . 10 1 1 A 55 55 LYS N N 55 121.160 120.404 0.756 1
1 640 . 10 1 1 A 56 56 GLU H H 56 8.490 8.812 -0.322 1
1 641 . 10 1 1 A 56 56 GLU HA H 56 4.280 4.700 -0.420 1
1 646 . 10 1 1 A 56 56 GLU C C 56 175.730 175.210 0.520 1
1 647 . 10 1 1 A 56 56 GLU CA C 56 56.730 56.329 0.401 1
1 648 . 10 1 1 A 56 56 GLU CB C 56 30.070 30.681 -0.611 1
1 650 . 10 1 1 A 56 56 GLU N N 56 124.090 128.406 -4.316 1
1 651 . 10 1 1 A 57 57 VAL H H 57 8.920 8.444 0.476 1
1 652 . 10 1 1 A 57 57 VAL HA H 57 4.030 4.821 -0.791 1
1 660 . 10 1 1 A 57 57 VAL C C 57 174.610 173.819 0.791 1
1 661 . 10 1 1 A 57 57 VAL CA C 57 61.680 59.668 2.012 1
1 662 . 10 1 1 A 57 57 VAL CB C 57 33.880 34.543 -0.663 1
1 665 . 10 1 1 A 57 57 VAL N N 57 129.960 126.621 3.339 1
1 666 . 10 1 1 A 58 58 LYS H H 58 7.860 8.687 -0.827 1
1 667 . 10 1 1 A 58 58 LYS HA H 58 5.120 4.822 0.298 1
1 676 . 10 1 1 A 58 58 LYS C C 58 175.380 175.799 -0.419 1
1 677 . 10 1 1 A 58 58 LYS CA C 58 55.200 54.903 0.297 1
1 678 . 10 1 1 A 58 58 LYS CB C 58 34.670 34.577 0.093 1
1 682 . 10 1 1 A 58 58 LYS N N 58 124.790 127.375 -2.585 1
1 683 . 10 1 1 A 59 59 PHE H H 59 9.270 9.144 0.126 1
1 684 . 10 1 1 A 59 59 PHE HA H 59 4.960 5.110 -0.150 1
1 692 . 10 1 1 A 59 59 PHE C C 59 173.950 174.229 -0.279 1
1 693 . 10 1 1 A 59 59 PHE CA C 59 55.910 56.347 -0.437 1
1 694 . 10 1 1 A 59 59 PHE CB C 59 42.950 42.384 0.566 1
1 700 . 10 1 1 A 59 59 PHE N N 59 118.270 122.090 -3.820 1
1 701 . 10 1 1 A 60 60 LYS H H 60 9.170 8.912 0.258 1
1 702 . 10 1 1 A 60 60 LYS HA H 60 4.910 4.982 -0.072 1
1 711 . 10 1 1 A 60 60 LYS C C 60 176.230 175.882 0.348 1
1 712 . 10 1 1 A 60 60 LYS CA C 60 53.910 54.609 -0.699 1
1 713 . 10 1 1 A 60 60 LYS CB C 60 35.170 34.954 0.216 1
1 717 . 10 1 1 A 60 60 LYS N N 60 121.960 124.108 -2.148 1
1 718 . 10 1 1 A 61 61 VAL H H 61 9.400 8.820 0.580 1
1 719 . 10 1 1 A 61 61 VAL HA H 61 4.170 4.076 0.094 1
1 727 . 10 1 1 A 61 61 VAL C C 61 175.500 175.362 0.138 1
1 728 . 10 1 1 A 61 61 VAL CA C 61 61.980 63.194 -1.214 1
1 729 . 10 1 1 A 61 61 VAL CB C 61 29.490 31.170 -1.680 1
1 732 . 10 1 1 A 61 61 VAL N N 61 127.140 126.972 0.168 1
1 733 . 10 1 1 A 62 62 VAL H H 62 8.390 8.669 -0.279 1
1 734 . 10 1 1 A 62 62 VAL HA H 62 3.650 3.968 -0.318 1
1 742 . 10 1 1 A 62 62 VAL C C 62 176.440 176.019 0.421 1
1 743 . 10 1 1 A 62 62 VAL CA C 62 64.930 64.426 0.504 1
1 744 . 10 1 1 A 62 62 VAL CB C 62 32.130 32.423 -0.293 1
1 747 . 10 1 1 A 62 62 VAL N N 62 132.840 129.238 3.602 1
1 748 . 10 1 1 A 63 63 GLN H H 63 7.470 7.126 0.344 1
1 749 . 10 1 1 A 63 63 GLN HA H 63 4.270 4.484 -0.214 1
1 756 . 10 1 1 A 63 63 GLN C C 63 172.290 173.372 -1.082 1
1 757 . 10 1 1 A 63 63 GLN CA C 63 56.640 55.485 1.155 1
1 758 . 10 1 1 A 63 63 GLN CB C 63 32.630 32.186 0.444 1
1 760 . 10 1 1 A 63 63 GLN N N 63 114.500 116.827 -2.327 1
1 762 . 10 1 1 A 64 64 ALA H H 64 8.200 8.577 -0.377 1
1 763 . 10 1 1 A 64 64 ALA HA H 64 4.830 5.336 -0.506 1
1 767 . 10 1 1 A 64 64 ALA C C 64 174.270 175.684 -1.414 1
1 768 . 10 1 1 A 64 64 ALA CA C 64 50.800 49.965 0.835 1
1 769 . 10 1 1 A 64 64 ALA CB C 64 20.100 21.679 -1.579 1
1 770 . 10 1 1 A 64 64 ALA N N 64 131.410 128.402 3.008 1
1 771 . 10 1 1 A 65 65 TYR H H 65 8.860 8.539 0.321 1
1 772 . 10 1 1 A 65 65 TYR HA H 65 4.540 4.945 -0.405 1
1 779 . 10 1 1 A 65 65 TYR CA C 65 54.270 55.167 -0.897 1
1 780 . 10 1 1 A 65 65 TYR CB C 65 41.360 40.916 0.444 1
1 785 . 10 1 1 A 65 65 TYR N N 65 124.140 119.957 4.183 1
1 786 . 10 1 1 A 66 66 PRO HA H 66 4.120 4.753 -0.633 1
1 793 . 10 1 1 A 66 66 PRO CA C 66 63.450 62.364 1.086 1
1 794 . 10 1 1 A 66 66 PRO CB C 66 34.170 32.762 1.408 1
1 797 . 10 1 1 A 67 67 SER H H 67 7.380 8.241 -0.861 1
1 798 . 10 1 1 A 67 67 SER HA H 67 4.720 4.980 -0.260 1
1 801 . 10 1 1 A 67 67 SER CA C 67 54.250 56.057 -1.807 1
1 802 . 10 1 1 A 67 67 SER CB C 67 64.530 63.756 0.774 1
1 803 . 10 1 1 A 67 67 SER N N 67 106.200 116.679 -10.479 1
1 804 . 10 1 1 A 68 68 PRO HA H 68 4.880 4.665 0.215 1
1 811 . 10 1 1 A 68 68 PRO CA C 68 62.990 62.498 0.492 1
1 812 . 10 1 1 A 68 68 PRO CB C 68 35.220 33.239 1.981 1
1 815 . 10 1 1 A 69 69 LEU H H 69 8.960 7.907 1.053 1
1 816 . 10 1 1 A 69 69 LEU HA H 69 4.430 5.075 -0.645 1
1 826 . 10 1 1 A 69 69 LEU C C 69 174.570 175.299 -0.729 1
1 827 . 10 1 1 A 69 69 LEU CA C 69 53.900 52.666 1.234 1
1 828 . 10 1 1 A 69 69 LEU CB C 69 44.210 45.910 -1.700 1
1 832 . 10 1 1 A 69 69 LEU N N 69 120.480 117.211 3.269 1
1 833 . 10 1 1 A 70 70 ARG H H 70 8.130 8.380 -0.250 1
1 834 . 10 1 1 A 70 70 ARG HA H 70 4.930 4.765 0.165 1
1 841 . 10 1 1 A 70 70 ARG C C 70 175.460 176.141 -0.681 1
1 842 . 10 1 1 A 70 70 ARG CA C 70 54.040 55.456 -1.416 1
1 843 . 10 1 1 A 70 70 ARG CB C 70 30.550 31.917 -1.367 1
1 846 . 10 1 1 A 70 70 ARG N N 70 125.180 119.653 5.527 1
1 847 . 10 1 1 A 71 71 VAL H H 71 8.450 8.267 0.183 1
1 848 . 10 1 1 A 71 71 VAL HA H 71 3.410 4.426 -1.016 1
1 856 . 10 1 1 A 71 71 VAL C C 71 175.460 175.495 -0.035 1
1 857 . 10 1 1 A 71 71 VAL CA C 71 65.210 62.325 2.885 1
1 858 . 10 1 1 A 71 71 VAL CB C 71 29.840 31.647 -1.807 1
1 861 . 10 1 1 A 71 71 VAL N N 71 128.170 122.530 5.640 1
1 862 . 10 1 1 A 72 72 GLU H H 72 8.620 8.408 0.212 1
1 863 . 10 1 1 A 72 72 GLU HA H 72 4.870 4.822 0.048 1
1 868 . 10 1 1 A 72 72 GLU C C 72 176.960 176.237 0.723 1
1 869 . 10 1 1 A 72 72 GLU CA C 72 54.330 54.436 -0.106 1
1 870 . 10 1 1 A 72 72 GLU CB C 72 33.280 33.189 0.091 1
1 872 . 10 1 1 A 72 72 GLU N N 72 127.670 126.799 0.871 1
1 873 . 10 1 1 A 73 73 ASP H H 73 8.700 8.838 -0.138 1
1 874 . 10 1 1 A 73 73 ASP HA H 73 4.150 4.281 -0.131 1
1 877 . 10 1 1 A 73 73 ASP C C 73 177.460 177.801 -0.341 1
1 878 . 10 1 1 A 73 73 ASP CA C 73 57.620 57.275 0.345 1
1 879 . 10 1 1 A 73 73 ASP CB C 73 40.360 40.423 -0.063 1
1 880 . 10 1 1 A 73 73 ASP N N 73 121.140 126.968 -5.828 1
1 881 . 10 1 1 A 74 74 ARG H H 74 7.760 7.733 0.027 1
1 882 . 10 1 1 A 74 74 ARG HA H 74 4.280 4.333 -0.053 1
1 889 . 10 1 1 A 74 74 ARG C C 74 176.510 176.696 -0.186 1
1 890 . 10 1 1 A 74 74 ARG CA C 74 55.450 56.922 -1.472 1
1 891 . 10 1 1 A 74 74 ARG CB C 74 29.990 30.811 -0.821 1
1 894 . 10 1 1 A 74 74 ARG N N 74 112.890 116.391 -3.501 1
1 895 . 10 1 1 A 75 75 THR H H 75 7.700 7.407 0.293 1
1 896 . 10 1 1 A 75 75 THR HA H 75 4.020 4.252 -0.232 1
1 901 . 10 1 1 A 75 75 THR C C 75 173.810 173.865 -0.055 1
1 902 . 10 1 1 A 75 75 THR CA C 75 64.060 64.061 -0.001 1
1 903 . 10 1 1 A 75 75 THR CB C 75 69.350 69.384 -0.034 1
1 905 . 10 1 1 A 75 75 THR N N 75 120.650 116.434 4.216 1
1 906 . 10 1 1 A 76 76 LYS H H 76 8.520 8.128 0.392 1
1 907 . 10 1 1 A 76 76 LYS HA H 76 4.270 4.678 -0.408 1
1 916 . 10 1 1 A 76 76 LYS C C 76 174.560 175.756 -1.196 1
1 917 . 10 1 1 A 76 76 LYS CA C 76 56.280 55.930 0.350 1
1 918 . 10 1 1 A 76 76 LYS CB C 76 33.120 33.852 -0.732 1
1 922 . 10 1 1 A 76 76 LYS N N 76 130.950 127.374 3.576 1
1 923 . 10 1 1 A 77 77 ILE H H 77 8.430 8.661 -0.231 1
1 924 . 10 1 1 A 77 77 ILE HA H 77 4.850 5.190 -0.340 1
1 934 . 10 1 1 A 77 77 ILE C C 77 174.650 175.181 -0.531 1
1 935 . 10 1 1 A 77 77 ILE CA C 77 59.820 59.948 -0.128 1
1 936 . 10 1 1 A 77 77 ILE CB C 77 38.280 40.915 -2.635 1
1 940 . 10 1 1 A 77 77 ILE N N 77 128.020 123.200 4.820 1
1 941 . 10 1 1 A 78 78 THR H H 78 8.870 8.765 0.105 1
1 942 . 10 1 1 A 78 78 THR HA H 78 4.470 5.125 -0.655 1
1 947 . 10 1 1 A 78 78 THR C C 78 172.760 173.410 -0.650 1
1 948 . 10 1 1 A 78 78 THR CA C 78 60.740 61.345 -0.605 1
1 949 . 10 1 1 A 78 78 THR CB C 78 71.320 71.539 -0.219 1
1 951 . 10 1 1 A 78 78 THR N N 78 123.870 123.649 0.221 1
1 952 . 10 1 1 A 79 79 LEU H H 79 8.820 8.959 -0.139 1
1 953 . 10 1 1 A 79 79 LEU HA H 79 5.140 5.093 0.047 1
1 963 . 10 1 1 A 79 79 LEU C C 79 176.610 175.787 0.823 1
1 964 . 10 1 1 A 79 79 LEU CA C 79 53.280 53.368 -0.088 1
1 965 . 10 1 1 A 79 79 LEU CB C 79 42.600 42.704 -0.104 1
1 969 . 10 1 1 A 79 79 LEU N N 79 127.070 126.668 0.402 1
1 970 . 10 1 1 A 80 80 VAL H H 80 8.800 8.770 0.030 1
1 971 . 10 1 1 A 80 80 VAL HA H 80 4.260 4.846 -0.586 1
1 979 . 10 1 1 A 80 80 VAL CA C 80 61.350 61.390 -0.040 1
1 980 . 10 1 1 A 80 80 VAL CB C 80 32.790 33.309 -0.519 1
1 983 . 10 1 1 A 80 80 VAL N N 80 124.120 125.714 -1.594 1
1 984 . 10 1 1 A 81 81 THR H H 81 8.160 8.749 -0.589 1
1 985 . 10 1 1 A 81 81 THR HA H 81 4.410 5.199 -0.789 1
1 990 . 10 1 1 A 81 81 THR CA C 81 60.800 60.436 0.364 1
1 991 . 10 1 1 A 81 81 THR CB C 81 69.650 72.288 -2.638 1
1 993 . 10 1 1 A 81 81 THR N N 81 114.500 117.060 -2.560 1
1 1 . 11 1 1 A 9 9 GLY H H 9 8.390 8.783 -0.393 1
1 2 . 11 1 1 A 9 9 GLY HA2 H 9 3.900 3.976 -0.076 1
1 3 . 11 1 1 A 9 9 GLY HA3 H 9 3.860 3.977 -0.117 1
1 4 . 11 1 1 A 9 9 GLY CA C 9 45.150 45.064 0.086 1
1 5 . 11 1 1 A 9 9 GLY N N 9 110.000 111.461 -1.461 1
1 6 . 11 1 1 A 10 10 VAL H H 10 7.870 7.614 0.256 1
1 7 . 11 1 1 A 10 10 VAL HA H 10 4.040 4.093 -0.053 1
1 15 . 11 1 1 A 10 10 VAL C C 10 175.880 175.452 0.428 1
1 16 . 11 1 1 A 10 10 VAL CA C 10 62.110 62.567 -0.457 1
1 17 . 11 1 1 A 10 10 VAL CB C 10 32.760 32.119 0.641 1
1 20 . 11 1 1 A 10 10 VAL N N 10 119.730 120.151 -0.421 1
1 21 . 11 1 1 A 11 11 ILE H H 11 8.230 9.126 -0.896 1
1 22 . 11 1 1 A 11 11 ILE HA H 11 4.090 4.587 -0.497 1
1 32 . 11 1 1 A 11 11 ILE C C 11 175.850 174.763 1.087 1
1 33 . 11 1 1 A 11 11 ILE CA C 11 60.800 59.758 1.042 1
1 34 . 11 1 1 A 11 11 ILE CB C 11 38.470 40.969 -2.499 1
1 38 . 11 1 1 A 11 11 ILE N N 11 125.570 128.443 -2.873 1
1 39 . 11 1 1 A 12 12 MET H H 12 8.370 8.969 -0.599 1
1 40 . 11 1 1 A 12 12 MET HA H 12 4.540 4.934 -0.394 1
1 48 . 11 1 1 A 12 12 MET C C 12 174.830 175.990 -1.160 1
1 49 . 11 1 1 A 12 12 MET CA C 12 54.790 54.233 0.557 1
1 50 . 11 1 1 A 12 12 MET CB C 12 32.640 33.577 -0.937 1
1 53 . 11 1 1 A 12 12 MET N N 12 125.930 126.537 -0.607 1
1 54 . 11 1 1 A 13 13 SER H H 13 7.990 8.840 -0.850 1
1 55 . 11 1 1 A 13 13 SER HA H 13 5.030 5.454 -0.424 1
1 58 . 11 1 1 A 13 13 SER C C 13 174.330 173.235 1.095 1
1 59 . 11 1 1 A 13 13 SER CA C 13 57.320 56.154 1.166 1
1 60 . 11 1 1 A 13 13 SER CB C 13 64.790 66.611 -1.821 1
1 61 . 11 1 1 A 13 13 SER N N 13 116.400 117.479 -1.079 1
1 62 . 11 1 1 A 14 14 GLU H H 14 9.430 8.795 0.635 1
1 63 . 11 1 1 A 14 14 GLU HA H 14 5.250 5.114 0.136 1
1 68 . 11 1 1 A 14 14 GLU C C 14 172.980 173.916 -0.936 1
1 69 . 11 1 1 A 14 14 GLU CA C 14 55.390 55.306 0.084 1
1 70 . 11 1 1 A 14 14 GLU CB C 14 33.910 34.201 -0.291 1
1 72 . 11 1 1 A 14 14 GLU N N 14 123.670 121.696 1.974 1
1 73 . 11 1 1 A 15 15 LEU H H 15 8.930 8.967 -0.037 1
1 74 . 11 1 1 A 15 15 LEU HA H 15 4.870 5.203 -0.333 1
1 84 . 11 1 1 A 15 15 LEU C C 15 174.000 174.460 -0.460 1
1 85 . 11 1 1 A 15 15 LEU CA C 15 53.020 53.518 -0.498 1
1 86 . 11 1 1 A 15 15 LEU CB C 15 46.040 45.655 0.385 1
1 90 . 11 1 1 A 15 15 LEU N N 15 125.350 126.809 -1.459 1
1 91 . 11 1 1 A 16 16 LYS H H 16 8.840 8.812 0.028 1
1 92 . 11 1 1 A 16 16 LYS HA H 16 5.360 4.886 0.474 1
1 101 . 11 1 1 A 16 16 LYS C C 16 175.660 175.452 0.208 1
1 102 . 11 1 1 A 16 16 LYS CA C 16 54.940 55.665 -0.725 1
1 103 . 11 1 1 A 16 16 LYS CB C 16 34.280 33.397 0.883 1
1 107 . 11 1 1 A 16 16 LYS N N 16 124.640 126.771 -2.131 1
1 108 . 11 1 1 A 17 17 LEU H H 17 8.820 9.039 -0.219 1
1 109 . 11 1 1 A 17 17 LEU HA H 17 5.430 5.222 0.208 1
1 119 . 11 1 1 A 17 17 LEU C C 17 174.630 175.689 -1.059 1
1 120 . 11 1 1 A 17 17 LEU CA C 17 52.900 53.492 -0.592 1
1 121 . 11 1 1 A 17 17 LEU CB C 17 46.910 45.446 1.464 1
1 125 . 11 1 1 A 17 17 LEU N N 17 123.460 126.847 -3.387 1
1 126 . 11 1 1 A 18 18 LYS H H 18 9.110 8.662 0.448 1
1 127 . 11 1 1 A 18 18 LYS HA H 18 5.490 5.049 0.441 1
1 136 . 11 1 1 A 18 18 LYS CA C 18 52.270 52.959 -0.689 1
1 137 . 11 1 1 A 18 18 LYS CB C 18 37.500 36.462 1.038 1
1 141 . 11 1 1 A 18 18 LYS N N 18 122.230 123.482 -1.252 1
1 142 . 11 1 1 A 19 19 PRO HA H 19 4.100 4.446 -0.346 1
1 149 . 11 1 1 A 19 19 PRO CA C 19 62.440 62.551 -0.111 1
1 150 . 11 1 1 A 19 19 PRO CB C 19 30.640 32.281 -1.641 1
1 153 . 11 1 1 A 20 20 LEU H H 20 8.490 8.372 0.118 1
1 154 . 11 1 1 A 20 20 LEU HA H 20 4.320 4.152 0.168 1
1 164 . 11 1 1 A 20 20 LEU CA C 20 57.680 58.706 -1.026 1
1 165 . 11 1 1 A 20 20 LEU CB C 20 38.760 40.648 -1.888 1
1 169 . 11 1 1 A 20 20 LEU N N 20 123.250 119.582 3.668 1
1 170 . 11 1 1 A 21 21 PRO HA H 21 4.530 4.532 -0.002 1
1 177 . 11 1 1 A 21 21 PRO CA C 21 62.880 62.549 0.331 1
1 178 . 11 1 1 A 21 21 PRO CB C 21 31.420 32.282 -0.862 1
1 181 . 11 1 1 A 22 22 LYS H H 22 8.180 8.365 -0.185 1
1 182 . 11 1 1 A 22 22 LYS HA H 22 4.110 4.414 -0.304 1
1 191 . 11 1 1 A 22 22 LYS C C 22 175.680 175.424 0.256 1
1 192 . 11 1 1 A 22 22 LYS CA C 22 56.210 55.716 0.494 1
1 193 . 11 1 1 A 22 22 LYS CB C 22 30.660 31.530 -0.870 1
1 197 . 11 1 1 A 22 22 LYS N N 22 119.160 121.982 -2.822 1
1 198 . 11 1 1 A 23 23 VAL H H 23 7.530 7.871 -0.341 1
1 199 . 11 1 1 A 23 23 VAL HA H 23 4.280 4.726 -0.446 1
1 207 . 11 1 1 A 23 23 VAL C C 23 173.690 172.610 1.080 1
1 208 . 11 1 1 A 23 23 VAL CA C 23 59.830 59.574 0.256 1
1 209 . 11 1 1 A 23 23 VAL CB C 23 34.550 35.561 -1.011 1
1 212 . 11 1 1 A 23 23 VAL N N 23 121.820 122.928 -1.108 1
1 213 . 11 1 1 A 24 24 GLU H H 24 8.270 8.925 -0.655 1
1 214 . 11 1 1 A 24 24 GLU HA H 24 4.330 4.949 -0.619 1
1 219 . 11 1 1 A 24 24 GLU C C 24 175.390 174.958 0.432 1
1 220 . 11 1 1 A 24 24 GLU CA C 24 55.220 54.824 0.396 1
1 221 . 11 1 1 A 24 24 GLU CB C 24 29.970 32.591 -2.621 1
1 223 . 11 1 1 A 24 24 GLU N N 24 125.610 127.989 -2.379 1
1 224 . 11 1 1 A 25 25 LEU H H 25 8.480 8.715 -0.235 1
1 225 . 11 1 1 A 25 25 LEU HA H 25 4.520 4.428 0.092 1
1 235 . 11 1 1 A 25 25 LEU CA C 25 51.660 51.072 0.588 1
1 236 . 11 1 1 A 25 25 LEU CB C 25 41.750 41.451 0.299 1
1 240 . 11 1 1 A 25 25 LEU N N 25 125.880 128.191 -2.311 1
1 241 . 11 1 1 A 26 26 PRO HA H 26 4.760 4.658 0.102 1
1 248 . 11 1 1 A 26 26 PRO CA C 26 61.330 61.928 -0.598 1
1 249 . 11 1 1 A 26 26 PRO CB C 26 31.060 32.842 -1.782 1
1 252 . 11 1 1 A 27 27 PRO HA H 27 4.390 4.403 -0.013 1
1 259 . 11 1 1 A 27 27 PRO CA C 27 64.550 64.875 -0.325 1
1 260 . 11 1 1 A 27 27 PRO CB C 27 31.770 31.736 0.034 1
1 263 . 11 1 1 A 28 28 ASP H H 28 8.560 8.823 -0.263 1
1 264 . 11 1 1 A 28 28 ASP HA H 28 4.620 4.400 0.220 1
1 267 . 11 1 1 A 28 28 ASP C C 28 177.100 178.815 -1.715 1
1 268 . 11 1 1 A 28 28 ASP CA C 28 53.890 56.529 -2.639 1
1 269 . 11 1 1 A 28 28 ASP CB C 28 39.120 39.614 -0.494 1
1 270 . 11 1 1 A 28 28 ASP N N 28 115.820 117.830 -2.010 1
1 271 . 11 1 1 A 29 29 PHE H H 29 7.940 8.031 -0.091 1
1 272 . 11 1 1 A 29 29 PHE HA H 29 4.180 4.339 -0.159 1
1 280 . 11 1 1 A 29 29 PHE C C 29 176.740 178.238 -1.498 1
1 281 . 11 1 1 A 29 29 PHE CA C 29 61.020 61.014 0.006 1
1 282 . 11 1 1 A 29 29 PHE CB C 29 39.230 38.780 0.450 1
1 288 . 11 1 1 A 29 29 PHE N N 29 119.610 118.206 1.404 1
1 289 . 11 1 1 A 30 30 VAL H H 30 8.010 8.397 -0.387 1
1 290 . 11 1 1 A 30 30 VAL HA H 30 3.350 3.768 -0.418 1
1 298 . 11 1 1 A 30 30 VAL C C 30 176.400 177.107 -0.707 1
1 299 . 11 1 1 A 30 30 VAL CA C 30 66.510 64.818 1.692 1
1 300 . 11 1 1 A 30 30 VAL CB C 30 31.020 31.074 -0.054 1
1 303 . 11 1 1 A 30 30 VAL N N 30 116.370 119.461 -3.091 1
1 304 . 11 1 1 A 31 31 ASP H H 31 7.420 7.970 -0.550 1
1 305 . 11 1 1 A 31 31 ASP HA H 31 4.310 4.359 -0.049 1
1 308 . 11 1 1 A 31 31 ASP C C 31 178.360 178.896 -0.536 1
1 309 . 11 1 1 A 31 31 ASP CA C 31 57.110 57.105 0.005 1
1 310 . 11 1 1 A 31 31 ASP CB C 31 40.450 40.897 -0.447 1
1 311 . 11 1 1 A 31 31 ASP N N 31 119.190 121.569 -2.379 1
1 312 . 11 1 1 A 32 32 VAL H H 32 7.190 7.528 -0.338 1
1 313 . 11 1 1 A 32 32 VAL HA H 32 3.510 3.550 -0.040 1
1 321 . 11 1 1 A 32 32 VAL C C 32 178.100 178.555 -0.455 1
1 322 . 11 1 1 A 32 32 VAL CA C 32 65.570 66.379 -0.809 1
1 323 . 11 1 1 A 32 32 VAL CB C 32 31.410 31.317 0.093 1
1 326 . 11 1 1 A 32 32 VAL N N 32 119.830 120.245 -0.415 1
1 327 . 11 1 1 A 33 33 ILE H H 33 7.660 8.445 -0.785 1
1 328 . 11 1 1 A 33 33 ILE HA H 33 3.170 3.536 -0.366 1
1 338 . 11 1 1 A 33 33 ILE C C 33 176.660 178.151 -1.491 1
1 339 . 11 1 1 A 33 33 ILE CA C 33 65.220 65.200 0.020 1
1 340 . 11 1 1 A 33 33 ILE CB C 33 37.500 37.671 -0.171 1
1 344 . 11 1 1 A 33 33 ILE N N 33 118.490 120.850 -2.360 1
1 345 . 11 1 1 A 34 34 ARG H H 34 7.830 7.732 0.098 1
1 346 . 11 1 1 A 34 34 ARG HA H 34 3.380 3.898 -0.518 1
1 354 . 11 1 1 A 34 34 ARG C C 34 178.060 177.787 0.273 1
1 355 . 11 1 1 A 34 34 ARG CA C 34 60.570 59.074 1.496 1
1 356 . 11 1 1 A 34 34 ARG CB C 34 30.070 29.821 0.249 1
1 359 . 11 1 1 A 34 34 ARG N N 34 118.260 119.961 -1.701 1
1 361 . 11 1 1 A 35 35 ILE H H 35 7.350 7.791 -0.441 1
1 362 . 11 1 1 A 35 35 ILE HA H 35 3.720 3.705 0.015 1
1 372 . 11 1 1 A 35 35 ILE C C 35 179.090 178.045 1.045 1
1 373 . 11 1 1 A 35 35 ILE CA C 35 64.060 65.342 -1.282 1
1 374 . 11 1 1 A 35 35 ILE CB C 35 38.030 37.664 0.366 1
1 378 . 11 1 1 A 35 35 ILE N N 35 116.750 119.369 -2.619 1
1 379 . 11 1 1 A 36 36 LYS H H 36 7.880 7.648 0.232 1
1 380 . 11 1 1 A 36 36 LYS HA H 36 4.090 3.958 0.132 1
1 389 . 11 1 1 A 36 36 LYS C C 36 178.560 178.898 -0.338 1
1 390 . 11 1 1 A 36 36 LYS CA C 36 57.650 59.828 -2.178 1
1 391 . 11 1 1 A 36 36 LYS CB C 36 32.090 32.294 -0.204 1
1 395 . 11 1 1 A 36 36 LYS N N 36 118.700 119.606 -0.906 1
1 396 . 11 1 1 A 37 37 LEU H H 37 7.860 7.434 0.426 1
1 397 . 11 1 1 A 37 37 LEU HA H 37 4.230 4.303 -0.073 1
1 407 . 11 1 1 A 37 37 LEU C C 37 175.880 176.768 -0.888 1
1 408 . 11 1 1 A 37 37 LEU CA C 37 54.090 55.614 -1.524 1
1 409 . 11 1 1 A 37 37 LEU CB C 37 43.310 42.506 0.804 1
1 413 . 11 1 1 A 37 37 LEU N N 37 116.380 117.319 -0.939 1
1 414 . 11 1 1 A 38 38 GLN H H 38 7.190 7.586 -0.396 1
1 415 . 11 1 1 A 38 38 GLN HA H 38 3.530 4.445 -0.915 1
1 422 . 11 1 1 A 38 38 GLN C C 38 177.480 176.260 1.220 1
1 423 . 11 1 1 A 38 38 GLN CA C 38 58.370 56.725 1.645 1
1 424 . 11 1 1 A 38 38 GLN CB C 38 28.300 28.733 -0.433 1
1 426 . 11 1 1 A 38 38 GLN N N 38 119.210 117.652 1.558 1
1 428 . 11 1 1 A 39 39 GLY H H 39 8.940 8.856 0.084 1
1 429 . 11 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 11 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 11 1 1 A 39 39 GLY C C 39 174.070 174.428 -0.358 1
1 432 . 11 1 1 A 39 39 GLY CA C 39 45.280 45.043 0.237 1
1 433 . 11 1 1 A 39 39 GLY N N 39 113.490 112.152 1.338 1
1 434 . 11 1 1 A 40 40 LYS H H 40 8.350 7.596 0.754 1
1 435 . 11 1 1 A 40 40 LYS HA H 40 4.400 4.594 -0.194 1
1 444 . 11 1 1 A 40 40 LYS C C 40 175.560 175.735 -0.175 1
1 445 . 11 1 1 A 40 40 LYS CA C 40 55.660 54.657 1.003 1
1 446 . 11 1 1 A 40 40 LYS CB C 40 32.870 33.744 -0.874 1
1 450 . 11 1 1 A 40 40 LYS N N 40 122.060 119.980 2.080 1
1 451 . 11 1 1 A 41 41 THR H H 41 8.410 8.579 -0.169 1
1 452 . 11 1 1 A 41 41 THR HA H 41 5.330 5.016 0.314 1
1 457 . 11 1 1 A 41 41 THR C C 41 174.860 174.457 0.403 1
1 458 . 11 1 1 A 41 41 THR CA C 41 62.040 61.652 0.388 1
1 459 . 11 1 1 A 41 41 THR CB C 41 69.420 70.876 -1.456 1
1 461 . 11 1 1 A 41 41 THR N N 41 118.150 117.207 0.943 1
1 462 . 11 1 1 A 42 42 VAL H H 42 9.140 9.097 0.043 1
1 463 . 11 1 1 A 42 42 VAL HA H 42 4.570 5.057 -0.487 1
1 471 . 11 1 1 A 42 42 VAL C C 42 172.970 174.307 -1.337 1
1 472 . 11 1 1 A 42 42 VAL CA C 42 59.450 59.126 0.324 1
1 473 . 11 1 1 A 42 42 VAL CB C 42 35.880 35.629 0.251 1
1 476 . 11 1 1 A 42 42 VAL N N 42 122.510 120.106 2.404 1
1 477 . 11 1 1 A 43 43 ARG H H 43 8.420 8.711 -0.291 1
1 478 . 11 1 1 A 43 43 ARG HA H 43 4.750 4.877 -0.127 1
1 485 . 11 1 1 A 43 43 ARG C C 43 175.650 175.802 -0.152 1
1 486 . 11 1 1 A 43 43 ARG CA C 43 53.650 53.840 -0.190 1
1 487 . 11 1 1 A 43 43 ARG CB C 43 33.870 34.114 -0.244 1
1 490 . 11 1 1 A 43 43 ARG N N 43 120.640 122.840 -2.200 1
1 491 . 11 1 1 A 44 44 THR H H 44 8.370 8.557 -0.187 1
1 492 . 11 1 1 A 44 44 THR HA H 44 3.410 3.761 -0.351 1
1 497 . 11 1 1 A 44 44 THR C C 44 175.020 175.807 -0.787 1
1 498 . 11 1 1 A 44 44 THR CA C 44 65.660 65.046 0.614 1
1 499 . 11 1 1 A 44 44 THR CB C 44 69.400 68.321 1.079 1
1 501 . 11 1 1 A 44 44 THR N N 44 118.590 117.433 1.157 1
1 502 . 11 1 1 A 45 45 GLY H H 45 9.090 8.768 0.322 1
1 503 . 11 1 1 A 45 45 GLY HA2 H 45 3.470 4.015 -0.545 1
1 504 . 11 1 1 A 45 45 GLY HA3 H 45 4.470 4.019 0.451 1
1 505 . 11 1 1 A 45 45 GLY C C 45 174.350 173.921 0.429 1
1 506 . 11 1 1 A 45 45 GLY CA C 45 45.000 44.942 0.058 1
1 507 . 11 1 1 A 45 45 GLY N N 45 117.350 115.004 2.346 1
1 508 . 11 1 1 A 46 46 ASP H H 46 8.010 7.887 0.123 1
1 509 . 11 1 1 A 46 46 ASP HA H 46 4.470 4.627 -0.157 1
1 512 . 11 1 1 A 46 46 ASP C C 46 174.570 174.400 0.170 1
1 513 . 11 1 1 A 46 46 ASP CA C 46 55.570 55.416 0.154 1
1 514 . 11 1 1 A 46 46 ASP CB C 46 41.680 41.554 0.126 1
1 515 . 11 1 1 A 46 46 ASP N N 46 122.240 122.219 0.021 1
1 516 . 11 1 1 A 47 47 VAL H H 47 8.330 8.345 -0.015 1
1 517 . 11 1 1 A 47 47 VAL HA H 47 4.950 4.909 0.041 1
1 525 . 11 1 1 A 47 47 VAL C C 47 176.330 175.404 0.926 1
1 526 . 11 1 1 A 47 47 VAL CA C 47 61.710 60.874 0.836 1
1 527 . 11 1 1 A 47 47 VAL CB C 47 32.900 34.421 -1.521 1
1 530 . 11 1 1 A 47 47 VAL N N 47 119.860 121.476 -1.616 1
1 531 . 11 1 1 A 48 48 ILE H H 48 9.160 8.729 0.431 1
1 532 . 11 1 1 A 48 48 ILE HA H 48 4.630 5.198 -0.568 1
1 542 . 11 1 1 A 48 48 ILE C C 48 174.400 174.461 -0.061 1
1 543 . 11 1 1 A 48 48 ILE CA C 48 58.990 59.295 -0.305 1
1 544 . 11 1 1 A 48 48 ILE CB C 48 41.810 42.112 -0.302 1
1 548 . 11 1 1 A 48 48 ILE N N 48 124.990 121.672 3.318 1
1 549 . 11 1 1 A 49 49 GLY H H 49 8.660 8.949 -0.289 1
1 550 . 11 1 1 A 49 49 GLY HA2 H 49 4.950 4.310 0.640 1
1 551 . 11 1 1 A 49 49 GLY HA3 H 49 3.620 4.354 -0.734 1
1 552 . 11 1 1 A 49 49 GLY C C 49 172.920 171.932 0.988 1
1 553 . 11 1 1 A 49 49 GLY CA C 49 44.580 44.367 0.213 1
1 554 . 11 1 1 A 49 49 GLY N N 49 112.060 109.364 2.696 1
1 555 . 11 1 1 A 50 50 ILE H H 50 8.810 9.060 -0.250 1
1 556 . 11 1 1 A 50 50 ILE HA H 50 4.370 4.820 -0.450 1
1 566 . 11 1 1 A 50 50 ILE C C 50 174.500 174.626 -0.126 1
1 567 . 11 1 1 A 50 50 ILE CA C 50 59.550 59.887 -0.337 1
1 568 . 11 1 1 A 50 50 ILE CB C 50 41.300 41.571 -0.271 1
1 572 . 11 1 1 A 50 50 ILE N N 50 123.220 124.889 -1.669 1
1 573 . 11 1 1 A 51 51 SER H H 51 8.540 8.851 -0.311 1
1 574 . 11 1 1 A 51 51 SER HA H 51 4.830 5.018 -0.188 1
1 577 . 11 1 1 A 51 51 SER C C 51 174.130 173.853 0.277 1
1 578 . 11 1 1 A 51 51 SER CA C 51 57.770 57.083 0.687 1
1 579 . 11 1 1 A 51 51 SER CB C 51 63.040 64.143 -1.103 1
1 580 . 11 1 1 A 51 51 SER N N 51 121.430 122.509 -1.079 1
1 581 . 11 1 1 A 52 52 ILE H H 52 8.930 8.735 0.195 1
1 582 . 11 1 1 A 52 52 ILE HA H 52 4.290 4.573 -0.283 1
1 592 . 11 1 1 A 52 52 ILE C C 52 175.280 176.076 -0.796 1
1 593 . 11 1 1 A 52 52 ILE CA C 52 60.250 60.292 -0.042 1
1 594 . 11 1 1 A 52 52 ILE CB C 52 39.840 40.447 -0.607 1
1 598 . 11 1 1 A 52 52 ILE N N 52 127.060 127.794 -0.734 1
1 599 . 11 1 1 A 53 53 LEU H H 53 9.380 9.465 -0.085 1
1 600 . 11 1 1 A 53 53 LEU HA H 53 3.890 4.070 -0.180 1
1 610 . 11 1 1 A 53 53 LEU C C 53 177.130 176.983 0.147 1
1 611 . 11 1 1 A 53 53 LEU CA C 53 55.560 56.184 -0.624 1
1 612 . 11 1 1 A 53 53 LEU CB C 53 39.370 40.656 -1.286 1
1 616 . 11 1 1 A 53 53 LEU N N 53 126.770 129.925 -3.155 1
1 617 . 11 1 1 A 54 54 GLY H H 54 8.310 8.704 -0.394 1
1 618 . 11 1 1 A 54 54 GLY HA2 H 54 3.490 3.897 -0.407 1
1 619 . 11 1 1 A 54 54 GLY HA3 H 54 4.080 3.898 0.182 1
1 620 . 11 1 1 A 54 54 GLY C C 54 173.690 173.756 -0.066 1
1 621 . 11 1 1 A 54 54 GLY CA C 54 45.340 45.723 -0.383 1
1 622 . 11 1 1 A 54 54 GLY N N 54 103.820 104.379 -0.559 1
1 623 . 11 1 1 A 55 55 LYS H H 55 7.730 7.956 -0.226 1
1 624 . 11 1 1 A 55 55 LYS HA H 55 4.560 4.753 -0.193 1
1 633 . 11 1 1 A 55 55 LYS C C 55 174.550 175.012 -0.462 1
1 634 . 11 1 1 A 55 55 LYS CA C 55 54.140 54.522 -0.382 1
1 635 . 11 1 1 A 55 55 LYS CB C 55 34.620 35.120 -0.500 1
1 639 . 11 1 1 A 55 55 LYS N N 55 121.160 119.953 1.207 1
1 640 . 11 1 1 A 56 56 GLU H H 56 8.490 8.818 -0.328 1
1 641 . 11 1 1 A 56 56 GLU HA H 56 4.280 4.704 -0.424 1
1 646 . 11 1 1 A 56 56 GLU C C 56 175.730 175.226 0.504 1
1 647 . 11 1 1 A 56 56 GLU CA C 56 56.730 56.327 0.403 1
1 648 . 11 1 1 A 56 56 GLU CB C 56 30.070 30.683 -0.613 1
1 650 . 11 1 1 A 56 56 GLU N N 56 124.090 124.771 -0.681 1
1 651 . 11 1 1 A 57 57 VAL H H 57 8.920 8.439 0.481 1
1 652 . 11 1 1 A 57 57 VAL HA H 57 4.030 4.800 -0.770 1
1 660 . 11 1 1 A 57 57 VAL C C 57 174.610 173.765 0.845 1
1 661 . 11 1 1 A 57 57 VAL CA C 57 61.680 59.587 2.093 1
1 662 . 11 1 1 A 57 57 VAL CB C 57 33.880 34.443 -0.563 1
1 665 . 11 1 1 A 57 57 VAL N N 57 129.960 126.626 3.334 1
1 666 . 11 1 1 A 58 58 LYS H H 58 7.860 8.684 -0.824 1
1 667 . 11 1 1 A 58 58 LYS HA H 58 5.120 4.823 0.297 1
1 676 . 11 1 1 A 58 58 LYS C C 58 175.380 175.818 -0.438 1
1 677 . 11 1 1 A 58 58 LYS CA C 58 55.200 54.895 0.305 1
1 678 . 11 1 1 A 58 58 LYS CB C 58 34.670 34.419 0.251 1
1 682 . 11 1 1 A 58 58 LYS N N 58 124.790 127.358 -2.568 1
1 683 . 11 1 1 A 59 59 PHE H H 59 9.270 9.145 0.125 1
1 684 . 11 1 1 A 59 59 PHE HA H 59 4.960 5.018 -0.058 1
1 692 . 11 1 1 A 59 59 PHE C C 59 173.950 174.335 -0.385 1
1 693 . 11 1 1 A 59 59 PHE CA C 59 55.910 56.261 -0.351 1
1 694 . 11 1 1 A 59 59 PHE CB C 59 42.950 42.257 0.693 1
1 700 . 11 1 1 A 59 59 PHE N N 59 118.270 122.346 -4.076 1
1 701 . 11 1 1 A 60 60 LYS H H 60 9.170 8.739 0.431 1
1 702 . 11 1 1 A 60 60 LYS HA H 60 4.910 4.920 -0.010 1
1 711 . 11 1 1 A 60 60 LYS C C 60 176.230 175.881 0.349 1
1 712 . 11 1 1 A 60 60 LYS CA C 60 53.910 54.844 -0.934 1
1 713 . 11 1 1 A 60 60 LYS CB C 60 35.170 34.574 0.596 1
1 717 . 11 1 1 A 60 60 LYS N N 60 121.960 124.339 -2.379 1
1 718 . 11 1 1 A 61 61 VAL H H 61 9.400 8.748 0.652 1
1 719 . 11 1 1 A 61 61 VAL HA H 61 4.170 4.039 0.131 1
1 727 . 11 1 1 A 61 61 VAL C C 61 175.500 175.339 0.161 1
1 728 . 11 1 1 A 61 61 VAL CA C 61 61.980 63.368 -1.388 1
1 729 . 11 1 1 A 61 61 VAL CB C 61 29.490 31.190 -1.700 1
1 732 . 11 1 1 A 61 61 VAL N N 61 127.140 127.164 -0.024 1
1 733 . 11 1 1 A 62 62 VAL H H 62 8.390 8.807 -0.417 1
1 734 . 11 1 1 A 62 62 VAL HA H 62 3.650 3.970 -0.320 1
1 742 . 11 1 1 A 62 62 VAL C C 62 176.440 176.005 0.435 1
1 743 . 11 1 1 A 62 62 VAL CA C 62 64.930 64.486 0.444 1
1 744 . 11 1 1 A 62 62 VAL CB C 62 32.130 32.444 -0.314 1
1 747 . 11 1 1 A 62 62 VAL N N 62 132.840 129.493 3.347 1
1 748 . 11 1 1 A 63 63 GLN H H 63 7.470 7.185 0.285 1
1 749 . 11 1 1 A 63 63 GLN HA H 63 4.270 4.625 -0.355 1
1 756 . 11 1 1 A 63 63 GLN C C 63 172.290 173.386 -1.096 1
1 757 . 11 1 1 A 63 63 GLN CA C 63 56.640 55.491 1.149 1
1 758 . 11 1 1 A 63 63 GLN CB C 63 32.630 32.292 0.338 1
1 760 . 11 1 1 A 63 63 GLN N N 63 114.500 116.745 -2.245 1
1 762 . 11 1 1 A 64 64 ALA H H 64 8.200 8.671 -0.471 1
1 763 . 11 1 1 A 64 64 ALA HA H 64 4.830 5.314 -0.484 1
1 767 . 11 1 1 A 64 64 ALA C C 64 174.270 175.533 -1.263 1
1 768 . 11 1 1 A 64 64 ALA CA C 64 50.800 49.962 0.838 1
1 769 . 11 1 1 A 64 64 ALA CB C 64 20.100 21.445 -1.345 1
1 770 . 11 1 1 A 64 64 ALA N N 64 131.410 128.192 3.218 1
1 771 . 11 1 1 A 65 65 TYR H H 65 8.860 8.502 0.358 1
1 772 . 11 1 1 A 65 65 TYR HA H 65 4.540 4.966 -0.426 1
1 779 . 11 1 1 A 65 65 TYR CA C 65 54.270 55.027 -0.757 1
1 780 . 11 1 1 A 65 65 TYR CB C 65 41.360 40.398 0.962 1
1 785 . 11 1 1 A 65 65 TYR N N 65 124.140 120.188 3.952 1
1 786 . 11 1 1 A 66 66 PRO HA H 66 4.120 4.741 -0.621 1
1 793 . 11 1 1 A 66 66 PRO CA C 66 63.450 62.365 1.085 1
1 794 . 11 1 1 A 66 66 PRO CB C 66 34.170 32.793 1.377 1
1 797 . 11 1 1 A 67 67 SER H H 67 7.380 8.240 -0.860 1
1 798 . 11 1 1 A 67 67 SER HA H 67 4.720 5.021 -0.301 1
1 801 . 11 1 1 A 67 67 SER CA C 67 54.250 55.985 -1.735 1
1 802 . 11 1 1 A 67 67 SER CB C 67 64.530 63.940 0.590 1
1 803 . 11 1 1 A 67 67 SER N N 67 106.200 116.840 -10.640 1
1 804 . 11 1 1 A 68 68 PRO HA H 68 4.880 4.682 0.198 1
1 811 . 11 1 1 A 68 68 PRO CA C 68 62.990 62.432 0.558 1
1 812 . 11 1 1 A 68 68 PRO CB C 68 35.220 33.254 1.966 1
1 815 . 11 1 1 A 69 69 LEU H H 69 8.960 7.928 1.032 1
1 816 . 11 1 1 A 69 69 LEU HA H 69 4.430 5.115 -0.685 1
1 826 . 11 1 1 A 69 69 LEU C C 69 174.570 175.246 -0.676 1
1 827 . 11 1 1 A 69 69 LEU CA C 69 53.900 52.658 1.242 1
1 828 . 11 1 1 A 69 69 LEU CB C 69 44.210 46.093 -1.883 1
1 832 . 11 1 1 A 69 69 LEU N N 69 120.480 116.807 3.673 1
1 833 . 11 1 1 A 70 70 ARG H H 70 8.130 8.370 -0.240 1
1 834 . 11 1 1 A 70 70 ARG HA H 70 4.930 4.794 0.136 1
1 841 . 11 1 1 A 70 70 ARG C C 70 175.460 176.119 -0.659 1
1 842 . 11 1 1 A 70 70 ARG CA C 70 54.040 55.432 -1.392 1
1 843 . 11 1 1 A 70 70 ARG CB C 70 30.550 31.926 -1.376 1
1 846 . 11 1 1 A 70 70 ARG N N 70 125.180 119.646 5.534 1
1 847 . 11 1 1 A 71 71 VAL H H 71 8.450 8.189 0.261 1
1 848 . 11 1 1 A 71 71 VAL HA H 71 3.410 4.464 -1.054 1
1 856 . 11 1 1 A 71 71 VAL C C 71 175.460 175.830 -0.370 1
1 857 . 11 1 1 A 71 71 VAL CA C 71 65.210 62.388 2.822 1
1 858 . 11 1 1 A 71 71 VAL CB C 71 29.840 31.631 -1.791 1
1 861 . 11 1 1 A 71 71 VAL N N 71 128.170 122.505 5.665 1
1 862 . 11 1 1 A 72 72 GLU H H 72 8.620 8.649 -0.029 1
1 863 . 11 1 1 A 72 72 GLU HA H 72 4.870 4.722 0.148 1
1 868 . 11 1 1 A 72 72 GLU C C 72 176.960 176.431 0.529 1
1 869 . 11 1 1 A 72 72 GLU CA C 72 54.330 54.212 0.118 1
1 870 . 11 1 1 A 72 72 GLU CB C 72 33.280 32.048 1.232 1
1 872 . 11 1 1 A 72 72 GLU N N 72 127.670 126.985 0.685 1
1 873 . 11 1 1 A 73 73 ASP H H 73 8.700 8.757 -0.057 1
1 874 . 11 1 1 A 73 73 ASP HA H 73 4.150 4.297 -0.147 1
1 877 . 11 1 1 A 73 73 ASP C C 73 177.460 177.641 -0.181 1
1 878 . 11 1 1 A 73 73 ASP CA C 73 57.620 57.313 0.307 1
1 879 . 11 1 1 A 73 73 ASP CB C 73 40.360 40.418 -0.058 1
1 880 . 11 1 1 A 73 73 ASP N N 73 121.140 123.064 -1.924 1
1 881 . 11 1 1 A 74 74 ARG H H 74 7.760 7.627 0.133 1
1 882 . 11 1 1 A 74 74 ARG HA H 74 4.280 4.334 -0.054 1
1 889 . 11 1 1 A 74 74 ARG C C 74 176.510 176.736 -0.226 1
1 890 . 11 1 1 A 74 74 ARG CA C 74 55.450 56.839 -1.389 1
1 891 . 11 1 1 A 74 74 ARG CB C 74 29.990 30.792 -0.802 1
1 894 . 11 1 1 A 74 74 ARG N N 74 112.890 116.334 -3.444 1
1 895 . 11 1 1 A 75 75 THR H H 75 7.700 7.557 0.143 1
1 896 . 11 1 1 A 75 75 THR HA H 75 4.020 4.387 -0.367 1
1 901 . 11 1 1 A 75 75 THR C C 75 173.810 173.930 -0.120 1
1 902 . 11 1 1 A 75 75 THR CA C 75 64.060 63.932 0.128 1
1 903 . 11 1 1 A 75 75 THR CB C 75 69.350 69.398 -0.048 1
1 905 . 11 1 1 A 75 75 THR N N 75 120.650 116.005 4.645 1
1 906 . 11 1 1 A 76 76 LYS H H 76 8.520 8.295 0.225 1
1 907 . 11 1 1 A 76 76 LYS HA H 76 4.270 4.636 -0.366 1
1 916 . 11 1 1 A 76 76 LYS C C 76 174.560 175.755 -1.195 1
1 917 . 11 1 1 A 76 76 LYS CA C 76 56.280 55.880 0.400 1
1 918 . 11 1 1 A 76 76 LYS CB C 76 33.120 33.683 -0.563 1
1 922 . 11 1 1 A 76 76 LYS N N 76 130.950 127.099 3.851 1
1 923 . 11 1 1 A 77 77 ILE H H 77 8.430 8.601 -0.171 1
1 924 . 11 1 1 A 77 77 ILE HA H 77 4.850 5.205 -0.355 1
1 934 . 11 1 1 A 77 77 ILE C C 77 174.650 174.850 -0.200 1
1 935 . 11 1 1 A 77 77 ILE CA C 77 59.820 60.162 -0.342 1
1 936 . 11 1 1 A 77 77 ILE CB C 77 38.280 40.918 -2.638 1
1 940 . 11 1 1 A 77 77 ILE N N 77 128.020 122.020 6.000 1
1 941 . 11 1 1 A 78 78 THR H H 78 8.870 8.838 0.032 1
1 942 . 11 1 1 A 78 78 THR HA H 78 4.470 5.098 -0.628 1
1 947 . 11 1 1 A 78 78 THR C C 78 172.760 173.665 -0.905 1
1 948 . 11 1 1 A 78 78 THR CA C 78 60.740 61.361 -0.621 1
1 949 . 11 1 1 A 78 78 THR CB C 78 71.320 71.533 -0.213 1
1 951 . 11 1 1 A 78 78 THR N N 78 123.870 124.167 -0.297 1
1 952 . 11 1 1 A 79 79 LEU H H 79 8.820 8.953 -0.133 1
1 953 . 11 1 1 A 79 79 LEU HA H 79 5.140 5.122 0.018 1
1 963 . 11 1 1 A 79 79 LEU C C 79 176.610 175.916 0.694 1
1 964 . 11 1 1 A 79 79 LEU CA C 79 53.280 53.366 -0.086 1
1 965 . 11 1 1 A 79 79 LEU CB C 79 42.600 42.937 -0.337 1
1 969 . 11 1 1 A 79 79 LEU N N 79 127.070 126.528 0.542 1
1 970 . 11 1 1 A 80 80 VAL H H 80 8.800 8.906 -0.106 1
1 971 . 11 1 1 A 80 80 VAL HA H 80 4.260 4.377 -0.117 1
1 979 . 11 1 1 A 80 80 VAL CA C 80 61.350 62.072 -0.722 1
1 980 . 11 1 1 A 80 80 VAL CB C 80 32.790 32.575 0.215 1
1 983 . 11 1 1 A 80 80 VAL N N 80 124.120 124.694 -0.574 1
1 984 . 11 1 1 A 81 81 THR H H 81 8.160 8.760 -0.600 1
1 985 . 11 1 1 A 81 81 THR HA H 81 4.410 4.655 -0.245 1
1 990 . 11 1 1 A 81 81 THR CA C 81 60.800 62.225 -1.425 1
1 991 . 11 1 1 A 81 81 THR CB C 81 69.650 70.582 -0.932 1
1 993 . 11 1 1 A 81 81 THR N N 81 114.500 115.603 -1.103 1
1 1 . 12 1 1 A 9 9 GLY H H 9 8.390 8.520 -0.130 1
1 2 . 12 1 1 A 9 9 GLY HA2 H 9 3.900 4.117 -0.217 1
1 3 . 12 1 1 A 9 9 GLY HA3 H 9 3.860 4.117 -0.257 1
1 4 . 12 1 1 A 9 9 GLY CA C 9 45.150 44.445 0.705 1
1 5 . 12 1 1 A 9 9 GLY N N 9 110.000 109.829 0.171 1
1 6 . 12 1 1 A 10 10 VAL H H 10 7.870 8.553 -0.683 1
1 7 . 12 1 1 A 10 10 VAL HA H 10 4.040 4.401 -0.361 1
1 15 . 12 1 1 A 10 10 VAL C C 10 175.880 176.476 -0.596 1
1 16 . 12 1 1 A 10 10 VAL CA C 10 62.110 61.859 0.251 1
1 17 . 12 1 1 A 10 10 VAL CB C 10 32.760 32.415 0.345 1
1 20 . 12 1 1 A 10 10 VAL N N 10 119.730 120.891 -1.161 1
1 21 . 12 1 1 A 11 11 ILE H H 11 8.230 8.456 -0.226 1
1 22 . 12 1 1 A 11 11 ILE HA H 11 4.090 4.101 -0.011 1
1 32 . 12 1 1 A 11 11 ILE C C 11 175.850 176.031 -0.181 1
1 33 . 12 1 1 A 11 11 ILE CA C 11 60.800 61.521 -0.721 1
1 34 . 12 1 1 A 11 11 ILE CB C 11 38.470 37.967 0.503 1
1 38 . 12 1 1 A 11 11 ILE N N 11 125.570 126.581 -1.011 1
1 39 . 12 1 1 A 12 12 MET H H 12 8.370 8.638 -0.268 1
1 40 . 12 1 1 A 12 12 MET HA H 12 4.540 4.861 -0.321 1
1 48 . 12 1 1 A 12 12 MET C C 12 174.830 175.979 -1.149 1
1 49 . 12 1 1 A 12 12 MET CA C 12 54.790 54.441 0.349 1
1 50 . 12 1 1 A 12 12 MET CB C 12 32.640 33.389 -0.749 1
1 53 . 12 1 1 A 12 12 MET N N 12 125.930 126.475 -0.545 1
1 54 . 12 1 1 A 13 13 SER H H 13 7.990 8.577 -0.587 1
1 55 . 12 1 1 A 13 13 SER HA H 13 5.030 5.033 -0.003 1
1 58 . 12 1 1 A 13 13 SER C C 13 174.330 173.989 0.341 1
1 59 . 12 1 1 A 13 13 SER CA C 13 57.320 57.330 -0.010 1
1 60 . 12 1 1 A 13 13 SER CB C 13 64.790 65.275 -0.485 1
1 61 . 12 1 1 A 13 13 SER N N 13 116.400 118.716 -2.316 1
1 62 . 12 1 1 A 14 14 GLU H H 14 9.430 8.570 0.860 1
1 63 . 12 1 1 A 14 14 GLU HA H 14 5.250 5.423 -0.173 1
1 68 . 12 1 1 A 14 14 GLU C C 14 172.980 174.752 -1.772 1
1 69 . 12 1 1 A 14 14 GLU CA C 14 55.390 55.015 0.375 1
1 70 . 12 1 1 A 14 14 GLU CB C 14 33.910 34.508 -0.598 1
1 72 . 12 1 1 A 14 14 GLU N N 14 123.670 118.992 4.678 1
1 73 . 12 1 1 A 15 15 LEU H H 15 8.930 8.875 0.055 1
1 74 . 12 1 1 A 15 15 LEU HA H 15 4.870 5.129 -0.259 1
1 84 . 12 1 1 A 15 15 LEU C C 15 174.000 174.310 -0.310 1
1 85 . 12 1 1 A 15 15 LEU CA C 15 53.020 53.586 -0.566 1
1 86 . 12 1 1 A 15 15 LEU CB C 15 46.040 45.766 0.274 1
1 90 . 12 1 1 A 15 15 LEU N N 15 125.350 125.528 -0.178 1
1 91 . 12 1 1 A 16 16 LYS H H 16 8.840 8.721 0.119 1
1 92 . 12 1 1 A 16 16 LYS HA H 16 5.360 4.878 0.482 1
1 101 . 12 1 1 A 16 16 LYS C C 16 175.660 175.271 0.389 1
1 102 . 12 1 1 A 16 16 LYS CA C 16 54.940 55.587 -0.647 1
1 103 . 12 1 1 A 16 16 LYS CB C 16 34.280 33.551 0.729 1
1 107 . 12 1 1 A 16 16 LYS N N 16 124.640 127.019 -2.379 1
1 108 . 12 1 1 A 17 17 LEU H H 17 8.820 9.051 -0.231 1
1 109 . 12 1 1 A 17 17 LEU HA H 17 5.430 5.170 0.260 1
1 119 . 12 1 1 A 17 17 LEU C C 17 174.630 175.742 -1.112 1
1 120 . 12 1 1 A 17 17 LEU CA C 17 52.900 53.354 -0.454 1
1 121 . 12 1 1 A 17 17 LEU CB C 17 46.910 45.390 1.520 1
1 125 . 12 1 1 A 17 17 LEU N N 17 123.460 126.951 -3.491 1
1 126 . 12 1 1 A 18 18 LYS H H 18 9.110 8.640 0.470 1
1 127 . 12 1 1 A 18 18 LYS HA H 18 5.490 4.954 0.536 1
1 136 . 12 1 1 A 18 18 LYS CA C 18 52.270 52.946 -0.676 1
1 137 . 12 1 1 A 18 18 LYS CB C 18 37.500 36.326 1.174 1
1 141 . 12 1 1 A 18 18 LYS N N 18 122.230 123.099 -0.869 1
1 142 . 12 1 1 A 19 19 PRO HA H 19 4.100 4.441 -0.341 1
1 149 . 12 1 1 A 19 19 PRO CA C 19 62.440 62.325 0.115 1
1 150 . 12 1 1 A 19 19 PRO CB C 19 30.640 32.292 -1.652 1
1 153 . 12 1 1 A 20 20 LEU H H 20 8.490 8.388 0.102 1
1 154 . 12 1 1 A 20 20 LEU HA H 20 4.320 4.205 0.115 1
1 164 . 12 1 1 A 20 20 LEU CA C 20 57.680 58.614 -0.934 1
1 165 . 12 1 1 A 20 20 LEU CB C 20 38.760 40.848 -2.088 1
1 169 . 12 1 1 A 20 20 LEU N N 20 123.250 119.574 3.676 1
1 170 . 12 1 1 A 21 21 PRO HA H 21 4.530 4.460 0.070 1
1 177 . 12 1 1 A 21 21 PRO CA C 21 62.880 62.449 0.431 1
1 178 . 12 1 1 A 21 21 PRO CB C 21 31.420 32.008 -0.588 1
1 181 . 12 1 1 A 22 22 LYS H H 22 8.180 8.220 -0.040 1
1 182 . 12 1 1 A 22 22 LYS HA H 22 4.110 4.364 -0.254 1
1 191 . 12 1 1 A 22 22 LYS C C 22 175.680 175.335 0.345 1
1 192 . 12 1 1 A 22 22 LYS CA C 22 56.210 55.926 0.284 1
1 193 . 12 1 1 A 22 22 LYS CB C 22 30.660 31.660 -1.000 1
1 197 . 12 1 1 A 22 22 LYS N N 22 119.160 118.886 0.274 1
1 198 . 12 1 1 A 23 23 VAL H H 23 7.530 7.956 -0.426 1
1 199 . 12 1 1 A 23 23 VAL HA H 23 4.280 4.775 -0.495 1
1 207 . 12 1 1 A 23 23 VAL C C 23 173.690 173.339 0.351 1
1 208 . 12 1 1 A 23 23 VAL CA C 23 59.830 59.599 0.231 1
1 209 . 12 1 1 A 23 23 VAL CB C 23 34.550 35.547 -0.997 1
1 212 . 12 1 1 A 23 23 VAL N N 23 121.820 124.160 -2.340 1
1 213 . 12 1 1 A 24 24 GLU H H 24 8.270 8.897 -0.627 1
1 214 . 12 1 1 A 24 24 GLU HA H 24 4.330 4.831 -0.501 1
1 219 . 12 1 1 A 24 24 GLU C C 24 175.390 175.399 -0.009 1
1 220 . 12 1 1 A 24 24 GLU CA C 24 55.220 55.015 0.205 1
1 221 . 12 1 1 A 24 24 GLU CB C 24 29.970 31.591 -1.621 1
1 223 . 12 1 1 A 24 24 GLU N N 24 125.610 126.906 -1.296 1
1 224 . 12 1 1 A 25 25 LEU H H 25 8.480 8.735 -0.255 1
1 225 . 12 1 1 A 25 25 LEU HA H 25 4.520 4.432 0.088 1
1 235 . 12 1 1 A 25 25 LEU CA C 25 51.660 51.071 0.589 1
1 236 . 12 1 1 A 25 25 LEU CB C 25 41.750 41.559 0.191 1
1 240 . 12 1 1 A 25 25 LEU N N 25 125.880 126.843 -0.963 1
1 241 . 12 1 1 A 26 26 PRO HA H 26 4.760 4.668 0.092 1
1 248 . 12 1 1 A 26 26 PRO CA C 26 61.330 61.937 -0.607 1
1 249 . 12 1 1 A 26 26 PRO CB C 26 31.060 32.849 -1.789 1
1 252 . 12 1 1 A 27 27 PRO HA H 27 4.390 4.410 -0.020 1
1 259 . 12 1 1 A 27 27 PRO CA C 27 64.550 64.881 -0.331 1
1 260 . 12 1 1 A 27 27 PRO CB C 27 31.770 31.742 0.028 1
1 263 . 12 1 1 A 28 28 ASP H H 28 8.560 8.825 -0.265 1
1 264 . 12 1 1 A 28 28 ASP HA H 28 4.620 4.400 0.220 1
1 267 . 12 1 1 A 28 28 ASP C C 28 177.100 178.813 -1.713 1
1 268 . 12 1 1 A 28 28 ASP CA C 28 53.890 56.528 -2.638 1
1 269 . 12 1 1 A 28 28 ASP CB C 28 39.120 39.612 -0.492 1
1 270 . 12 1 1 A 28 28 ASP N N 28 115.820 117.834 -2.014 1
1 271 . 12 1 1 A 29 29 PHE H H 29 7.940 8.028 -0.088 1
1 272 . 12 1 1 A 29 29 PHE HA H 29 4.180 4.324 -0.144 1
1 280 . 12 1 1 A 29 29 PHE C C 29 176.740 178.229 -1.489 1
1 281 . 12 1 1 A 29 29 PHE CA C 29 61.020 61.014 0.006 1
1 282 . 12 1 1 A 29 29 PHE CB C 29 39.230 38.767 0.463 1
1 288 . 12 1 1 A 29 29 PHE N N 29 119.610 118.205 1.405 1
1 289 . 12 1 1 A 30 30 VAL H H 30 8.010 8.453 -0.443 1
1 290 . 12 1 1 A 30 30 VAL HA H 30 3.350 3.767 -0.417 1
1 298 . 12 1 1 A 30 30 VAL C C 30 176.400 177.144 -0.744 1
1 299 . 12 1 1 A 30 30 VAL CA C 30 66.510 64.820 1.690 1
1 300 . 12 1 1 A 30 30 VAL CB C 30 31.020 31.065 -0.045 1
1 303 . 12 1 1 A 30 30 VAL N N 30 116.370 119.470 -3.100 1
1 304 . 12 1 1 A 31 31 ASP H H 31 7.420 7.968 -0.548 1
1 305 . 12 1 1 A 31 31 ASP HA H 31 4.310 4.358 -0.048 1
1 308 . 12 1 1 A 31 31 ASP C C 31 178.360 178.896 -0.536 1
1 309 . 12 1 1 A 31 31 ASP CA C 31 57.110 57.108 0.002 1
1 310 . 12 1 1 A 31 31 ASP CB C 31 40.450 40.897 -0.447 1
1 311 . 12 1 1 A 31 31 ASP N N 31 119.190 121.554 -2.364 1
1 312 . 12 1 1 A 32 32 VAL H H 32 7.190 7.537 -0.347 1
1 313 . 12 1 1 A 32 32 VAL HA H 32 3.510 3.548 -0.038 1
1 321 . 12 1 1 A 32 32 VAL C C 32 178.100 178.558 -0.458 1
1 322 . 12 1 1 A 32 32 VAL CA C 32 65.570 66.373 -0.803 1
1 323 . 12 1 1 A 32 32 VAL CB C 32 31.410 31.314 0.096 1
1 326 . 12 1 1 A 32 32 VAL N N 32 119.830 120.247 -0.417 1
1 327 . 12 1 1 A 33 33 ILE H H 33 7.660 8.443 -0.783 1
1 328 . 12 1 1 A 33 33 ILE HA H 33 3.170 3.516 -0.346 1
1 338 . 12 1 1 A 33 33 ILE C C 33 176.660 178.142 -1.482 1
1 339 . 12 1 1 A 33 33 ILE CA C 33 65.220 65.213 0.007 1
1 340 . 12 1 1 A 33 33 ILE CB C 33 37.500 37.759 -0.259 1
1 344 . 12 1 1 A 33 33 ILE N N 33 118.490 120.847 -2.357 1
1 345 . 12 1 1 A 34 34 ARG H H 34 7.830 7.719 0.111 1
1 346 . 12 1 1 A 34 34 ARG HA H 34 3.380 3.901 -0.521 1
1 354 . 12 1 1 A 34 34 ARG C C 34 178.060 177.030 1.030 1
1 355 . 12 1 1 A 34 34 ARG CA C 34 60.570 58.808 1.762 1
1 356 . 12 1 1 A 34 34 ARG CB C 34 30.070 29.555 0.515 1
1 359 . 12 1 1 A 34 34 ARG N N 34 118.260 120.009 -1.749 1
1 361 . 12 1 1 A 35 35 ILE H H 35 7.350 7.901 -0.551 1
1 362 . 12 1 1 A 35 35 ILE HA H 35 3.720 3.702 0.018 1
1 372 . 12 1 1 A 35 35 ILE C C 35 179.090 178.075 1.015 1
1 373 . 12 1 1 A 35 35 ILE CA C 35 64.060 65.374 -1.314 1
1 374 . 12 1 1 A 35 35 ILE CB C 35 38.030 37.376 0.654 1
1 378 . 12 1 1 A 35 35 ILE N N 35 116.750 119.415 -2.665 1
1 379 . 12 1 1 A 36 36 LYS H H 36 7.880 7.654 0.226 1
1 380 . 12 1 1 A 36 36 LYS HA H 36 4.090 3.954 0.136 1
1 389 . 12 1 1 A 36 36 LYS C C 36 178.560 178.917 -0.357 1
1 390 . 12 1 1 A 36 36 LYS CA C 36 57.650 59.767 -2.117 1
1 391 . 12 1 1 A 36 36 LYS CB C 36 32.090 32.192 -0.102 1
1 395 . 12 1 1 A 36 36 LYS N N 36 118.700 119.829 -1.129 1
1 396 . 12 1 1 A 37 37 LEU H H 37 7.860 7.424 0.436 1
1 397 . 12 1 1 A 37 37 LEU HA H 37 4.230 4.293 -0.063 1
1 407 . 12 1 1 A 37 37 LEU C C 37 175.880 176.756 -0.876 1
1 408 . 12 1 1 A 37 37 LEU CA C 37 54.090 55.609 -1.519 1
1 409 . 12 1 1 A 37 37 LEU CB C 37 43.310 42.479 0.831 1
1 413 . 12 1 1 A 37 37 LEU N N 37 116.380 117.571 -1.191 1
1 414 . 12 1 1 A 38 38 GLN H H 38 7.190 7.526 -0.336 1
1 415 . 12 1 1 A 38 38 GLN HA H 38 3.530 4.407 -0.877 1
1 422 . 12 1 1 A 38 38 GLN C C 38 177.480 176.260 1.220 1
1 423 . 12 1 1 A 38 38 GLN CA C 38 58.370 56.735 1.635 1
1 424 . 12 1 1 A 38 38 GLN CB C 38 28.300 28.691 -0.391 1
1 426 . 12 1 1 A 38 38 GLN N N 38 119.210 117.670 1.540 1
1 428 . 12 1 1 A 39 39 GLY H H 39 8.940 8.821 0.119 1
1 429 . 12 1 1 A 39 39 GLY HA2 H 39 3.540 3.987 -0.447 1
1 430 . 12 1 1 A 39 39 GLY HA3 H 39 4.220 3.988 0.232 1
1 431 . 12 1 1 A 39 39 GLY C C 39 174.070 174.421 -0.351 1
1 432 . 12 1 1 A 39 39 GLY CA C 39 45.280 45.037 0.243 1
1 433 . 12 1 1 A 39 39 GLY N N 39 113.490 112.389 1.101 1
1 434 . 12 1 1 A 40 40 LYS H H 40 8.350 7.630 0.720 1
1 435 . 12 1 1 A 40 40 LYS HA H 40 4.400 4.604 -0.204 1
1 444 . 12 1 1 A 40 40 LYS C C 40 175.560 175.767 -0.207 1
1 445 . 12 1 1 A 40 40 LYS CA C 40 55.660 54.646 1.014 1
1 446 . 12 1 1 A 40 40 LYS CB C 40 32.870 33.746 -0.876 1
1 450 . 12 1 1 A 40 40 LYS N N 40 122.060 119.974 2.086 1
1 451 . 12 1 1 A 41 41 THR H H 41 8.410 8.580 -0.170 1
1 452 . 12 1 1 A 41 41 THR HA H 41 5.330 5.014 0.316 1
1 457 . 12 1 1 A 41 41 THR C C 41 174.860 174.416 0.444 1
1 458 . 12 1 1 A 41 41 THR CA C 41 62.040 61.710 0.330 1
1 459 . 12 1 1 A 41 41 THR CB C 41 69.420 70.864 -1.444 1
1 461 . 12 1 1 A 41 41 THR N N 41 118.150 117.345 0.805 1
1 462 . 12 1 1 A 42 42 VAL H H 42 9.140 9.175 -0.035 1
1 463 . 12 1 1 A 42 42 VAL HA H 42 4.570 5.025 -0.455 1
1 471 . 12 1 1 A 42 42 VAL C C 42 172.970 173.638 -0.668 1
1 472 . 12 1 1 A 42 42 VAL CA C 42 59.450 59.304 0.146 1
1 473 . 12 1 1 A 42 42 VAL CB C 42 35.880 35.366 0.514 1
1 476 . 12 1 1 A 42 42 VAL N N 42 122.510 120.691 1.819 1
1 477 . 12 1 1 A 43 43 ARG H H 43 8.420 8.731 -0.311 1
1 478 . 12 1 1 A 43 43 ARG HA H 43 4.750 4.946 -0.196 1
1 485 . 12 1 1 A 43 43 ARG C C 43 175.650 174.913 0.737 1
1 486 . 12 1 1 A 43 43 ARG CA C 43 53.650 54.105 -0.455 1
1 487 . 12 1 1 A 43 43 ARG CB C 43 33.870 33.967 -0.097 1
1 490 . 12 1 1 A 43 43 ARG N N 43 120.640 122.958 -2.318 1
1 491 . 12 1 1 A 44 44 THR H H 44 8.370 8.559 -0.189 1
1 492 . 12 1 1 A 44 44 THR HA H 44 3.410 3.754 -0.344 1
1 497 . 12 1 1 A 44 44 THR C C 44 175.020 175.810 -0.790 1
1 498 . 12 1 1 A 44 44 THR CA C 44 65.660 65.010 0.650 1
1 499 . 12 1 1 A 44 44 THR CB C 44 69.400 68.334 1.066 1
1 501 . 12 1 1 A 44 44 THR N N 44 118.590 119.357 -0.767 1
1 502 . 12 1 1 A 45 45 GLY H H 45 9.090 8.762 0.328 1
1 503 . 12 1 1 A 45 45 GLY HA2 H 45 3.470 4.012 -0.542 1
1 504 . 12 1 1 A 45 45 GLY HA3 H 45 4.470 4.015 0.455 1
1 505 . 12 1 1 A 45 45 GLY C C 45 174.350 173.838 0.512 1
1 506 . 12 1 1 A 45 45 GLY CA C 45 45.000 44.944 0.056 1
1 507 . 12 1 1 A 45 45 GLY N N 45 117.350 114.978 2.372 1
1 508 . 12 1 1 A 46 46 ASP H H 46 8.010 7.906 0.104 1
1 509 . 12 1 1 A 46 46 ASP HA H 46 4.470 4.622 -0.152 1
1 512 . 12 1 1 A 46 46 ASP C C 46 174.570 174.439 0.131 1
1 513 . 12 1 1 A 46 46 ASP CA C 46 55.570 55.420 0.150 1
1 514 . 12 1 1 A 46 46 ASP CB C 46 41.680 41.534 0.146 1
1 515 . 12 1 1 A 46 46 ASP N N 46 122.240 122.229 0.011 1
1 516 . 12 1 1 A 47 47 VAL H H 47 8.330 8.435 -0.105 1
1 517 . 12 1 1 A 47 47 VAL HA H 47 4.950 4.912 0.038 1
1 525 . 12 1 1 A 47 47 VAL C C 47 176.330 175.523 0.807 1
1 526 . 12 1 1 A 47 47 VAL CA C 47 61.710 60.862 0.848 1
1 527 . 12 1 1 A 47 47 VAL CB C 47 32.900 35.285 -2.385 1
1 530 . 12 1 1 A 47 47 VAL N N 47 119.860 121.850 -1.990 1
1 531 . 12 1 1 A 48 48 ILE H H 48 9.160 8.719 0.441 1
1 532 . 12 1 1 A 48 48 ILE HA H 48 4.630 5.191 -0.561 1
1 542 . 12 1 1 A 48 48 ILE C C 48 174.400 174.391 0.009 1
1 543 . 12 1 1 A 48 48 ILE CA C 48 58.990 59.290 -0.300 1
1 544 . 12 1 1 A 48 48 ILE CB C 48 41.810 42.089 -0.279 1
1 548 . 12 1 1 A 48 48 ILE N N 48 124.990 121.443 3.547 1
1 549 . 12 1 1 A 49 49 GLY H H 49 8.660 8.904 -0.244 1
1 550 . 12 1 1 A 49 49 GLY HA2 H 49 4.950 4.308 0.642 1
1 551 . 12 1 1 A 49 49 GLY HA3 H 49 3.620 4.349 -0.729 1
1 552 . 12 1 1 A 49 49 GLY C C 49 172.920 171.974 0.946 1
1 553 . 12 1 1 A 49 49 GLY CA C 49 44.580 44.372 0.208 1
1 554 . 12 1 1 A 49 49 GLY N N 49 112.060 109.291 2.769 1
1 555 . 12 1 1 A 50 50 ILE H H 50 8.810 9.028 -0.218 1
1 556 . 12 1 1 A 50 50 ILE HA H 50 4.370 4.794 -0.424 1
1 566 . 12 1 1 A 50 50 ILE C C 50 174.500 174.736 -0.236 1
1 567 . 12 1 1 A 50 50 ILE CA C 50 59.550 59.855 -0.305 1
1 568 . 12 1 1 A 50 50 ILE CB C 50 41.300 41.644 -0.344 1
1 572 . 12 1 1 A 50 50 ILE N N 50 123.220 124.947 -1.727 1
1 573 . 12 1 1 A 51 51 SER H H 51 8.540 8.847 -0.307 1
1 574 . 12 1 1 A 51 51 SER HA H 51 4.830 4.995 -0.165 1
1 577 . 12 1 1 A 51 51 SER C C 51 174.130 173.868 0.262 1
1 578 . 12 1 1 A 51 51 SER CA C 51 57.770 57.077 0.693 1
1 579 . 12 1 1 A 51 51 SER CB C 51 63.040 64.128 -1.088 1
1 580 . 12 1 1 A 51 51 SER N N 51 121.430 122.551 -1.121 1
1 581 . 12 1 1 A 52 52 ILE H H 52 8.930 8.721 0.209 1
1 582 . 12 1 1 A 52 52 ILE HA H 52 4.290 4.594 -0.304 1
1 592 . 12 1 1 A 52 52 ILE C C 52 175.280 176.041 -0.761 1
1 593 . 12 1 1 A 52 52 ILE CA C 52 60.250 60.255 -0.005 1
1 594 . 12 1 1 A 52 52 ILE CB C 52 39.840 40.506 -0.666 1
1 598 . 12 1 1 A 52 52 ILE N N 52 127.060 127.832 -0.772 1
1 599 . 12 1 1 A 53 53 LEU H H 53 9.380 9.454 -0.074 1
1 600 . 12 1 1 A 53 53 LEU HA H 53 3.890 4.082 -0.192 1
1 610 . 12 1 1 A 53 53 LEU C C 53 177.130 176.985 0.145 1
1 611 . 12 1 1 A 53 53 LEU CA C 53 55.560 56.194 -0.634 1
1 612 . 12 1 1 A 53 53 LEU CB C 53 39.370 40.669 -1.299 1
1 616 . 12 1 1 A 53 53 LEU N N 53 126.770 129.886 -3.116 1
1 617 . 12 1 1 A 54 54 GLY H H 54 8.310 8.698 -0.388 1
1 618 . 12 1 1 A 54 54 GLY HA2 H 54 3.490 3.896 -0.406 1
1 619 . 12 1 1 A 54 54 GLY HA3 H 54 4.080 3.897 0.183 1
1 620 . 12 1 1 A 54 54 GLY C C 54 173.690 173.752 -0.062 1
1 621 . 12 1 1 A 54 54 GLY CA C 54 45.340 45.724 -0.384 1
1 622 . 12 1 1 A 54 54 GLY N N 54 103.820 104.376 -0.556 1
1 623 . 12 1 1 A 55 55 LYS H H 55 7.730 7.938 -0.208 1
1 624 . 12 1 1 A 55 55 LYS HA H 55 4.560 4.759 -0.199 1
1 633 . 12 1 1 A 55 55 LYS C C 55 174.550 174.999 -0.449 1
1 634 . 12 1 1 A 55 55 LYS CA C 55 54.140 54.401 -0.261 1
1 635 . 12 1 1 A 55 55 LYS CB C 55 34.620 35.375 -0.755 1
1 639 . 12 1 1 A 55 55 LYS N N 55 121.160 119.931 1.229 1
1 640 . 12 1 1 A 56 56 GLU H H 56 8.490 8.789 -0.299 1
1 641 . 12 1 1 A 56 56 GLU HA H 56 4.280 4.693 -0.413 1
1 646 . 12 1 1 A 56 56 GLU C C 56 175.730 175.220 0.510 1
1 647 . 12 1 1 A 56 56 GLU CA C 56 56.730 56.262 0.468 1
1 648 . 12 1 1 A 56 56 GLU CB C 56 30.070 30.625 -0.555 1
1 650 . 12 1 1 A 56 56 GLU N N 56 124.090 124.696 -0.606 1
1 651 . 12 1 1 A 57 57 VAL H H 57 8.920 8.498 0.422 1
1 652 . 12 1 1 A 57 57 VAL HA H 57 4.030 4.814 -0.784 1
1 660 . 12 1 1 A 57 57 VAL C C 57 174.610 173.778 0.832 1
1 661 . 12 1 1 A 57 57 VAL CA C 57 61.680 59.306 2.374 1
1 662 . 12 1 1 A 57 57 VAL CB C 57 33.880 34.528 -0.648 1
1 665 . 12 1 1 A 57 57 VAL N N 57 129.960 126.774 3.186 1
1 666 . 12 1 1 A 58 58 LYS H H 58 7.860 8.694 -0.834 1
1 667 . 12 1 1 A 58 58 LYS HA H 58 5.120 4.815 0.305 1
1 676 . 12 1 1 A 58 58 LYS C C 58 175.380 175.647 -0.267 1
1 677 . 12 1 1 A 58 58 LYS CA C 58 55.200 54.869 0.331 1
1 678 . 12 1 1 A 58 58 LYS CB C 58 34.670 34.279 0.391 1
1 682 . 12 1 1 A 58 58 LYS N N 58 124.790 127.347 -2.557 1
1 683 . 12 1 1 A 59 59 PHE H H 59 9.270 9.110 0.160 1
1 684 . 12 1 1 A 59 59 PHE HA H 59 4.960 5.089 -0.129 1
1 692 . 12 1 1 A 59 59 PHE C C 59 173.950 174.162 -0.212 1
1 693 . 12 1 1 A 59 59 PHE CA C 59 55.910 56.313 -0.403 1
1 694 . 12 1 1 A 59 59 PHE CB C 59 42.950 42.186 0.764 1
1 700 . 12 1 1 A 59 59 PHE N N 59 118.270 122.374 -4.104 1
1 701 . 12 1 1 A 60 60 LYS H H 60 9.170 8.906 0.264 1
1 702 . 12 1 1 A 60 60 LYS HA H 60 4.910 4.995 -0.085 1
1 711 . 12 1 1 A 60 60 LYS C C 60 176.230 175.780 0.450 1
1 712 . 12 1 1 A 60 60 LYS CA C 60 53.910 54.566 -0.656 1
1 713 . 12 1 1 A 60 60 LYS CB C 60 35.170 35.100 0.070 1
1 717 . 12 1 1 A 60 60 LYS N N 60 121.960 124.053 -2.093 1
1 718 . 12 1 1 A 61 61 VAL H H 61 9.400 8.769 0.631 1
1 719 . 12 1 1 A 61 61 VAL HA H 61 4.170 4.091 0.079 1
1 727 . 12 1 1 A 61 61 VAL C C 61 175.500 175.341 0.159 1
1 728 . 12 1 1 A 61 61 VAL CA C 61 61.980 63.092 -1.112 1
1 729 . 12 1 1 A 61 61 VAL CB C 61 29.490 31.300 -1.810 1
1 732 . 12 1 1 A 61 61 VAL N N 61 127.140 126.885 0.255 1
1 733 . 12 1 1 A 62 62 VAL H H 62 8.390 8.684 -0.294 1
1 734 . 12 1 1 A 62 62 VAL HA H 62 3.650 3.959 -0.309 1
1 742 . 12 1 1 A 62 62 VAL C C 62 176.440 176.018 0.422 1
1 743 . 12 1 1 A 62 62 VAL CA C 62 64.930 64.419 0.511 1
1 744 . 12 1 1 A 62 62 VAL CB C 62 32.130 32.402 -0.272 1
1 747 . 12 1 1 A 62 62 VAL N N 62 132.840 129.120 3.720 1
1 748 . 12 1 1 A 63 63 GLN H H 63 7.470 7.128 0.342 1
1 749 . 12 1 1 A 63 63 GLN HA H 63 4.270 4.669 -0.399 1
1 756 . 12 1 1 A 63 63 GLN C C 63 172.290 173.356 -1.066 1
1 757 . 12 1 1 A 63 63 GLN CA C 63 56.640 55.449 1.191 1
1 758 . 12 1 1 A 63 63 GLN CB C 63 32.630 31.977 0.653 1
1 760 . 12 1 1 A 63 63 GLN N N 63 114.500 116.863 -2.363 1
1 762 . 12 1 1 A 64 64 ALA H H 64 8.200 8.736 -0.536 1
1 763 . 12 1 1 A 64 64 ALA HA H 64 4.830 5.325 -0.495 1
1 767 . 12 1 1 A 64 64 ALA C C 64 174.270 175.566 -1.296 1
1 768 . 12 1 1 A 64 64 ALA CA C 64 50.800 49.975 0.825 1
1 769 . 12 1 1 A 64 64 ALA CB C 64 20.100 21.710 -1.610 1
1 770 . 12 1 1 A 64 64 ALA N N 64 131.410 128.694 2.716 1
1 771 . 12 1 1 A 65 65 TYR H H 65 8.860 8.519 0.341 1
1 772 . 12 1 1 A 65 65 TYR HA H 65 4.540 4.968 -0.428 1
1 779 . 12 1 1 A 65 65 TYR CA C 65 54.270 55.099 -0.829 1
1 780 . 12 1 1 A 65 65 TYR CB C 65 41.360 40.463 0.897 1
1 785 . 12 1 1 A 65 65 TYR N N 65 124.140 119.977 4.163 1
1 786 . 12 1 1 A 66 66 PRO HA H 66 4.120 4.765 -0.645 1
1 793 . 12 1 1 A 66 66 PRO CA C 66 63.450 62.355 1.095 1
1 794 . 12 1 1 A 66 66 PRO CB C 66 34.170 32.832 1.338 1
1 797 . 12 1 1 A 67 67 SER H H 67 7.380 8.236 -0.856 1
1 798 . 12 1 1 A 67 67 SER HA H 67 4.720 4.977 -0.257 1
1 801 . 12 1 1 A 67 67 SER CA C 67 54.250 56.054 -1.804 1
1 802 . 12 1 1 A 67 67 SER CB C 67 64.530 63.753 0.777 1
1 803 . 12 1 1 A 67 67 SER N N 67 106.200 116.677 -10.477 1
1 804 . 12 1 1 A 68 68 PRO HA H 68 4.880 4.657 0.223 1
1 811 . 12 1 1 A 68 68 PRO CA C 68 62.990 62.467 0.523 1
1 812 . 12 1 1 A 68 68 PRO CB C 68 35.220 33.164 2.056 1
1 815 . 12 1 1 A 69 69 LEU H H 69 8.960 8.058 0.902 1
1 816 . 12 1 1 A 69 69 LEU HA H 69 4.430 5.117 -0.687 1
1 826 . 12 1 1 A 69 69 LEU C C 69 174.570 175.338 -0.768 1
1 827 . 12 1 1 A 69 69 LEU CA C 69 53.900 52.583 1.317 1
1 828 . 12 1 1 A 69 69 LEU CB C 69 44.210 46.127 -1.917 1
1 832 . 12 1 1 A 69 69 LEU N N 69 120.480 117.134 3.346 1
1 833 . 12 1 1 A 70 70 ARG H H 70 8.130 8.376 -0.246 1
1 834 . 12 1 1 A 70 70 ARG HA H 70 4.930 4.777 0.153 1
1 841 . 12 1 1 A 70 70 ARG C C 70 175.460 176.115 -0.655 1
1 842 . 12 1 1 A 70 70 ARG CA C 70 54.040 55.670 -1.630 1
1 843 . 12 1 1 A 70 70 ARG CB C 70 30.550 31.672 -1.122 1
1 846 . 12 1 1 A 70 70 ARG N N 70 125.180 119.862 5.318 1
1 847 . 12 1 1 A 71 71 VAL H H 71 8.450 8.231 0.219 1
1 848 . 12 1 1 A 71 71 VAL HA H 71 3.410 4.459 -1.049 1
1 856 . 12 1 1 A 71 71 VAL C C 71 175.460 175.776 -0.316 1
1 857 . 12 1 1 A 71 71 VAL CA C 71 65.210 62.377 2.833 1
1 858 . 12 1 1 A 71 71 VAL CB C 71 29.840 31.644 -1.804 1
1 861 . 12 1 1 A 71 71 VAL N N 71 128.170 122.572 5.598 1
1 862 . 12 1 1 A 72 72 GLU H H 72 8.620 8.646 -0.026 1
1 863 . 12 1 1 A 72 72 GLU HA H 72 4.870 4.731 0.139 1
1 868 . 12 1 1 A 72 72 GLU C C 72 176.960 176.441 0.519 1
1 869 . 12 1 1 A 72 72 GLU CA C 72 54.330 54.143 0.187 1
1 870 . 12 1 1 A 72 72 GLU CB C 72 33.280 32.188 1.092 1
1 872 . 12 1 1 A 72 72 GLU N N 72 127.670 126.854 0.816 1
1 873 . 12 1 1 A 73 73 ASP H H 73 8.700 8.753 -0.053 1
1 874 . 12 1 1 A 73 73 ASP HA H 73 4.150 4.299 -0.149 1
1 877 . 12 1 1 A 73 73 ASP C C 73 177.460 177.626 -0.166 1
1 878 . 12 1 1 A 73 73 ASP CA C 73 57.620 57.314 0.306 1
1 879 . 12 1 1 A 73 73 ASP CB C 73 40.360 40.420 -0.060 1
1 880 . 12 1 1 A 73 73 ASP N N 73 121.140 123.029 -1.889 1
1 881 . 12 1 1 A 74 74 ARG H H 74 7.760 7.640 0.120 1
1 882 . 12 1 1 A 74 74 ARG HA H 74 4.280 4.335 -0.055 1
1 889 . 12 1 1 A 74 74 ARG C C 74 176.510 176.733 -0.223 1
1 890 . 12 1 1 A 74 74 ARG CA C 74 55.450 56.779 -1.329 1
1 891 . 12 1 1 A 74 74 ARG CB C 74 29.990 30.796 -0.806 1
1 894 . 12 1 1 A 74 74 ARG N N 74 112.890 116.332 -3.442 1
1 895 . 12 1 1 A 75 75 THR H H 75 7.700 7.597 0.103 1
1 896 . 12 1 1 A 75 75 THR HA H 75 4.020 4.369 -0.349 1
1 901 . 12 1 1 A 75 75 THR C C 75 173.810 173.852 -0.042 1
1 902 . 12 1 1 A 75 75 THR CA C 75 64.060 63.873 0.187 1
1 903 . 12 1 1 A 75 75 THR CB C 75 69.350 69.330 0.020 1
1 905 . 12 1 1 A 75 75 THR N N 75 120.650 116.459 4.191 1
1 906 . 12 1 1 A 76 76 LYS H H 76 8.520 8.306 0.214 1
1 907 . 12 1 1 A 76 76 LYS HA H 76 4.270 4.675 -0.405 1
1 916 . 12 1 1 A 76 76 LYS C C 76 174.560 175.769 -1.209 1
1 917 . 12 1 1 A 76 76 LYS CA C 76 56.280 55.925 0.355 1
1 918 . 12 1 1 A 76 76 LYS CB C 76 33.120 33.806 -0.686 1
1 922 . 12 1 1 A 76 76 LYS N N 76 130.950 127.295 3.655 1
1 923 . 12 1 1 A 77 77 ILE H H 77 8.430 8.599 -0.169 1
1 924 . 12 1 1 A 77 77 ILE HA H 77 4.850 5.140 -0.290 1
1 934 . 12 1 1 A 77 77 ILE C C 77 174.650 175.152 -0.502 1
1 935 . 12 1 1 A 77 77 ILE CA C 77 59.820 60.087 -0.267 1
1 936 . 12 1 1 A 77 77 ILE CB C 77 38.280 40.700 -2.420 1
1 940 . 12 1 1 A 77 77 ILE N N 77 128.020 122.963 5.057 1
1 941 . 12 1 1 A 78 78 THR H H 78 8.870 8.846 0.024 1
1 942 . 12 1 1 A 78 78 THR HA H 78 4.470 5.120 -0.650 1
1 947 . 12 1 1 A 78 78 THR C C 78 172.760 173.101 -0.341 1
1 948 . 12 1 1 A 78 78 THR CA C 78 60.740 61.212 -0.472 1
1 949 . 12 1 1 A 78 78 THR CB C 78 71.320 72.024 -0.704 1
1 951 . 12 1 1 A 78 78 THR N N 78 123.870 123.969 -0.099 1
1 952 . 12 1 1 A 79 79 LEU H H 79 8.820 8.872 -0.052 1
1 953 . 12 1 1 A 79 79 LEU HA H 79 5.140 5.058 0.082 1
1 963 . 12 1 1 A 79 79 LEU C C 79 176.610 175.968 0.642 1
1 964 . 12 1 1 A 79 79 LEU CA C 79 53.280 53.342 -0.062 1
1 965 . 12 1 1 A 79 79 LEU CB C 79 42.600 42.926 -0.326 1
1 969 . 12 1 1 A 79 79 LEU N N 79 127.070 125.811 1.259 1
1 970 . 12 1 1 A 80 80 VAL H H 80 8.800 8.526 0.274 1
1 971 . 12 1 1 A 80 80 VAL HA H 80 4.260 4.688 -0.428 1
1 979 . 12 1 1 A 80 80 VAL CA C 80 61.350 61.519 -0.169 1
1 980 . 12 1 1 A 80 80 VAL CB C 80 32.790 32.648 0.142 1
1 983 . 12 1 1 A 80 80 VAL N N 80 124.120 125.534 -1.414 1
1 984 . 12 1 1 A 81 81 THR H H 81 8.160 8.778 -0.618 1
1 985 . 12 1 1 A 81 81 THR HA H 81 4.410 5.109 -0.699 1
1 990 . 12 1 1 A 81 81 THR CA C 81 60.800 59.896 0.904 1
1 991 . 12 1 1 A 81 81 THR CB C 81 69.650 72.640 -2.990 1
1 993 . 12 1 1 A 81 81 THR N N 81 114.500 116.741 -2.241 1
1 1 . 13 1 1 A 9 9 GLY H H 9 8.390 8.414 -0.024 1
1 2 . 13 1 1 A 9 9 GLY HA2 H 9 3.900 4.183 -0.283 1
1 3 . 13 1 1 A 9 9 GLY HA3 H 9 3.860 4.183 -0.323 1
1 4 . 13 1 1 A 9 9 GLY CA C 9 45.150 44.964 0.186 1
1 5 . 13 1 1 A 9 9 GLY N N 9 110.000 112.023 -2.023 1
1 6 . 13 1 1 A 10 10 VAL H H 10 7.870 8.210 -0.340 1
1 7 . 13 1 1 A 10 10 VAL HA H 10 4.040 4.529 -0.489 1
1 15 . 13 1 1 A 10 10 VAL C C 10 175.880 175.308 0.572 1
1 16 . 13 1 1 A 10 10 VAL CA C 10 62.110 62.335 -0.225 1
1 17 . 13 1 1 A 10 10 VAL CB C 10 32.760 32.589 0.171 1
1 20 . 13 1 1 A 10 10 VAL N N 10 119.730 121.910 -2.180 1
1 21 . 13 1 1 A 11 11 ILE H H 11 8.230 8.887 -0.657 1
1 22 . 13 1 1 A 11 11 ILE HA H 11 4.090 4.588 -0.498 1
1 32 . 13 1 1 A 11 11 ILE C C 11 175.850 175.214 0.636 1
1 33 . 13 1 1 A 11 11 ILE CA C 11 60.800 60.213 0.587 1
1 34 . 13 1 1 A 11 11 ILE CB C 11 38.470 39.705 -1.235 1
1 38 . 13 1 1 A 11 11 ILE N N 11 125.570 128.072 -2.502 1
1 39 . 13 1 1 A 12 12 MET H H 12 8.370 8.908 -0.538 1
1 40 . 13 1 1 A 12 12 MET HA H 12 4.540 4.865 -0.325 1
1 48 . 13 1 1 A 12 12 MET C C 12 174.830 175.867 -1.037 1
1 49 . 13 1 1 A 12 12 MET CA C 12 54.790 54.331 0.459 1
1 50 . 13 1 1 A 12 12 MET CB C 12 32.640 33.411 -0.771 1
1 53 . 13 1 1 A 12 12 MET N N 12 125.930 126.415 -0.485 1
1 54 . 13 1 1 A 13 13 SER H H 13 7.990 8.646 -0.656 1
1 55 . 13 1 1 A 13 13 SER HA H 13 5.030 5.178 -0.148 1
1 58 . 13 1 1 A 13 13 SER C C 13 174.330 173.507 0.823 1
1 59 . 13 1 1 A 13 13 SER CA C 13 57.320 56.594 0.726 1
1 60 . 13 1 1 A 13 13 SER CB C 13 64.790 65.551 -0.761 1
1 61 . 13 1 1 A 13 13 SER N N 13 116.400 118.601 -2.201 1
1 62 . 13 1 1 A 14 14 GLU H H 14 9.430 8.760 0.670 1
1 63 . 13 1 1 A 14 14 GLU HA H 14 5.250 5.089 0.161 1
1 68 . 13 1 1 A 14 14 GLU C C 14 172.980 173.997 -1.017 1
1 69 . 13 1 1 A 14 14 GLU CA C 14 55.390 55.383 0.007 1
1 70 . 13 1 1 A 14 14 GLU CB C 14 33.910 34.212 -0.302 1
1 72 . 13 1 1 A 14 14 GLU N N 14 123.670 121.594 2.076 1
1 73 . 13 1 1 A 15 15 LEU H H 15 8.930 8.915 0.015 1
1 74 . 13 1 1 A 15 15 LEU HA H 15 4.870 5.164 -0.294 1
1 84 . 13 1 1 A 15 15 LEU C C 15 174.000 174.535 -0.535 1
1 85 . 13 1 1 A 15 15 LEU CA C 15 53.020 53.524 -0.504 1
1 86 . 13 1 1 A 15 15 LEU CB C 15 46.040 45.733 0.307 1
1 90 . 13 1 1 A 15 15 LEU N N 15 125.350 126.057 -0.707 1
1 91 . 13 1 1 A 16 16 LYS H H 16 8.840 8.800 0.040 1
1 92 . 13 1 1 A 16 16 LYS HA H 16 5.360 4.898 0.462 1
1 101 . 13 1 1 A 16 16 LYS C C 16 175.660 175.455 0.205 1
1 102 . 13 1 1 A 16 16 LYS CA C 16 54.940 55.559 -0.619 1
1 103 . 13 1 1 A 16 16 LYS CB C 16 34.280 33.581 0.699 1
1 107 . 13 1 1 A 16 16 LYS N N 16 124.640 126.792 -2.152 1
1 108 . 13 1 1 A 17 17 LEU H H 17 8.820 9.072 -0.252 1
1 109 . 13 1 1 A 17 17 LEU HA H 17 5.430 5.247 0.183 1
1 119 . 13 1 1 A 17 17 LEU C C 17 174.630 175.726 -1.096 1
1 120 . 13 1 1 A 17 17 LEU CA C 17 52.900 53.479 -0.579 1
1 121 . 13 1 1 A 17 17 LEU CB C 17 46.910 45.513 1.397 1
1 125 . 13 1 1 A 17 17 LEU N N 17 123.460 126.985 -3.525 1
1 126 . 13 1 1 A 18 18 LYS H H 18 9.110 8.747 0.363 1
1 127 . 13 1 1 A 18 18 LYS HA H 18 5.490 4.952 0.538 1
1 136 . 13 1 1 A 18 18 LYS CA C 18 52.270 52.840 -0.570 1
1 137 . 13 1 1 A 18 18 LYS CB C 18 37.500 36.267 1.233 1
1 141 . 13 1 1 A 18 18 LYS N N 18 122.230 123.285 -1.055 1
1 142 . 13 1 1 A 19 19 PRO HA H 19 4.100 4.298 -0.198 1
1 149 . 13 1 1 A 19 19 PRO CA C 19 62.440 62.761 -0.321 1
1 150 . 13 1 1 A 19 19 PRO CB C 19 30.640 31.901 -1.261 1
1 153 . 13 1 1 A 20 20 LEU H H 20 8.490 8.371 0.119 1
1 154 . 13 1 1 A 20 20 LEU HA H 20 4.320 4.147 0.173 1
1 164 . 13 1 1 A 20 20 LEU CA C 20 57.680 58.711 -1.031 1
1 165 . 13 1 1 A 20 20 LEU CB C 20 38.760 40.527 -1.767 1
1 169 . 13 1 1 A 20 20 LEU N N 20 123.250 119.627 3.623 1
1 170 . 13 1 1 A 21 21 PRO HA H 21 4.530 4.468 0.062 1
1 177 . 13 1 1 A 21 21 PRO CA C 21 62.880 62.509 0.371 1
1 178 . 13 1 1 A 21 21 PRO CB C 21 31.420 32.235 -0.815 1
1 181 . 13 1 1 A 22 22 LYS H H 22 8.180 8.337 -0.157 1
1 182 . 13 1 1 A 22 22 LYS HA H 22 4.110 4.515 -0.405 1
1 191 . 13 1 1 A 22 22 LYS C C 22 175.680 175.302 0.378 1
1 192 . 13 1 1 A 22 22 LYS CA C 22 56.210 55.735 0.475 1
1 193 . 13 1 1 A 22 22 LYS CB C 22 30.660 31.896 -1.236 1
1 197 . 13 1 1 A 22 22 LYS N N 22 119.160 121.790 -2.630 1
1 198 . 13 1 1 A 23 23 VAL H H 23 7.530 7.887 -0.357 1
1 199 . 13 1 1 A 23 23 VAL HA H 23 4.280 4.771 -0.491 1
1 207 . 13 1 1 A 23 23 VAL C C 23 173.690 172.973 0.717 1
1 208 . 13 1 1 A 23 23 VAL CA C 23 59.830 59.565 0.265 1
1 209 . 13 1 1 A 23 23 VAL CB C 23 34.550 35.507 -0.957 1
1 212 . 13 1 1 A 23 23 VAL N N 23 121.820 124.948 -3.128 1
1 213 . 13 1 1 A 24 24 GLU H H 24 8.270 8.992 -0.722 1
1 214 . 13 1 1 A 24 24 GLU HA H 24 4.330 5.135 -0.805 1
1 219 . 13 1 1 A 24 24 GLU C C 24 175.390 174.980 0.410 1
1 220 . 13 1 1 A 24 24 GLU CA C 24 55.220 54.493 0.727 1
1 221 . 13 1 1 A 24 24 GLU CB C 24 29.970 33.212 -3.242 1
1 223 . 13 1 1 A 24 24 GLU N N 24 125.610 128.002 -2.392 1
1 224 . 13 1 1 A 25 25 LEU H H 25 8.480 8.793 -0.313 1
1 225 . 13 1 1 A 25 25 LEU HA H 25 4.520 4.427 0.093 1
1 235 . 13 1 1 A 25 25 LEU CA C 25 51.660 51.993 -0.333 1
1 236 . 13 1 1 A 25 25 LEU CB C 25 41.750 41.004 0.746 1
1 240 . 13 1 1 A 25 25 LEU N N 25 125.880 128.069 -2.189 1
1 241 . 13 1 1 A 26 26 PRO HA H 26 4.760 4.614 0.146 1
1 248 . 13 1 1 A 26 26 PRO CA C 26 61.330 61.904 -0.574 1
1 249 . 13 1 1 A 26 26 PRO CB C 26 31.060 32.739 -1.679 1
1 252 . 13 1 1 A 27 27 PRO HA H 27 4.390 4.408 -0.018 1
1 259 . 13 1 1 A 27 27 PRO CA C 27 64.550 64.844 -0.294 1
1 260 . 13 1 1 A 27 27 PRO CB C 27 31.770 31.744 0.026 1
1 263 . 13 1 1 A 28 28 ASP H H 28 8.560 8.784 -0.224 1
1 264 . 13 1 1 A 28 28 ASP HA H 28 4.620 4.421 0.199 1
1 267 . 13 1 1 A 28 28 ASP C C 28 177.100 178.764 -1.664 1
1 268 . 13 1 1 A 28 28 ASP CA C 28 53.890 56.311 -2.421 1
1 269 . 13 1 1 A 28 28 ASP CB C 28 39.120 39.563 -0.443 1
1 270 . 13 1 1 A 28 28 ASP N N 28 115.820 117.832 -2.012 1
1 271 . 13 1 1 A 29 29 PHE H H 29 7.940 7.985 -0.045 1
1 272 . 13 1 1 A 29 29 PHE HA H 29 4.180 4.337 -0.157 1
1 280 . 13 1 1 A 29 29 PHE C C 29 176.740 178.210 -1.470 1
1 281 . 13 1 1 A 29 29 PHE CA C 29 61.020 61.056 -0.036 1
1 282 . 13 1 1 A 29 29 PHE CB C 29 39.230 38.645 0.585 1
1 288 . 13 1 1 A 29 29 PHE N N 29 119.610 118.217 1.393 1
1 289 . 13 1 1 A 30 30 VAL H H 30 8.010 8.472 -0.462 1
1 290 . 13 1 1 A 30 30 VAL HA H 30 3.350 3.769 -0.419 1
1 298 . 13 1 1 A 30 30 VAL C C 30 176.400 177.107 -0.707 1
1 299 . 13 1 1 A 30 30 VAL CA C 30 66.510 64.819 1.691 1
1 300 . 13 1 1 A 30 30 VAL CB C 30 31.020 31.078 -0.058 1
1 303 . 13 1 1 A 30 30 VAL N N 30 116.370 119.616 -3.246 1
1 304 . 13 1 1 A 31 31 ASP H H 31 7.420 7.975 -0.555 1
1 305 . 13 1 1 A 31 31 ASP HA H 31 4.310 4.369 -0.059 1
1 308 . 13 1 1 A 31 31 ASP C C 31 178.360 178.876 -0.516 1
1 309 . 13 1 1 A 31 31 ASP CA C 31 57.110 57.083 0.027 1
1 310 . 13 1 1 A 31 31 ASP CB C 31 40.450 40.971 -0.521 1
1 311 . 13 1 1 A 31 31 ASP N N 31 119.190 121.593 -2.403 1
1 312 . 13 1 1 A 32 32 VAL H H 32 7.190 7.358 -0.168 1
1 313 . 13 1 1 A 32 32 VAL HA H 32 3.510 3.548 -0.038 1
1 321 . 13 1 1 A 32 32 VAL C C 32 178.100 178.478 -0.378 1
1 322 . 13 1 1 A 32 32 VAL CA C 32 65.570 66.368 -0.798 1
1 323 . 13 1 1 A 32 32 VAL CB C 32 31.410 31.278 0.132 1
1 326 . 13 1 1 A 32 32 VAL N N 32 119.830 119.950 -0.120 1
1 327 . 13 1 1 A 33 33 ILE H H 33 7.660 8.421 -0.761 1
1 328 . 13 1 1 A 33 33 ILE HA H 33 3.170 3.546 -0.376 1
1 338 . 13 1 1 A 33 33 ILE C C 33 176.660 178.087 -1.427 1
1 339 . 13 1 1 A 33 33 ILE CA C 33 65.220 65.197 0.023 1
1 340 . 13 1 1 A 33 33 ILE CB C 33 37.500 37.620 -0.120 1
1 344 . 13 1 1 A 33 33 ILE N N 33 118.490 120.813 -2.323 1
1 345 . 13 1 1 A 34 34 ARG H H 34 7.830 7.748 0.082 1
1 346 . 13 1 1 A 34 34 ARG HA H 34 3.380 3.898 -0.518 1
1 354 . 13 1 1 A 34 34 ARG C C 34 178.060 177.836 0.224 1
1 355 . 13 1 1 A 34 34 ARG CA C 34 60.570 58.901 1.669 1
1 356 . 13 1 1 A 34 34 ARG CB C 34 30.070 29.752 0.318 1
1 359 . 13 1 1 A 34 34 ARG N N 34 118.260 120.078 -1.818 1
1 361 . 13 1 1 A 35 35 ILE H H 35 7.350 7.791 -0.441 1
1 362 . 13 1 1 A 35 35 ILE HA H 35 3.720 3.705 0.015 1
1 372 . 13 1 1 A 35 35 ILE C C 35 179.090 178.081 1.009 1
1 373 . 13 1 1 A 35 35 ILE CA C 35 64.060 65.331 -1.271 1
1 374 . 13 1 1 A 35 35 ILE CB C 35 38.030 37.589 0.441 1
1 378 . 13 1 1 A 35 35 ILE N N 35 116.750 119.556 -2.806 1
1 379 . 13 1 1 A 36 36 LYS H H 36 7.880 7.527 0.353 1
1 380 . 13 1 1 A 36 36 LYS HA H 36 4.090 3.963 0.127 1
1 389 . 13 1 1 A 36 36 LYS C C 36 178.560 178.967 -0.407 1
1 390 . 13 1 1 A 36 36 LYS CA C 36 57.650 59.761 -2.111 1
1 391 . 13 1 1 A 36 36 LYS CB C 36 32.090 32.259 -0.169 1
1 395 . 13 1 1 A 36 36 LYS N N 36 118.700 119.662 -0.962 1
1 396 . 13 1 1 A 37 37 LEU H H 37 7.860 7.416 0.444 1
1 397 . 13 1 1 A 37 37 LEU HA H 37 4.230 4.277 -0.047 1
1 407 . 13 1 1 A 37 37 LEU C C 37 175.880 176.780 -0.900 1
1 408 . 13 1 1 A 37 37 LEU CA C 37 54.090 55.855 -1.765 1
1 409 . 13 1 1 A 37 37 LEU CB C 37 43.310 42.618 0.692 1
1 413 . 13 1 1 A 37 37 LEU N N 37 116.380 117.437 -1.057 1
1 414 . 13 1 1 A 38 38 GLN H H 38 7.190 7.586 -0.396 1
1 415 . 13 1 1 A 38 38 GLN HA H 38 3.530 4.507 -0.977 1
1 422 . 13 1 1 A 38 38 GLN C C 38 177.480 176.264 1.216 1
1 423 . 13 1 1 A 38 38 GLN CA C 38 58.370 56.728 1.642 1
1 424 . 13 1 1 A 38 38 GLN CB C 38 28.300 28.729 -0.429 1
1 426 . 13 1 1 A 38 38 GLN N N 38 119.210 117.635 1.575 1
1 428 . 13 1 1 A 39 39 GLY H H 39 8.940 8.885 0.055 1
1 429 . 13 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 13 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 13 1 1 A 39 39 GLY C C 39 174.070 174.427 -0.357 1
1 432 . 13 1 1 A 39 39 GLY CA C 39 45.280 45.062 0.218 1
1 433 . 13 1 1 A 39 39 GLY N N 39 113.490 112.157 1.333 1
1 434 . 13 1 1 A 40 40 LYS H H 40 8.350 7.585 0.765 1
1 435 . 13 1 1 A 40 40 LYS HA H 40 4.400 4.603 -0.203 1
1 444 . 13 1 1 A 40 40 LYS C C 40 175.560 175.771 -0.211 1
1 445 . 13 1 1 A 40 40 LYS CA C 40 55.660 54.650 1.010 1
1 446 . 13 1 1 A 40 40 LYS CB C 40 32.870 33.762 -0.892 1
1 450 . 13 1 1 A 40 40 LYS N N 40 122.060 119.983 2.077 1
1 451 . 13 1 1 A 41 41 THR H H 41 8.410 8.542 -0.132 1
1 452 . 13 1 1 A 41 41 THR HA H 41 5.330 4.952 0.378 1
1 457 . 13 1 1 A 41 41 THR C C 41 174.860 174.461 0.399 1
1 458 . 13 1 1 A 41 41 THR CA C 41 62.040 61.658 0.382 1
1 459 . 13 1 1 A 41 41 THR CB C 41 69.420 70.888 -1.468 1
1 461 . 13 1 1 A 41 41 THR N N 41 118.150 117.338 0.812 1
1 462 . 13 1 1 A 42 42 VAL H H 42 9.140 9.055 0.085 1
1 463 . 13 1 1 A 42 42 VAL HA H 42 4.570 5.034 -0.464 1
1 471 . 13 1 1 A 42 42 VAL C C 42 172.970 174.240 -1.270 1
1 472 . 13 1 1 A 42 42 VAL CA C 42 59.450 59.129 0.321 1
1 473 . 13 1 1 A 42 42 VAL CB C 42 35.880 35.511 0.369 1
1 476 . 13 1 1 A 42 42 VAL N N 42 122.510 120.232 2.278 1
1 477 . 13 1 1 A 43 43 ARG H H 43 8.420 8.704 -0.284 1
1 478 . 13 1 1 A 43 43 ARG HA H 43 4.750 4.874 -0.124 1
1 485 . 13 1 1 A 43 43 ARG C C 43 175.650 175.801 -0.151 1
1 486 . 13 1 1 A 43 43 ARG CA C 43 53.650 53.761 -0.111 1
1 487 . 13 1 1 A 43 43 ARG CB C 43 33.870 33.930 -0.060 1
1 490 . 13 1 1 A 43 43 ARG N N 43 120.640 122.977 -2.337 1
1 491 . 13 1 1 A 44 44 THR H H 44 8.370 8.567 -0.197 1
1 492 . 13 1 1 A 44 44 THR HA H 44 3.410 3.760 -0.350 1
1 497 . 13 1 1 A 44 44 THR C C 44 175.020 175.812 -0.792 1
1 498 . 13 1 1 A 44 44 THR CA C 44 65.660 65.027 0.633 1
1 499 . 13 1 1 A 44 44 THR CB C 44 69.400 68.337 1.063 1
1 501 . 13 1 1 A 44 44 THR N N 44 118.590 117.571 1.019 1
1 502 . 13 1 1 A 45 45 GLY H H 45 9.090 8.745 0.345 1
1 503 . 13 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 13 1 1 A 45 45 GLY HA3 H 45 4.470 4.020 0.450 1
1 505 . 13 1 1 A 45 45 GLY C C 45 174.350 173.844 0.506 1
1 506 . 13 1 1 A 45 45 GLY CA C 45 45.000 44.942 0.058 1
1 507 . 13 1 1 A 45 45 GLY N N 45 117.350 114.986 2.364 1
1 508 . 13 1 1 A 46 46 ASP H H 46 8.010 7.902 0.108 1
1 509 . 13 1 1 A 46 46 ASP HA H 46 4.470 4.618 -0.148 1
1 512 . 13 1 1 A 46 46 ASP C C 46 174.570 174.421 0.149 1
1 513 . 13 1 1 A 46 46 ASP CA C 46 55.570 55.421 0.149 1
1 514 . 13 1 1 A 46 46 ASP CB C 46 41.680 41.549 0.131 1
1 515 . 13 1 1 A 46 46 ASP N N 46 122.240 122.224 0.016 1
1 516 . 13 1 1 A 47 47 VAL H H 47 8.330 8.436 -0.106 1
1 517 . 13 1 1 A 47 47 VAL HA H 47 4.950 4.883 0.067 1
1 525 . 13 1 1 A 47 47 VAL C C 47 176.330 175.521 0.809 1
1 526 . 13 1 1 A 47 47 VAL CA C 47 61.710 60.813 0.897 1
1 527 . 13 1 1 A 47 47 VAL CB C 47 32.900 35.430 -2.530 1
1 530 . 13 1 1 A 47 47 VAL N N 47 119.860 121.570 -1.710 1
1 531 . 13 1 1 A 48 48 ILE H H 48 9.160 8.703 0.457 1
1 532 . 13 1 1 A 48 48 ILE HA H 48 4.630 5.194 -0.564 1
1 542 . 13 1 1 A 48 48 ILE C C 48 174.400 174.394 0.006 1
1 543 . 13 1 1 A 48 48 ILE CA C 48 58.990 59.303 -0.313 1
1 544 . 13 1 1 A 48 48 ILE CB C 48 41.810 42.154 -0.344 1
1 548 . 13 1 1 A 48 48 ILE N N 48 124.990 121.363 3.627 1
1 549 . 13 1 1 A 49 49 GLY H H 49 8.660 8.923 -0.263 1
1 550 . 13 1 1 A 49 49 GLY HA2 H 49 4.950 4.320 0.630 1
1 551 . 13 1 1 A 49 49 GLY HA3 H 49 3.620 4.363 -0.743 1
1 552 . 13 1 1 A 49 49 GLY C C 49 172.920 171.982 0.938 1
1 553 . 13 1 1 A 49 49 GLY CA C 49 44.580 44.396 0.184 1
1 554 . 13 1 1 A 49 49 GLY N N 49 112.060 109.309 2.751 1
1 555 . 13 1 1 A 50 50 ILE H H 50 8.810 9.006 -0.196 1
1 556 . 13 1 1 A 50 50 ILE HA H 50 4.370 4.798 -0.428 1
1 566 . 13 1 1 A 50 50 ILE C C 50 174.500 174.870 -0.370 1
1 567 . 13 1 1 A 50 50 ILE CA C 50 59.550 59.873 -0.323 1
1 568 . 13 1 1 A 50 50 ILE CB C 50 41.300 41.740 -0.440 1
1 572 . 13 1 1 A 50 50 ILE N N 50 123.220 125.065 -1.845 1
1 573 . 13 1 1 A 51 51 SER H H 51 8.540 9.003 -0.463 1
1 574 . 13 1 1 A 51 51 SER HA H 51 4.830 5.191 -0.361 1
1 577 . 13 1 1 A 51 51 SER C C 51 174.130 173.969 0.161 1
1 578 . 13 1 1 A 51 51 SER CA C 51 57.770 56.699 1.071 1
1 579 . 13 1 1 A 51 51 SER CB C 51 63.040 64.533 -1.493 1
1 580 . 13 1 1 A 51 51 SER N N 51 121.430 121.311 0.119 1
1 581 . 13 1 1 A 52 52 ILE H H 52 8.930 8.714 0.216 1
1 582 . 13 1 1 A 52 52 ILE HA H 52 4.290 4.605 -0.315 1
1 592 . 13 1 1 A 52 52 ILE C C 52 175.280 176.118 -0.838 1
1 593 . 13 1 1 A 52 52 ILE CA C 52 60.250 60.329 -0.079 1
1 594 . 13 1 1 A 52 52 ILE CB C 52 39.840 40.453 -0.613 1
1 598 . 13 1 1 A 52 52 ILE N N 52 127.060 124.629 2.431 1
1 599 . 13 1 1 A 53 53 LEU H H 53 9.380 9.502 -0.122 1
1 600 . 13 1 1 A 53 53 LEU HA H 53 3.890 4.095 -0.205 1
1 610 . 13 1 1 A 53 53 LEU C C 53 177.130 176.990 0.140 1
1 611 . 13 1 1 A 53 53 LEU CA C 53 55.560 56.206 -0.646 1
1 612 . 13 1 1 A 53 53 LEU CB C 53 39.370 40.681 -1.311 1
1 616 . 13 1 1 A 53 53 LEU N N 53 126.770 129.987 -3.217 1
1 617 . 13 1 1 A 54 54 GLY H H 54 8.310 8.713 -0.403 1
1 618 . 13 1 1 A 54 54 GLY HA2 H 54 3.490 3.899 -0.409 1
1 619 . 13 1 1 A 54 54 GLY HA3 H 54 4.080 3.901 0.179 1
1 620 . 13 1 1 A 54 54 GLY C C 54 173.690 173.975 -0.285 1
1 621 . 13 1 1 A 54 54 GLY CA C 54 45.340 45.785 -0.445 1
1 622 . 13 1 1 A 54 54 GLY N N 54 103.820 104.389 -0.569 1
1 623 . 13 1 1 A 55 55 LYS H H 55 7.730 7.895 -0.165 1
1 624 . 13 1 1 A 55 55 LYS HA H 55 4.560 4.786 -0.226 1
1 633 . 13 1 1 A 55 55 LYS C C 55 174.550 175.330 -0.780 1
1 634 . 13 1 1 A 55 55 LYS CA C 55 54.140 55.025 -0.885 1
1 635 . 13 1 1 A 55 55 LYS CB C 55 34.620 35.341 -0.721 1
1 639 . 13 1 1 A 55 55 LYS N N 55 121.160 120.469 0.691 1
1 640 . 13 1 1 A 56 56 GLU H H 56 8.490 8.845 -0.355 1
1 641 . 13 1 1 A 56 56 GLU HA H 56 4.280 4.694 -0.414 1
1 646 . 13 1 1 A 56 56 GLU C C 56 175.730 175.200 0.530 1
1 647 . 13 1 1 A 56 56 GLU CA C 56 56.730 56.330 0.400 1
1 648 . 13 1 1 A 56 56 GLU CB C 56 30.070 30.717 -0.647 1
1 650 . 13 1 1 A 56 56 GLU N N 56 124.090 128.621 -4.531 1
1 651 . 13 1 1 A 57 57 VAL H H 57 8.920 8.372 0.548 1
1 652 . 13 1 1 A 57 57 VAL HA H 57 4.030 4.782 -0.752 1
1 660 . 13 1 1 A 57 57 VAL C C 57 174.610 173.700 0.910 1
1 661 . 13 1 1 A 57 57 VAL CA C 57 61.680 59.591 2.089 1
1 662 . 13 1 1 A 57 57 VAL CB C 57 33.880 34.577 -0.697 1
1 665 . 13 1 1 A 57 57 VAL N N 57 129.960 126.427 3.533 1
1 666 . 13 1 1 A 58 58 LYS H H 58 7.860 8.697 -0.837 1
1 667 . 13 1 1 A 58 58 LYS HA H 58 5.120 4.806 0.314 1
1 676 . 13 1 1 A 58 58 LYS C C 58 175.380 175.823 -0.443 1
1 677 . 13 1 1 A 58 58 LYS CA C 58 55.200 54.982 0.218 1
1 678 . 13 1 1 A 58 58 LYS CB C 58 34.670 34.330 0.340 1
1 682 . 13 1 1 A 58 58 LYS N N 58 124.790 127.364 -2.574 1
1 683 . 13 1 1 A 59 59 PHE H H 59 9.270 9.122 0.148 1
1 684 . 13 1 1 A 59 59 PHE HA H 59 4.960 5.192 -0.232 1
1 692 . 13 1 1 A 59 59 PHE C C 59 173.950 174.282 -0.332 1
1 693 . 13 1 1 A 59 59 PHE CA C 59 55.910 56.337 -0.427 1
1 694 . 13 1 1 A 59 59 PHE CB C 59 42.950 42.154 0.796 1
1 700 . 13 1 1 A 59 59 PHE N N 59 118.270 122.641 -4.371 1
1 701 . 13 1 1 A 60 60 LYS H H 60 9.170 8.906 0.264 1
1 702 . 13 1 1 A 60 60 LYS HA H 60 4.910 5.003 -0.093 1
1 711 . 13 1 1 A 60 60 LYS C C 60 176.230 175.855 0.375 1
1 712 . 13 1 1 A 60 60 LYS CA C 60 53.910 54.511 -0.601 1
1 713 . 13 1 1 A 60 60 LYS CB C 60 35.170 35.113 0.057 1
1 717 . 13 1 1 A 60 60 LYS N N 60 121.960 124.153 -2.193 1
1 718 . 13 1 1 A 61 61 VAL H H 61 9.400 8.817 0.583 1
1 719 . 13 1 1 A 61 61 VAL HA H 61 4.170 4.064 0.106 1
1 727 . 13 1 1 A 61 61 VAL C C 61 175.500 175.396 0.104 1
1 728 . 13 1 1 A 61 61 VAL CA C 61 61.980 63.281 -1.301 1
1 729 . 13 1 1 A 61 61 VAL CB C 61 29.490 31.186 -1.696 1
1 732 . 13 1 1 A 61 61 VAL N N 61 127.140 126.952 0.188 1
1 733 . 13 1 1 A 62 62 VAL H H 62 8.390 8.830 -0.440 1
1 734 . 13 1 1 A 62 62 VAL HA H 62 3.650 3.973 -0.323 1
1 742 . 13 1 1 A 62 62 VAL C C 62 176.440 176.029 0.411 1
1 743 . 13 1 1 A 62 62 VAL CA C 62 64.930 64.445 0.485 1
1 744 . 13 1 1 A 62 62 VAL CB C 62 32.130 32.442 -0.312 1
1 747 . 13 1 1 A 62 62 VAL N N 62 132.840 129.404 3.436 1
1 748 . 13 1 1 A 63 63 GLN H H 63 7.470 7.167 0.303 1
1 749 . 13 1 1 A 63 63 GLN HA H 63 4.270 4.473 -0.203 1
1 756 . 13 1 1 A 63 63 GLN C C 63 172.290 173.427 -1.137 1
1 757 . 13 1 1 A 63 63 GLN CA C 63 56.640 55.524 1.116 1
1 758 . 13 1 1 A 63 63 GLN CB C 63 32.630 32.111 0.519 1
1 760 . 13 1 1 A 63 63 GLN N N 63 114.500 116.845 -2.345 1
1 762 . 13 1 1 A 64 64 ALA H H 64 8.200 8.449 -0.249 1
1 763 . 13 1 1 A 64 64 ALA HA H 64 4.830 5.298 -0.468 1
1 767 . 13 1 1 A 64 64 ALA C C 64 174.270 175.706 -1.436 1
1 768 . 13 1 1 A 64 64 ALA CA C 64 50.800 49.978 0.822 1
1 769 . 13 1 1 A 64 64 ALA CB C 64 20.100 21.347 -1.247 1
1 770 . 13 1 1 A 64 64 ALA N N 64 131.410 128.187 3.223 1
1 771 . 13 1 1 A 65 65 TYR H H 65 8.860 8.496 0.364 1
1 772 . 13 1 1 A 65 65 TYR HA H 65 4.540 5.003 -0.463 1
1 779 . 13 1 1 A 65 65 TYR CA C 65 54.270 55.011 -0.741 1
1 780 . 13 1 1 A 65 65 TYR CB C 65 41.360 40.337 1.023 1
1 785 . 13 1 1 A 65 65 TYR N N 65 124.140 120.185 3.955 1
1 786 . 13 1 1 A 66 66 PRO HA H 66 4.120 4.746 -0.626 1
1 793 . 13 1 1 A 66 66 PRO CA C 66 63.450 62.364 1.086 1
1 794 . 13 1 1 A 66 66 PRO CB C 66 34.170 32.800 1.370 1
1 797 . 13 1 1 A 67 67 SER H H 67 7.380 8.245 -0.865 1
1 798 . 13 1 1 A 67 67 SER HA H 67 4.720 4.975 -0.255 1
1 801 . 13 1 1 A 67 67 SER CA C 67 54.250 56.030 -1.780 1
1 802 . 13 1 1 A 67 67 SER CB C 67 64.530 63.930 0.600 1
1 803 . 13 1 1 A 67 67 SER N N 67 106.200 116.839 -10.639 1
1 804 . 13 1 1 A 68 68 PRO HA H 68 4.880 4.685 0.195 1
1 811 . 13 1 1 A 68 68 PRO CA C 68 62.990 62.469 0.521 1
1 812 . 13 1 1 A 68 68 PRO CB C 68 35.220 33.252 1.968 1
1 815 . 13 1 1 A 69 69 LEU H H 69 8.960 7.890 1.070 1
1 816 . 13 1 1 A 69 69 LEU HA H 69 4.430 5.074 -0.644 1
1 826 . 13 1 1 A 69 69 LEU C C 69 174.570 175.295 -0.725 1
1 827 . 13 1 1 A 69 69 LEU CA C 69 53.900 52.670 1.230 1
1 828 . 13 1 1 A 69 69 LEU CB C 69 44.210 45.954 -1.744 1
1 832 . 13 1 1 A 69 69 LEU N N 69 120.480 116.765 3.715 1
1 833 . 13 1 1 A 70 70 ARG H H 70 8.130 8.379 -0.249 1
1 834 . 13 1 1 A 70 70 ARG HA H 70 4.930 4.763 0.167 1
1 841 . 13 1 1 A 70 70 ARG C C 70 175.460 176.133 -0.673 1
1 842 . 13 1 1 A 70 70 ARG CA C 70 54.040 55.450 -1.410 1
1 843 . 13 1 1 A 70 70 ARG CB C 70 30.550 31.919 -1.369 1
1 846 . 13 1 1 A 70 70 ARG N N 70 125.180 119.654 5.526 1
1 847 . 13 1 1 A 71 71 VAL H H 71 8.450 8.267 0.183 1
1 848 . 13 1 1 A 71 71 VAL HA H 71 3.410 4.439 -1.029 1
1 856 . 13 1 1 A 71 71 VAL C C 71 175.460 175.499 -0.039 1
1 857 . 13 1 1 A 71 71 VAL CA C 71 65.210 62.209 3.001 1
1 858 . 13 1 1 A 71 71 VAL CB C 71 29.840 31.588 -1.748 1
1 861 . 13 1 1 A 71 71 VAL N N 71 128.170 122.518 5.652 1
1 862 . 13 1 1 A 72 72 GLU H H 72 8.620 8.475 0.145 1
1 863 . 13 1 1 A 72 72 GLU HA H 72 4.870 4.849 0.021 1
1 868 . 13 1 1 A 72 72 GLU C C 72 176.960 176.807 0.153 1
1 869 . 13 1 1 A 72 72 GLU CA C 72 54.330 54.434 -0.104 1
1 870 . 13 1 1 A 72 72 GLU CB C 72 33.280 33.090 0.190 1
1 872 . 13 1 1 A 72 72 GLU N N 72 127.670 127.046 0.624 1
1 873 . 13 1 1 A 73 73 ASP H H 73 8.700 9.034 -0.334 1
1 874 . 13 1 1 A 73 73 ASP HA H 73 4.150 4.367 -0.217 1
1 877 . 13 1 1 A 73 73 ASP C C 73 177.460 178.010 -0.550 1
1 878 . 13 1 1 A 73 73 ASP CA C 73 57.620 56.683 0.937 1
1 879 . 13 1 1 A 73 73 ASP CB C 73 40.360 39.816 0.544 1
1 880 . 13 1 1 A 73 73 ASP N N 73 121.140 123.912 -2.772 1
1 881 . 13 1 1 A 74 74 ARG H H 74 7.760 7.724 0.036 1
1 882 . 13 1 1 A 74 74 ARG HA H 74 4.280 4.351 -0.071 1
1 889 . 13 1 1 A 74 74 ARG C C 74 176.510 176.785 -0.275 1
1 890 . 13 1 1 A 74 74 ARG CA C 74 55.450 56.868 -1.418 1
1 891 . 13 1 1 A 74 74 ARG CB C 74 29.990 30.836 -0.846 1
1 894 . 13 1 1 A 74 74 ARG N N 74 112.890 117.046 -4.156 1
1 895 . 13 1 1 A 75 75 THR H H 75 7.700 7.421 0.279 1
1 896 . 13 1 1 A 75 75 THR HA H 75 4.020 4.255 -0.235 1
1 901 . 13 1 1 A 75 75 THR C C 75 173.810 173.972 -0.162 1
1 902 . 13 1 1 A 75 75 THR CA C 75 64.060 63.576 0.484 1
1 903 . 13 1 1 A 75 75 THR CB C 75 69.350 69.977 -0.627 1
1 905 . 13 1 1 A 75 75 THR N N 75 120.650 116.659 3.991 1
1 906 . 13 1 1 A 76 76 LYS H H 76 8.520 8.209 0.311 1
1 907 . 13 1 1 A 76 76 LYS HA H 76 4.270 4.664 -0.394 1
1 916 . 13 1 1 A 76 76 LYS C C 76 174.560 175.898 -1.338 1
1 917 . 13 1 1 A 76 76 LYS CA C 76 56.280 56.157 0.123 1
1 918 . 13 1 1 A 76 76 LYS CB C 76 33.120 33.545 -0.425 1
1 922 . 13 1 1 A 76 76 LYS N N 76 130.950 126.808 4.142 1
1 923 . 13 1 1 A 77 77 ILE H H 77 8.430 8.752 -0.322 1
1 924 . 13 1 1 A 77 77 ILE HA H 77 4.850 5.182 -0.332 1
1 934 . 13 1 1 A 77 77 ILE C C 77 174.650 174.798 -0.148 1
1 935 . 13 1 1 A 77 77 ILE CA C 77 59.820 60.189 -0.369 1
1 936 . 13 1 1 A 77 77 ILE CB C 77 38.280 40.768 -2.488 1
1 940 . 13 1 1 A 77 77 ILE N N 77 128.020 123.370 4.650 1
1 941 . 13 1 1 A 78 78 THR H H 78 8.870 8.786 0.084 1
1 942 . 13 1 1 A 78 78 THR HA H 78 4.470 5.103 -0.633 1
1 947 . 13 1 1 A 78 78 THR C C 78 172.760 173.552 -0.792 1
1 948 . 13 1 1 A 78 78 THR CA C 78 60.740 61.449 -0.709 1
1 949 . 13 1 1 A 78 78 THR CB C 78 71.320 71.291 0.029 1
1 951 . 13 1 1 A 78 78 THR N N 78 123.870 124.162 -0.292 1
1 952 . 13 1 1 A 79 79 LEU H H 79 8.820 8.958 -0.138 1
1 953 . 13 1 1 A 79 79 LEU HA H 79 5.140 5.079 0.061 1
1 963 . 13 1 1 A 79 79 LEU C C 79 176.610 176.008 0.602 1
1 964 . 13 1 1 A 79 79 LEU CA C 79 53.280 53.423 -0.143 1
1 965 . 13 1 1 A 79 79 LEU CB C 79 42.600 42.577 0.023 1
1 969 . 13 1 1 A 79 79 LEU N N 79 127.070 126.780 0.290 1
1 970 . 13 1 1 A 80 80 VAL H H 80 8.800 8.713 0.087 1
1 971 . 13 1 1 A 80 80 VAL HA H 80 4.260 4.745 -0.485 1
1 979 . 13 1 1 A 80 80 VAL CA C 80 61.350 61.434 -0.084 1
1 980 . 13 1 1 A 80 80 VAL CB C 80 32.790 33.178 -0.388 1
1 983 . 13 1 1 A 80 80 VAL N N 80 124.120 125.125 -1.005 1
1 984 . 13 1 1 A 81 81 THR H H 81 8.160 8.816 -0.656 1
1 985 . 13 1 1 A 81 81 THR HA H 81 4.410 5.256 -0.846 1
1 990 . 13 1 1 A 81 81 THR CA C 81 60.800 60.050 0.750 1
1 991 . 13 1 1 A 81 81 THR CB C 81 69.650 72.601 -2.951 1
1 993 . 13 1 1 A 81 81 THR N N 81 114.500 116.796 -2.296 1
1 1 . 14 1 1 A 9 9 GLY H H 9 8.390 8.944 -0.554 1
1 2 . 14 1 1 A 9 9 GLY HA2 H 9 3.900 3.875 0.025 1
1 3 . 14 1 1 A 9 9 GLY HA3 H 9 3.860 3.875 -0.015 1
1 4 . 14 1 1 A 9 9 GLY CA C 9 45.150 46.989 -1.839 1
1 5 . 14 1 1 A 9 9 GLY N N 9 110.000 113.606 -3.606 1
1 6 . 14 1 1 A 10 10 VAL H H 10 7.870 7.679 0.191 1
1 7 . 14 1 1 A 10 10 VAL HA H 10 4.040 4.671 -0.631 1
1 15 . 14 1 1 A 10 10 VAL C C 10 175.880 174.672 1.208 1
1 16 . 14 1 1 A 10 10 VAL CA C 10 62.110 60.805 1.305 1
1 17 . 14 1 1 A 10 10 VAL CB C 10 32.760 35.807 -3.047 1
1 20 . 14 1 1 A 10 10 VAL N N 10 119.730 118.518 1.212 1
1 21 . 14 1 1 A 11 11 ILE H H 11 8.230 8.874 -0.644 1
1 22 . 14 1 1 A 11 11 ILE HA H 11 4.090 4.785 -0.695 1
1 32 . 14 1 1 A 11 11 ILE C C 11 175.850 174.703 1.147 1
1 33 . 14 1 1 A 11 11 ILE CA C 11 60.800 59.743 1.057 1
1 34 . 14 1 1 A 11 11 ILE CB C 11 38.470 39.431 -0.961 1
1 38 . 14 1 1 A 11 11 ILE N N 11 125.570 127.262 -1.692 1
1 39 . 14 1 1 A 12 12 MET H H 12 8.370 8.836 -0.466 1
1 40 . 14 1 1 A 12 12 MET HA H 12 4.540 4.941 -0.401 1
1 48 . 14 1 1 A 12 12 MET C C 12 174.830 175.790 -0.960 1
1 49 . 14 1 1 A 12 12 MET CA C 12 54.790 54.148 0.642 1
1 50 . 14 1 1 A 12 12 MET CB C 12 32.640 33.542 -0.902 1
1 53 . 14 1 1 A 12 12 MET N N 12 125.930 127.240 -1.310 1
1 54 . 14 1 1 A 13 13 SER H H 13 7.990 8.734 -0.744 1
1 55 . 14 1 1 A 13 13 SER HA H 13 5.030 5.369 -0.339 1
1 58 . 14 1 1 A 13 13 SER C C 13 174.330 173.856 0.474 1
1 59 . 14 1 1 A 13 13 SER CA C 13 57.320 55.780 1.540 1
1 60 . 14 1 1 A 13 13 SER CB C 13 64.790 66.201 -1.411 1
1 61 . 14 1 1 A 13 13 SER N N 13 116.400 118.113 -1.713 1
1 62 . 14 1 1 A 14 14 GLU H H 14 9.430 8.557 0.873 1
1 63 . 14 1 1 A 14 14 GLU HA H 14 5.250 5.424 -0.174 1
1 68 . 14 1 1 A 14 14 GLU C C 14 172.980 174.818 -1.838 1
1 69 . 14 1 1 A 14 14 GLU CA C 14 55.390 55.020 0.370 1
1 70 . 14 1 1 A 14 14 GLU CB C 14 33.910 34.392 -0.482 1
1 72 . 14 1 1 A 14 14 GLU N N 14 123.670 119.673 3.997 1
1 73 . 14 1 1 A 15 15 LEU H H 15 8.930 8.902 0.028 1
1 74 . 14 1 1 A 15 15 LEU HA H 15 4.870 5.081 -0.211 1
1 84 . 14 1 1 A 15 15 LEU C C 15 174.000 174.298 -0.298 1
1 85 . 14 1 1 A 15 15 LEU CA C 15 53.020 53.829 -0.809 1
1 86 . 14 1 1 A 15 15 LEU CB C 15 46.040 45.743 0.297 1
1 90 . 14 1 1 A 15 15 LEU N N 15 125.350 125.846 -0.496 1
1 91 . 14 1 1 A 16 16 LYS H H 16 8.840 8.686 0.154 1
1 92 . 14 1 1 A 16 16 LYS HA H 16 5.360 4.860 0.500 1
1 101 . 14 1 1 A 16 16 LYS C C 16 175.660 175.337 0.323 1
1 102 . 14 1 1 A 16 16 LYS CA C 16 54.940 55.616 -0.676 1
1 103 . 14 1 1 A 16 16 LYS CB C 16 34.280 33.767 0.513 1
1 107 . 14 1 1 A 16 16 LYS N N 16 124.640 126.782 -2.142 1
1 108 . 14 1 1 A 17 17 LEU H H 17 8.820 8.957 -0.137 1
1 109 . 14 1 1 A 17 17 LEU HA H 17 5.430 5.170 0.260 1
1 119 . 14 1 1 A 17 17 LEU C C 17 174.630 175.051 -0.421 1
1 120 . 14 1 1 A 17 17 LEU CA C 17 52.900 53.281 -0.381 1
1 121 . 14 1 1 A 17 17 LEU CB C 17 46.910 45.178 1.732 1
1 125 . 14 1 1 A 17 17 LEU N N 17 123.460 126.696 -3.236 1
1 126 . 14 1 1 A 18 18 LYS H H 18 9.110 8.716 0.394 1
1 127 . 14 1 1 A 18 18 LYS HA H 18 5.490 5.022 0.468 1
1 136 . 14 1 1 A 18 18 LYS CA C 18 52.270 52.935 -0.665 1
1 137 . 14 1 1 A 18 18 LYS CB C 18 37.500 36.019 1.481 1
1 141 . 14 1 1 A 18 18 LYS N N 18 122.230 123.617 -1.387 1
1 142 . 14 1 1 A 19 19 PRO HA H 19 4.100 4.917 -0.817 1
1 149 . 14 1 1 A 19 19 PRO CA C 19 62.440 62.700 -0.260 1
1 150 . 14 1 1 A 19 19 PRO CB C 19 30.640 32.376 -1.736 1
1 153 . 14 1 1 A 20 20 LEU H H 20 8.490 8.635 -0.145 1
1 154 . 14 1 1 A 20 20 LEU HA H 20 4.320 4.319 0.001 1
1 164 . 14 1 1 A 20 20 LEU CA C 20 57.680 58.665 -0.985 1
1 165 . 14 1 1 A 20 20 LEU CB C 20 38.760 41.741 -2.981 1
1 169 . 14 1 1 A 20 20 LEU N N 20 123.250 119.679 3.571 1
1 170 . 14 1 1 A 21 21 PRO HA H 21 4.530 4.566 -0.036 1
1 177 . 14 1 1 A 21 21 PRO CA C 21 62.880 62.582 0.298 1
1 178 . 14 1 1 A 21 21 PRO CB C 21 31.420 32.297 -0.877 1
1 181 . 14 1 1 A 22 22 LYS H H 22 8.180 8.391 -0.211 1
1 182 . 14 1 1 A 22 22 LYS HA H 22 4.110 4.567 -0.457 1
1 191 . 14 1 1 A 22 22 LYS C C 22 175.680 175.290 0.390 1
1 192 . 14 1 1 A 22 22 LYS CA C 22 56.210 55.771 0.439 1
1 193 . 14 1 1 A 22 22 LYS CB C 22 30.660 32.196 -1.536 1
1 197 . 14 1 1 A 22 22 LYS N N 22 119.160 121.753 -2.593 1
1 198 . 14 1 1 A 23 23 VAL H H 23 7.530 8.054 -0.524 1
1 199 . 14 1 1 A 23 23 VAL HA H 23 4.280 4.773 -0.493 1
1 207 . 14 1 1 A 23 23 VAL C C 23 173.690 173.494 0.196 1
1 208 . 14 1 1 A 23 23 VAL CA C 23 59.830 59.591 0.239 1
1 209 . 14 1 1 A 23 23 VAL CB C 23 34.550 35.593 -1.043 1
1 212 . 14 1 1 A 23 23 VAL N N 23 121.820 125.200 -3.380 1
1 213 . 14 1 1 A 24 24 GLU H H 24 8.270 8.823 -0.553 1
1 214 . 14 1 1 A 24 24 GLU HA H 24 4.330 4.838 -0.508 1
1 219 . 14 1 1 A 24 24 GLU C C 24 175.390 175.415 -0.025 1
1 220 . 14 1 1 A 24 24 GLU CA C 24 55.220 55.071 0.149 1
1 221 . 14 1 1 A 24 24 GLU CB C 24 29.970 31.625 -1.655 1
1 223 . 14 1 1 A 24 24 GLU N N 24 125.610 127.003 -1.393 1
1 224 . 14 1 1 A 25 25 LEU H H 25 8.480 8.717 -0.237 1
1 225 . 14 1 1 A 25 25 LEU HA H 25 4.520 4.408 0.112 1
1 235 . 14 1 1 A 25 25 LEU CA C 25 51.660 51.044 0.616 1
1 236 . 14 1 1 A 25 25 LEU CB C 25 41.750 41.612 0.138 1
1 240 . 14 1 1 A 25 25 LEU N N 25 125.880 126.801 -0.921 1
1 241 . 14 1 1 A 26 26 PRO HA H 26 4.760 4.660 0.100 1
1 248 . 14 1 1 A 26 26 PRO CA C 26 61.330 61.931 -0.601 1
1 249 . 14 1 1 A 26 26 PRO CB C 26 31.060 32.850 -1.790 1
1 252 . 14 1 1 A 27 27 PRO HA H 27 4.390 4.401 -0.011 1
1 259 . 14 1 1 A 27 27 PRO CA C 27 64.550 64.867 -0.317 1
1 260 . 14 1 1 A 27 27 PRO CB C 27 31.770 31.737 0.033 1
1 263 . 14 1 1 A 28 28 ASP H H 28 8.560 8.827 -0.267 1
1 264 . 14 1 1 A 28 28 ASP HA H 28 4.620 4.408 0.212 1
1 267 . 14 1 1 A 28 28 ASP C C 28 177.100 178.817 -1.717 1
1 268 . 14 1 1 A 28 28 ASP CA C 28 53.890 56.479 -2.589 1
1 269 . 14 1 1 A 28 28 ASP CB C 28 39.120 39.525 -0.405 1
1 270 . 14 1 1 A 28 28 ASP N N 28 115.820 117.833 -2.013 1
1 271 . 14 1 1 A 29 29 PHE H H 29 7.940 7.906 0.034 1
1 272 . 14 1 1 A 29 29 PHE HA H 29 4.180 4.330 -0.150 1
1 280 . 14 1 1 A 29 29 PHE C C 29 176.740 178.228 -1.488 1
1 281 . 14 1 1 A 29 29 PHE CA C 29 61.020 61.011 0.009 1
1 282 . 14 1 1 A 29 29 PHE CB C 29 39.230 38.757 0.473 1
1 288 . 14 1 1 A 29 29 PHE N N 29 119.610 118.204 1.406 1
1 289 . 14 1 1 A 30 30 VAL H H 30 8.010 8.419 -0.409 1
1 290 . 14 1 1 A 30 30 VAL HA H 30 3.350 3.750 -0.400 1
1 298 . 14 1 1 A 30 30 VAL C C 30 176.400 177.147 -0.747 1
1 299 . 14 1 1 A 30 30 VAL CA C 30 66.510 64.821 1.689 1
1 300 . 14 1 1 A 30 30 VAL CB C 30 31.020 31.029 -0.009 1
1 303 . 14 1 1 A 30 30 VAL N N 30 116.370 119.475 -3.105 1
1 304 . 14 1 1 A 31 31 ASP H H 31 7.420 7.974 -0.554 1
1 305 . 14 1 1 A 31 31 ASP HA H 31 4.310 4.363 -0.053 1
1 308 . 14 1 1 A 31 31 ASP C C 31 178.360 178.906 -0.546 1
1 309 . 14 1 1 A 31 31 ASP CA C 31 57.110 57.117 -0.007 1
1 310 . 14 1 1 A 31 31 ASP CB C 31 40.450 40.867 -0.417 1
1 311 . 14 1 1 A 31 31 ASP N N 31 119.190 121.607 -2.417 1
1 312 . 14 1 1 A 32 32 VAL H H 32 7.190 7.546 -0.356 1
1 313 . 14 1 1 A 32 32 VAL HA H 32 3.510 3.559 -0.049 1
1 321 . 14 1 1 A 32 32 VAL C C 32 178.100 178.582 -0.482 1
1 322 . 14 1 1 A 32 32 VAL CA C 32 65.570 66.388 -0.818 1
1 323 . 14 1 1 A 32 32 VAL CB C 32 31.410 31.300 0.110 1
1 326 . 14 1 1 A 32 32 VAL N N 32 119.830 120.276 -0.446 1
1 327 . 14 1 1 A 33 33 ILE H H 33 7.660 8.468 -0.808 1
1 328 . 14 1 1 A 33 33 ILE HA H 33 3.170 3.572 -0.402 1
1 338 . 14 1 1 A 33 33 ILE C C 33 176.660 178.192 -1.532 1
1 339 . 14 1 1 A 33 33 ILE CA C 33 65.220 65.262 -0.042 1
1 340 . 14 1 1 A 33 33 ILE CB C 33 37.500 37.819 -0.319 1
1 344 . 14 1 1 A 33 33 ILE N N 33 118.490 120.924 -2.434 1
1 345 . 14 1 1 A 34 34 ARG H H 34 7.830 7.703 0.127 1
1 346 . 14 1 1 A 34 34 ARG HA H 34 3.380 3.939 -0.559 1
1 354 . 14 1 1 A 34 34 ARG C C 34 178.060 177.913 0.147 1
1 355 . 14 1 1 A 34 34 ARG CA C 34 60.570 59.173 1.397 1
1 356 . 14 1 1 A 34 34 ARG CB C 34 30.070 29.919 0.151 1
1 359 . 14 1 1 A 34 34 ARG N N 34 118.260 120.030 -1.770 1
1 361 . 14 1 1 A 35 35 ILE H H 35 7.350 7.928 -0.578 1
1 362 . 14 1 1 A 35 35 ILE HA H 35 3.720 3.710 0.010 1
1 372 . 14 1 1 A 35 35 ILE C C 35 179.090 178.145 0.945 1
1 373 . 14 1 1 A 35 35 ILE CA C 35 64.060 65.361 -1.301 1
1 374 . 14 1 1 A 35 35 ILE CB C 35 38.030 37.555 0.475 1
1 378 . 14 1 1 A 35 35 ILE N N 35 116.750 119.510 -2.760 1
1 379 . 14 1 1 A 36 36 LYS H H 36 7.880 7.722 0.158 1
1 380 . 14 1 1 A 36 36 LYS HA H 36 4.090 3.959 0.131 1
1 389 . 14 1 1 A 36 36 LYS C C 36 178.560 178.936 -0.376 1
1 390 . 14 1 1 A 36 36 LYS CA C 36 57.650 59.787 -2.137 1
1 391 . 14 1 1 A 36 36 LYS CB C 36 32.090 32.154 -0.064 1
1 395 . 14 1 1 A 36 36 LYS N N 36 118.700 119.765 -1.065 1
1 396 . 14 1 1 A 37 37 LEU H H 37 7.860 7.453 0.407 1
1 397 . 14 1 1 A 37 37 LEU HA H 37 4.230 4.321 -0.091 1
1 407 . 14 1 1 A 37 37 LEU C C 37 175.880 176.772 -0.892 1
1 408 . 14 1 1 A 37 37 LEU CA C 37 54.090 55.507 -1.417 1
1 409 . 14 1 1 A 37 37 LEU CB C 37 43.310 42.502 0.808 1
1 413 . 14 1 1 A 37 37 LEU N N 37 116.380 117.585 -1.205 1
1 414 . 14 1 1 A 38 38 GLN H H 38 7.190 7.485 -0.295 1
1 415 . 14 1 1 A 38 38 GLN HA H 38 3.530 4.406 -0.876 1
1 422 . 14 1 1 A 38 38 GLN C C 38 177.480 176.269 1.211 1
1 423 . 14 1 1 A 38 38 GLN CA C 38 58.370 56.745 1.625 1
1 424 . 14 1 1 A 38 38 GLN CB C 38 28.300 28.706 -0.406 1
1 426 . 14 1 1 A 38 38 GLN N N 38 119.210 117.693 1.517 1
1 428 . 14 1 1 A 39 39 GLY H H 39 8.940 8.805 0.135 1
1 429 . 14 1 1 A 39 39 GLY HA2 H 39 3.540 3.995 -0.455 1
1 430 . 14 1 1 A 39 39 GLY HA3 H 39 4.220 3.995 0.225 1
1 431 . 14 1 1 A 39 39 GLY C C 39 174.070 174.430 -0.360 1
1 432 . 14 1 1 A 39 39 GLY CA C 39 45.280 45.048 0.232 1
1 433 . 14 1 1 A 39 39 GLY N N 39 113.490 112.399 1.091 1
1 434 . 14 1 1 A 40 40 LYS H H 40 8.350 7.636 0.714 1
1 435 . 14 1 1 A 40 40 LYS HA H 40 4.400 4.603 -0.203 1
1 444 . 14 1 1 A 40 40 LYS C C 40 175.560 175.852 -0.292 1
1 445 . 14 1 1 A 40 40 LYS CA C 40 55.660 54.661 0.999 1
1 446 . 14 1 1 A 40 40 LYS CB C 40 32.870 33.752 -0.882 1
1 450 . 14 1 1 A 40 40 LYS N N 40 122.060 119.986 2.074 1
1 451 . 14 1 1 A 41 41 THR H H 41 8.410 8.588 -0.178 1
1 452 . 14 1 1 A 41 41 THR HA H 41 5.330 5.056 0.274 1
1 457 . 14 1 1 A 41 41 THR C C 41 174.860 174.331 0.529 1
1 458 . 14 1 1 A 41 41 THR CA C 41 62.040 61.665 0.375 1
1 459 . 14 1 1 A 41 41 THR CB C 41 69.420 70.916 -1.496 1
1 461 . 14 1 1 A 41 41 THR N N 41 118.150 117.217 0.933 1
1 462 . 14 1 1 A 42 42 VAL H H 42 9.140 9.122 0.018 1
1 463 . 14 1 1 A 42 42 VAL HA H 42 4.570 5.038 -0.468 1
1 471 . 14 1 1 A 42 42 VAL C C 42 172.970 173.555 -0.585 1
1 472 . 14 1 1 A 42 42 VAL CA C 42 59.450 59.227 0.223 1
1 473 . 14 1 1 A 42 42 VAL CB C 42 35.880 35.455 0.425 1
1 476 . 14 1 1 A 42 42 VAL N N 42 122.510 119.975 2.535 1
1 477 . 14 1 1 A 43 43 ARG H H 43 8.420 8.703 -0.283 1
1 478 . 14 1 1 A 43 43 ARG HA H 43 4.750 4.958 -0.208 1
1 485 . 14 1 1 A 43 43 ARG C C 43 175.650 174.904 0.746 1
1 486 . 14 1 1 A 43 43 ARG CA C 43 53.650 54.143 -0.493 1
1 487 . 14 1 1 A 43 43 ARG CB C 43 33.870 33.961 -0.091 1
1 490 . 14 1 1 A 43 43 ARG N N 43 120.640 122.770 -2.130 1
1 491 . 14 1 1 A 44 44 THR H H 44 8.370 8.568 -0.198 1
1 492 . 14 1 1 A 44 44 THR HA H 44 3.410 3.753 -0.343 1
1 497 . 14 1 1 A 44 44 THR C C 44 175.020 175.810 -0.790 1
1 498 . 14 1 1 A 44 44 THR CA C 44 65.660 65.005 0.655 1
1 499 . 14 1 1 A 44 44 THR CB C 44 69.400 68.333 1.067 1
1 501 . 14 1 1 A 44 44 THR N N 44 118.590 119.467 -0.877 1
1 502 . 14 1 1 A 45 45 GLY H H 45 9.090 8.789 0.301 1
1 503 . 14 1 1 A 45 45 GLY HA2 H 45 3.470 4.012 -0.542 1
1 504 . 14 1 1 A 45 45 GLY HA3 H 45 4.470 4.015 0.455 1
1 505 . 14 1 1 A 45 45 GLY C C 45 174.350 173.839 0.511 1
1 506 . 14 1 1 A 45 45 GLY CA C 45 45.000 44.938 0.062 1
1 507 . 14 1 1 A 45 45 GLY N N 45 117.350 114.957 2.393 1
1 508 . 14 1 1 A 46 46 ASP H H 46 8.010 7.874 0.136 1
1 509 . 14 1 1 A 46 46 ASP HA H 46 4.470 4.624 -0.154 1
1 512 . 14 1 1 A 46 46 ASP C C 46 174.570 174.402 0.168 1
1 513 . 14 1 1 A 46 46 ASP CA C 46 55.570 55.434 0.136 1
1 514 . 14 1 1 A 46 46 ASP CB C 46 41.680 41.523 0.157 1
1 515 . 14 1 1 A 46 46 ASP N N 46 122.240 122.233 0.007 1
1 516 . 14 1 1 A 47 47 VAL H H 47 8.330 8.446 -0.116 1
1 517 . 14 1 1 A 47 47 VAL HA H 47 4.950 4.951 -0.001 1
1 525 . 14 1 1 A 47 47 VAL C C 47 176.330 175.327 1.003 1
1 526 . 14 1 1 A 47 47 VAL CA C 47 61.710 60.932 0.778 1
1 527 . 14 1 1 A 47 47 VAL CB C 47 32.900 34.860 -1.960 1
1 530 . 14 1 1 A 47 47 VAL N N 47 119.860 121.780 -1.920 1
1 531 . 14 1 1 A 48 48 ILE H H 48 9.160 8.696 0.464 1
1 532 . 14 1 1 A 48 48 ILE HA H 48 4.630 5.048 -0.418 1
1 542 . 14 1 1 A 48 48 ILE C C 48 174.400 174.309 0.091 1
1 543 . 14 1 1 A 48 48 ILE CA C 48 58.990 59.437 -0.447 1
1 544 . 14 1 1 A 48 48 ILE CB C 48 41.810 42.291 -0.481 1
1 548 . 14 1 1 A 48 48 ILE N N 48 124.990 121.634 3.356 1
1 549 . 14 1 1 A 49 49 GLY H H 49 8.660 8.965 -0.305 1
1 550 . 14 1 1 A 49 49 GLY HA2 H 49 4.950 4.192 0.758 1
1 551 . 14 1 1 A 49 49 GLY HA3 H 49 3.620 4.232 -0.612 1
1 552 . 14 1 1 A 49 49 GLY C C 49 172.920 171.927 0.993 1
1 553 . 14 1 1 A 49 49 GLY CA C 49 44.580 44.375 0.205 1
1 554 . 14 1 1 A 49 49 GLY N N 49 112.060 110.026 2.034 1
1 555 . 14 1 1 A 50 50 ILE H H 50 8.810 8.840 -0.030 1
1 556 . 14 1 1 A 50 50 ILE HA H 50 4.370 4.786 -0.416 1
1 566 . 14 1 1 A 50 50 ILE C C 50 174.500 174.743 -0.243 1
1 567 . 14 1 1 A 50 50 ILE CA C 50 59.550 59.879 -0.329 1
1 568 . 14 1 1 A 50 50 ILE CB C 50 41.300 41.668 -0.368 1
1 572 . 14 1 1 A 50 50 ILE N N 50 123.220 125.512 -2.292 1
1 573 . 14 1 1 A 51 51 SER H H 51 8.540 8.846 -0.306 1
1 574 . 14 1 1 A 51 51 SER HA H 51 4.830 4.986 -0.156 1
1 577 . 14 1 1 A 51 51 SER C C 51 174.130 173.866 0.264 1
1 578 . 14 1 1 A 51 51 SER CA C 51 57.770 57.113 0.657 1
1 579 . 14 1 1 A 51 51 SER CB C 51 63.040 63.986 -0.946 1
1 580 . 14 1 1 A 51 51 SER N N 51 121.430 122.502 -1.072 1
1 581 . 14 1 1 A 52 52 ILE H H 52 8.930 8.721 0.209 1
1 582 . 14 1 1 A 52 52 ILE HA H 52 4.290 4.592 -0.302 1
1 592 . 14 1 1 A 52 52 ILE C C 52 175.280 175.971 -0.691 1
1 593 . 14 1 1 A 52 52 ILE CA C 52 60.250 60.163 0.087 1
1 594 . 14 1 1 A 52 52 ILE CB C 52 39.840 40.532 -0.692 1
1 598 . 14 1 1 A 52 52 ILE N N 52 127.060 127.324 -0.264 1
1 599 . 14 1 1 A 53 53 LEU H H 53 9.380 9.440 -0.060 1
1 600 . 14 1 1 A 53 53 LEU HA H 53 3.890 4.077 -0.187 1
1 610 . 14 1 1 A 53 53 LEU C C 53 177.130 176.985 0.145 1
1 611 . 14 1 1 A 53 53 LEU CA C 53 55.560 56.191 -0.631 1
1 612 . 14 1 1 A 53 53 LEU CB C 53 39.370 40.646 -1.276 1
1 616 . 14 1 1 A 53 53 LEU N N 53 126.770 129.492 -2.722 1
1 617 . 14 1 1 A 54 54 GLY H H 54 8.310 8.691 -0.381 1
1 618 . 14 1 1 A 54 54 GLY HA2 H 54 3.490 3.897 -0.407 1
1 619 . 14 1 1 A 54 54 GLY HA3 H 54 4.080 3.899 0.181 1
1 620 . 14 1 1 A 54 54 GLY C C 54 173.690 173.774 -0.084 1
1 621 . 14 1 1 A 54 54 GLY CA C 54 45.340 45.699 -0.359 1
1 622 . 14 1 1 A 54 54 GLY N N 54 103.820 104.369 -0.549 1
1 623 . 14 1 1 A 55 55 LYS H H 55 7.730 7.858 -0.128 1
1 624 . 14 1 1 A 55 55 LYS HA H 55 4.560 4.748 -0.188 1
1 633 . 14 1 1 A 55 55 LYS C C 55 174.550 175.001 -0.451 1
1 634 . 14 1 1 A 55 55 LYS CA C 55 54.140 54.400 -0.260 1
1 635 . 14 1 1 A 55 55 LYS CB C 55 34.620 35.600 -0.980 1
1 639 . 14 1 1 A 55 55 LYS N N 55 121.160 119.819 1.341 1
1 640 . 14 1 1 A 56 56 GLU H H 56 8.490 8.802 -0.312 1
1 641 . 14 1 1 A 56 56 GLU HA H 56 4.280 4.663 -0.383 1
1 646 . 14 1 1 A 56 56 GLU C C 56 175.730 175.114 0.616 1
1 647 . 14 1 1 A 56 56 GLU CA C 56 56.730 56.367 0.363 1
1 648 . 14 1 1 A 56 56 GLU CB C 56 30.070 30.743 -0.673 1
1 650 . 14 1 1 A 56 56 GLU N N 56 124.090 125.170 -1.080 1
1 651 . 14 1 1 A 57 57 VAL H H 57 8.920 8.329 0.591 1
1 652 . 14 1 1 A 57 57 VAL HA H 57 4.030 4.720 -0.690 1
1 660 . 14 1 1 A 57 57 VAL C C 57 174.610 173.250 1.360 1
1 661 . 14 1 1 A 57 57 VAL CA C 57 61.680 59.427 2.253 1
1 662 . 14 1 1 A 57 57 VAL CB C 57 33.880 34.342 -0.462 1
1 665 . 14 1 1 A 57 57 VAL N N 57 129.960 125.973 3.987 1
1 666 . 14 1 1 A 58 58 LYS H H 58 7.860 8.593 -0.733 1
1 667 . 14 1 1 A 58 58 LYS HA H 58 5.120 4.584 0.536 1
1 676 . 14 1 1 A 58 58 LYS C C 58 175.380 175.586 -0.206 1
1 677 . 14 1 1 A 58 58 LYS CA C 58 55.200 54.684 0.516 1
1 678 . 14 1 1 A 58 58 LYS CB C 58 34.670 33.892 0.778 1
1 682 . 14 1 1 A 58 58 LYS N N 58 124.790 127.102 -2.312 1
1 683 . 14 1 1 A 59 59 PHE H H 59 9.270 8.903 0.367 1
1 684 . 14 1 1 A 59 59 PHE HA H 59 4.960 5.094 -0.134 1
1 692 . 14 1 1 A 59 59 PHE C C 59 173.950 174.354 -0.404 1
1 693 . 14 1 1 A 59 59 PHE CA C 59 55.910 56.380 -0.470 1
1 694 . 14 1 1 A 59 59 PHE CB C 59 42.950 42.030 0.920 1
1 700 . 14 1 1 A 59 59 PHE N N 59 118.270 122.876 -4.606 1
1 701 . 14 1 1 A 60 60 LYS H H 60 9.170 8.929 0.241 1
1 702 . 14 1 1 A 60 60 LYS HA H 60 4.910 4.964 -0.054 1
1 711 . 14 1 1 A 60 60 LYS C C 60 176.230 175.895 0.335 1
1 712 . 14 1 1 A 60 60 LYS CA C 60 53.910 54.529 -0.619 1
1 713 . 14 1 1 A 60 60 LYS CB C 60 35.170 34.977 0.193 1
1 717 . 14 1 1 A 60 60 LYS N N 60 121.960 124.337 -2.377 1
1 718 . 14 1 1 A 61 61 VAL H H 61 9.400 8.800 0.600 1
1 719 . 14 1 1 A 61 61 VAL HA H 61 4.170 4.034 0.136 1
1 727 . 14 1 1 A 61 61 VAL C C 61 175.500 175.344 0.156 1
1 728 . 14 1 1 A 61 61 VAL CA C 61 61.980 63.262 -1.282 1
1 729 . 14 1 1 A 61 61 VAL CB C 61 29.490 31.173 -1.683 1
1 732 . 14 1 1 A 61 61 VAL N N 61 127.140 127.025 0.115 1
1 733 . 14 1 1 A 62 62 VAL H H 62 8.390 8.665 -0.275 1
1 734 . 14 1 1 A 62 62 VAL HA H 62 3.650 3.957 -0.307 1
1 742 . 14 1 1 A 62 62 VAL C C 62 176.440 176.047 0.393 1
1 743 . 14 1 1 A 62 62 VAL CA C 62 64.930 64.410 0.520 1
1 744 . 14 1 1 A 62 62 VAL CB C 62 32.130 32.402 -0.272 1
1 747 . 14 1 1 A 62 62 VAL N N 62 132.840 129.266 3.574 1
1 748 . 14 1 1 A 63 63 GLN H H 63 7.470 7.099 0.371 1
1 749 . 14 1 1 A 63 63 GLN HA H 63 4.270 4.580 -0.310 1
1 756 . 14 1 1 A 63 63 GLN C C 63 172.290 173.340 -1.050 1
1 757 . 14 1 1 A 63 63 GLN CA C 63 56.640 55.444 1.196 1
1 758 . 14 1 1 A 63 63 GLN CB C 63 32.630 31.900 0.730 1
1 760 . 14 1 1 A 63 63 GLN N N 63 114.500 116.857 -2.357 1
1 762 . 14 1 1 A 64 64 ALA H H 64 8.200 8.630 -0.430 1
1 763 . 14 1 1 A 64 64 ALA HA H 64 4.830 5.326 -0.496 1
1 767 . 14 1 1 A 64 64 ALA C C 64 174.270 175.659 -1.389 1
1 768 . 14 1 1 A 64 64 ALA CA C 64 50.800 49.987 0.813 1
1 769 . 14 1 1 A 64 64 ALA CB C 64 20.100 21.860 -1.760 1
1 770 . 14 1 1 A 64 64 ALA N N 64 131.410 128.780 2.630 1
1 771 . 14 1 1 A 65 65 TYR H H 65 8.860 8.532 0.328 1
1 772 . 14 1 1 A 65 65 TYR HA H 65 4.540 4.919 -0.379 1
1 779 . 14 1 1 A 65 65 TYR CA C 65 54.270 55.165 -0.895 1
1 780 . 14 1 1 A 65 65 TYR CB C 65 41.360 40.907 0.453 1
1 785 . 14 1 1 A 65 65 TYR N N 65 124.140 119.805 4.335 1
1 786 . 14 1 1 A 66 66 PRO HA H 66 4.120 4.746 -0.626 1
1 793 . 14 1 1 A 66 66 PRO CA C 66 63.450 62.359 1.091 1
1 794 . 14 1 1 A 66 66 PRO CB C 66 34.170 32.811 1.359 1
1 797 . 14 1 1 A 67 67 SER H H 67 7.380 8.241 -0.861 1
1 798 . 14 1 1 A 67 67 SER HA H 67 4.720 4.979 -0.259 1
1 801 . 14 1 1 A 67 67 SER CA C 67 54.250 56.057 -1.807 1
1 802 . 14 1 1 A 67 67 SER CB C 67 64.530 63.744 0.786 1
1 803 . 14 1 1 A 67 67 SER N N 67 106.200 116.674 -10.474 1
1 804 . 14 1 1 A 68 68 PRO HA H 68 4.880 4.654 0.226 1
1 811 . 14 1 1 A 68 68 PRO CA C 68 62.990 62.503 0.487 1
1 812 . 14 1 1 A 68 68 PRO CB C 68 35.220 33.154 2.066 1
1 815 . 14 1 1 A 69 69 LEU H H 69 8.960 8.019 0.941 1
1 816 . 14 1 1 A 69 69 LEU HA H 69 4.430 5.117 -0.687 1
1 826 . 14 1 1 A 69 69 LEU C C 69 174.570 175.291 -0.721 1
1 827 . 14 1 1 A 69 69 LEU CA C 69 53.900 52.588 1.312 1
1 828 . 14 1 1 A 69 69 LEU CB C 69 44.210 46.123 -1.913 1
1 832 . 14 1 1 A 69 69 LEU N N 69 120.480 117.088 3.392 1
1 833 . 14 1 1 A 70 70 ARG H H 70 8.130 8.379 -0.249 1
1 834 . 14 1 1 A 70 70 ARG HA H 70 4.930 4.793 0.137 1
1 841 . 14 1 1 A 70 70 ARG C C 70 175.460 176.372 -0.912 1
1 842 . 14 1 1 A 70 70 ARG CA C 70 54.040 55.674 -1.634 1
1 843 . 14 1 1 A 70 70 ARG CB C 70 30.550 31.738 -1.188 1
1 846 . 14 1 1 A 70 70 ARG N N 70 125.180 119.861 5.319 1
1 847 . 14 1 1 A 71 71 VAL H H 71 8.450 8.304 0.146 1
1 848 . 14 1 1 A 71 71 VAL HA H 71 3.410 4.439 -1.029 1
1 856 . 14 1 1 A 71 71 VAL C C 71 175.460 175.481 -0.021 1
1 857 . 14 1 1 A 71 71 VAL CA C 71 65.210 62.294 2.916 1
1 858 . 14 1 1 A 71 71 VAL CB C 71 29.840 31.541 -1.701 1
1 861 . 14 1 1 A 71 71 VAL N N 71 128.170 122.870 5.300 1
1 862 . 14 1 1 A 72 72 GLU H H 72 8.620 8.496 0.124 1
1 863 . 14 1 1 A 72 72 GLU HA H 72 4.870 4.826 0.044 1
1 868 . 14 1 1 A 72 72 GLU C C 72 176.960 175.858 1.102 1
1 869 . 14 1 1 A 72 72 GLU CA C 72 54.330 54.440 -0.110 1
1 870 . 14 1 1 A 72 72 GLU CB C 72 33.280 33.193 0.087 1
1 872 . 14 1 1 A 72 72 GLU N N 72 127.670 127.049 0.621 1
1 873 . 14 1 1 A 73 73 ASP H H 73 8.700 8.964 -0.264 1
1 874 . 14 1 1 A 73 73 ASP HA H 73 4.150 4.267 -0.117 1
1 877 . 14 1 1 A 73 73 ASP C C 73 177.460 178.117 -0.657 1
1 878 . 14 1 1 A 73 73 ASP CA C 73 57.620 56.724 0.896 1
1 879 . 14 1 1 A 73 73 ASP CB C 73 40.360 40.531 -0.171 1
1 880 . 14 1 1 A 73 73 ASP N N 73 121.140 124.462 -3.322 1
1 881 . 14 1 1 A 74 74 ARG H H 74 7.760 7.731 0.029 1
1 882 . 14 1 1 A 74 74 ARG HA H 74 4.280 4.343 -0.063 1
1 889 . 14 1 1 A 74 74 ARG C C 74 176.510 176.711 -0.201 1
1 890 . 14 1 1 A 74 74 ARG CA C 74 55.450 56.819 -1.369 1
1 891 . 14 1 1 A 74 74 ARG CB C 74 29.990 30.808 -0.818 1
1 894 . 14 1 1 A 74 74 ARG N N 74 112.890 116.812 -3.922 1
1 895 . 14 1 1 A 75 75 THR H H 75 7.700 7.425 0.275 1
1 896 . 14 1 1 A 75 75 THR HA H 75 4.020 4.236 -0.216 1
1 901 . 14 1 1 A 75 75 THR C C 75 173.810 173.941 -0.131 1
1 902 . 14 1 1 A 75 75 THR CA C 75 64.060 64.063 -0.003 1
1 903 . 14 1 1 A 75 75 THR CB C 75 69.350 69.448 -0.098 1
1 905 . 14 1 1 A 75 75 THR N N 75 120.650 116.495 4.155 1
1 906 . 14 1 1 A 76 76 LYS H H 76 8.520 8.264 0.256 1
1 907 . 14 1 1 A 76 76 LYS HA H 76 4.270 4.682 -0.412 1
1 916 . 14 1 1 A 76 76 LYS C C 76 174.560 175.807 -1.247 1
1 917 . 14 1 1 A 76 76 LYS CA C 76 56.280 55.976 0.304 1
1 918 . 14 1 1 A 76 76 LYS CB C 76 33.120 33.624 -0.504 1
1 922 . 14 1 1 A 76 76 LYS N N 76 130.950 127.401 3.549 1
1 923 . 14 1 1 A 77 77 ILE H H 77 8.430 8.670 -0.240 1
1 924 . 14 1 1 A 77 77 ILE HA H 77 4.850 5.135 -0.285 1
1 934 . 14 1 1 A 77 77 ILE C C 77 174.650 175.085 -0.435 1
1 935 . 14 1 1 A 77 77 ILE CA C 77 59.820 60.063 -0.243 1
1 936 . 14 1 1 A 77 77 ILE CB C 77 38.280 40.820 -2.540 1
1 940 . 14 1 1 A 77 77 ILE N N 77 128.020 123.712 4.308 1
1 941 . 14 1 1 A 78 78 THR H H 78 8.870 8.786 0.084 1
1 942 . 14 1 1 A 78 78 THR HA H 78 4.470 5.121 -0.651 1
1 947 . 14 1 1 A 78 78 THR C C 78 172.760 172.931 -0.171 1
1 948 . 14 1 1 A 78 78 THR CA C 78 60.740 61.282 -0.542 1
1 949 . 14 1 1 A 78 78 THR CB C 78 71.320 72.022 -0.702 1
1 951 . 14 1 1 A 78 78 THR N N 78 123.870 123.734 0.136 1
1 952 . 14 1 1 A 79 79 LEU H H 79 8.820 8.901 -0.081 1
1 953 . 14 1 1 A 79 79 LEU HA H 79 5.140 5.035 0.105 1
1 963 . 14 1 1 A 79 79 LEU C C 79 176.610 175.888 0.722 1
1 964 . 14 1 1 A 79 79 LEU CA C 79 53.280 53.310 -0.030 1
1 965 . 14 1 1 A 79 79 LEU CB C 79 42.600 42.882 -0.282 1
1 969 . 14 1 1 A 79 79 LEU N N 79 127.070 126.354 0.716 1
1 970 . 14 1 1 A 80 80 VAL H H 80 8.800 8.523 0.277 1
1 971 . 14 1 1 A 80 80 VAL HA H 80 4.260 4.718 -0.458 1
1 979 . 14 1 1 A 80 80 VAL CA C 80 61.350 61.625 -0.275 1
1 980 . 14 1 1 A 80 80 VAL CB C 80 32.790 32.845 -0.055 1
1 983 . 14 1 1 A 80 80 VAL N N 80 124.120 125.494 -1.374 1
1 984 . 14 1 1 A 81 81 THR H H 81 8.160 8.782 -0.622 1
1 985 . 14 1 1 A 81 81 THR HA H 81 4.410 5.275 -0.865 1
1 990 . 14 1 1 A 81 81 THR CA C 81 60.800 60.188 0.612 1
1 991 . 14 1 1 A 81 81 THR CB C 81 69.650 72.549 -2.899 1
1 993 . 14 1 1 A 81 81 THR N N 81 114.500 116.743 -2.243 1
1 1 . 15 1 1 A 9 9 GLY H H 9 8.390 8.815 -0.425 1
1 2 . 15 1 1 A 9 9 GLY HA2 H 9 3.900 3.978 -0.078 1
1 3 . 15 1 1 A 9 9 GLY HA3 H 9 3.860 3.978 -0.118 1
1 4 . 15 1 1 A 9 9 GLY CA C 9 45.150 45.064 0.086 1
1 5 . 15 1 1 A 9 9 GLY N N 9 110.000 111.732 -1.732 1
1 6 . 15 1 1 A 10 10 VAL H H 10 7.870 7.612 0.258 1
1 7 . 15 1 1 A 10 10 VAL HA H 10 4.040 4.096 -0.056 1
1 15 . 15 1 1 A 10 10 VAL C C 10 175.880 175.489 0.391 1
1 16 . 15 1 1 A 10 10 VAL CA C 10 62.110 62.484 -0.374 1
1 17 . 15 1 1 A 10 10 VAL CB C 10 32.760 32.106 0.654 1
1 20 . 15 1 1 A 10 10 VAL N N 10 119.730 120.133 -0.403 1
1 21 . 15 1 1 A 11 11 ILE H H 11 8.230 9.134 -0.904 1
1 22 . 15 1 1 A 11 11 ILE HA H 11 4.090 4.684 -0.594 1
1 32 . 15 1 1 A 11 11 ILE C C 11 175.850 174.807 1.043 1
1 33 . 15 1 1 A 11 11 ILE CA C 11 60.800 59.567 1.233 1
1 34 . 15 1 1 A 11 11 ILE CB C 11 38.470 41.588 -3.118 1
1 38 . 15 1 1 A 11 11 ILE N N 11 125.570 128.303 -2.733 1
1 39 . 15 1 1 A 12 12 MET H H 12 8.370 8.871 -0.501 1
1 40 . 15 1 1 A 12 12 MET HA H 12 4.540 4.905 -0.365 1
1 48 . 15 1 1 A 12 12 MET C C 12 174.830 175.894 -1.064 1
1 49 . 15 1 1 A 12 12 MET CA C 12 54.790 54.244 0.546 1
1 50 . 15 1 1 A 12 12 MET CB C 12 32.640 33.441 -0.801 1
1 53 . 15 1 1 A 12 12 MET N N 12 125.930 126.259 -0.329 1
1 54 . 15 1 1 A 13 13 SER H H 13 7.990 8.822 -0.832 1
1 55 . 15 1 1 A 13 13 SER HA H 13 5.030 5.492 -0.462 1
1 58 . 15 1 1 A 13 13 SER C C 13 174.330 173.281 1.049 1
1 59 . 15 1 1 A 13 13 SER CA C 13 57.320 56.121 1.199 1
1 60 . 15 1 1 A 13 13 SER CB C 13 64.790 66.481 -1.691 1
1 61 . 15 1 1 A 13 13 SER N N 13 116.400 117.542 -1.142 1
1 62 . 15 1 1 A 14 14 GLU H H 14 9.430 8.776 0.654 1
1 63 . 15 1 1 A 14 14 GLU HA H 14 5.250 5.134 0.116 1
1 68 . 15 1 1 A 14 14 GLU C C 14 172.980 173.975 -0.995 1
1 69 . 15 1 1 A 14 14 GLU CA C 14 55.390 55.270 0.120 1
1 70 . 15 1 1 A 14 14 GLU CB C 14 33.910 34.127 -0.217 1
1 72 . 15 1 1 A 14 14 GLU N N 14 123.670 121.846 1.824 1
1 73 . 15 1 1 A 15 15 LEU H H 15 8.930 9.046 -0.116 1
1 74 . 15 1 1 A 15 15 LEU HA H 15 4.870 5.080 -0.210 1
1 84 . 15 1 1 A 15 15 LEU C C 15 174.000 174.703 -0.703 1
1 85 . 15 1 1 A 15 15 LEU CA C 15 53.020 53.667 -0.647 1
1 86 . 15 1 1 A 15 15 LEU CB C 15 46.040 45.485 0.555 1
1 90 . 15 1 1 A 15 15 LEU N N 15 125.350 126.172 -0.822 1
1 91 . 15 1 1 A 16 16 LYS H H 16 8.840 8.715 0.125 1
1 92 . 15 1 1 A 16 16 LYS HA H 16 5.360 4.993 0.367 1
1 101 . 15 1 1 A 16 16 LYS C C 16 175.660 175.688 -0.028 1
1 102 . 15 1 1 A 16 16 LYS CA C 16 54.940 55.115 -0.175 1
1 103 . 15 1 1 A 16 16 LYS CB C 16 34.280 34.578 -0.298 1
1 107 . 15 1 1 A 16 16 LYS N N 16 124.640 127.123 -2.483 1
1 108 . 15 1 1 A 17 17 LEU H H 17 8.820 8.881 -0.061 1
1 109 . 15 1 1 A 17 17 LEU HA H 17 5.430 5.192 0.238 1
1 119 . 15 1 1 A 17 17 LEU C C 17 174.630 175.818 -1.188 1
1 120 . 15 1 1 A 17 17 LEU CA C 17 52.900 53.661 -0.761 1
1 121 . 15 1 1 A 17 17 LEU CB C 17 46.910 45.806 1.104 1
1 125 . 15 1 1 A 17 17 LEU N N 17 123.460 125.337 -1.877 1
1 126 . 15 1 1 A 18 18 LYS H H 18 9.110 8.616 0.494 1
1 127 . 15 1 1 A 18 18 LYS HA H 18 5.490 5.047 0.443 1
1 136 . 15 1 1 A 18 18 LYS CA C 18 52.270 53.005 -0.735 1
1 137 . 15 1 1 A 18 18 LYS CB C 18 37.500 36.426 1.074 1
1 141 . 15 1 1 A 18 18 LYS N N 18 122.230 123.421 -1.191 1
1 142 . 15 1 1 A 19 19 PRO HA H 19 4.100 4.433 -0.333 1
1 149 . 15 1 1 A 19 19 PRO CA C 19 62.440 62.437 0.003 1
1 150 . 15 1 1 A 19 19 PRO CB C 19 30.640 32.299 -1.659 1
1 153 . 15 1 1 A 20 20 LEU H H 20 8.490 8.410 0.080 1
1 154 . 15 1 1 A 20 20 LEU HA H 20 4.320 4.274 0.046 1
1 164 . 15 1 1 A 20 20 LEU CA C 20 57.680 58.581 -0.901 1
1 165 . 15 1 1 A 20 20 LEU CB C 20 38.760 41.657 -2.897 1
1 169 . 15 1 1 A 20 20 LEU N N 20 123.250 119.545 3.705 1
1 170 . 15 1 1 A 21 21 PRO HA H 21 4.530 4.516 0.014 1
1 177 . 15 1 1 A 21 21 PRO CA C 21 62.880 62.277 0.603 1
1 178 . 15 1 1 A 21 21 PRO CB C 21 31.420 32.496 -1.076 1
1 181 . 15 1 1 A 22 22 LYS H H 22 8.180 8.429 -0.249 1
1 182 . 15 1 1 A 22 22 LYS HA H 22 4.110 4.452 -0.342 1
1 191 . 15 1 1 A 22 22 LYS C C 22 175.680 175.436 0.244 1
1 192 . 15 1 1 A 22 22 LYS CA C 22 56.210 55.834 0.376 1
1 193 . 15 1 1 A 22 22 LYS CB C 22 30.660 32.020 -1.360 1
1 197 . 15 1 1 A 22 22 LYS N N 22 119.160 121.574 -2.414 1
1 198 . 15 1 1 A 23 23 VAL H H 23 7.530 8.491 -0.961 1
1 199 . 15 1 1 A 23 23 VAL HA H 23 4.280 4.826 -0.546 1
1 207 . 15 1 1 A 23 23 VAL C C 23 173.690 173.011 0.679 1
1 208 . 15 1 1 A 23 23 VAL CA C 23 59.830 59.526 0.304 1
1 209 . 15 1 1 A 23 23 VAL CB C 23 34.550 35.504 -0.954 1
1 212 . 15 1 1 A 23 23 VAL N N 23 121.820 122.879 -1.059 1
1 213 . 15 1 1 A 24 24 GLU H H 24 8.270 8.938 -0.668 1
1 214 . 15 1 1 A 24 24 GLU HA H 24 4.330 4.991 -0.661 1
1 219 . 15 1 1 A 24 24 GLU C C 24 175.390 175.243 0.147 1
1 220 . 15 1 1 A 24 24 GLU CA C 24 55.220 54.791 0.429 1
1 221 . 15 1 1 A 24 24 GLU CB C 24 29.970 31.790 -1.820 1
1 223 . 15 1 1 A 24 24 GLU N N 24 125.610 127.254 -1.644 1
1 224 . 15 1 1 A 25 25 LEU H H 25 8.480 8.818 -0.338 1
1 225 . 15 1 1 A 25 25 LEU HA H 25 4.520 4.413 0.107 1
1 235 . 15 1 1 A 25 25 LEU CA C 25 51.660 51.861 -0.201 1
1 236 . 15 1 1 A 25 25 LEU CB C 25 41.750 40.918 0.832 1
1 240 . 15 1 1 A 25 25 LEU N N 25 125.880 126.153 -0.273 1
1 241 . 15 1 1 A 26 26 PRO HA H 26 4.760 4.609 0.151 1
1 248 . 15 1 1 A 26 26 PRO CA C 26 61.330 61.886 -0.556 1
1 249 . 15 1 1 A 26 26 PRO CB C 26 31.060 32.850 -1.790 1
1 252 . 15 1 1 A 27 27 PRO HA H 27 4.390 4.413 -0.023 1
1 259 . 15 1 1 A 27 27 PRO CA C 27 64.550 64.837 -0.287 1
1 260 . 15 1 1 A 27 27 PRO CB C 27 31.770 31.737 0.033 1
1 263 . 15 1 1 A 28 28 ASP H H 28 8.560 8.779 -0.219 1
1 264 . 15 1 1 A 28 28 ASP HA H 28 4.620 4.430 0.190 1
1 267 . 15 1 1 A 28 28 ASP C C 28 177.100 178.666 -1.566 1
1 268 . 15 1 1 A 28 28 ASP CA C 28 53.890 56.298 -2.408 1
1 269 . 15 1 1 A 28 28 ASP CB C 28 39.120 39.601 -0.481 1
1 270 . 15 1 1 A 28 28 ASP N N 28 115.820 117.834 -2.014 1
1 271 . 15 1 1 A 29 29 PHE H H 29 7.940 7.906 0.034 1
1 272 . 15 1 1 A 29 29 PHE HA H 29 4.180 4.324 -0.144 1
1 280 . 15 1 1 A 29 29 PHE C C 29 176.740 178.227 -1.487 1
1 281 . 15 1 1 A 29 29 PHE CA C 29 61.020 61.006 0.014 1
1 282 . 15 1 1 A 29 29 PHE CB C 29 39.230 38.754 0.476 1
1 288 . 15 1 1 A 29 29 PHE N N 29 119.610 118.359 1.251 1
1 289 . 15 1 1 A 30 30 VAL H H 30 8.010 8.474 -0.464 1
1 290 . 15 1 1 A 30 30 VAL HA H 30 3.350 3.766 -0.416 1
1 298 . 15 1 1 A 30 30 VAL C C 30 176.400 177.141 -0.741 1
1 299 . 15 1 1 A 30 30 VAL CA C 30 66.510 64.822 1.688 1
1 300 . 15 1 1 A 30 30 VAL CB C 30 31.020 31.060 -0.040 1
1 303 . 15 1 1 A 30 30 VAL N N 30 116.370 119.478 -3.108 1
1 304 . 15 1 1 A 31 31 ASP H H 31 7.420 7.972 -0.552 1
1 305 . 15 1 1 A 31 31 ASP HA H 31 4.310 4.363 -0.053 1
1 308 . 15 1 1 A 31 31 ASP C C 31 178.360 178.887 -0.527 1
1 309 . 15 1 1 A 31 31 ASP CA C 31 57.110 57.104 0.006 1
1 310 . 15 1 1 A 31 31 ASP CB C 31 40.450 40.893 -0.443 1
1 311 . 15 1 1 A 31 31 ASP N N 31 119.190 121.569 -2.379 1
1 312 . 15 1 1 A 32 32 VAL H H 32 7.190 7.535 -0.345 1
1 313 . 15 1 1 A 32 32 VAL HA H 32 3.510 3.543 -0.033 1
1 321 . 15 1 1 A 32 32 VAL C C 32 178.100 178.540 -0.440 1
1 322 . 15 1 1 A 32 32 VAL CA C 32 65.570 66.361 -0.791 1
1 323 . 15 1 1 A 32 32 VAL CB C 32 31.410 31.285 0.125 1
1 326 . 15 1 1 A 32 32 VAL N N 32 119.830 120.253 -0.423 1
1 327 . 15 1 1 A 33 33 ILE H H 33 7.660 8.423 -0.763 1
1 328 . 15 1 1 A 33 33 ILE HA H 33 3.170 3.520 -0.350 1
1 338 . 15 1 1 A 33 33 ILE C C 33 176.660 178.159 -1.499 1
1 339 . 15 1 1 A 33 33 ILE CA C 33 65.220 65.221 -0.001 1
1 340 . 15 1 1 A 33 33 ILE CB C 33 37.500 37.776 -0.276 1
1 344 . 15 1 1 A 33 33 ILE N N 33 118.490 120.876 -2.386 1
1 345 . 15 1 1 A 34 34 ARG H H 34 7.830 7.684 0.146 1
1 346 . 15 1 1 A 34 34 ARG HA H 34 3.380 3.903 -0.523 1
1 354 . 15 1 1 A 34 34 ARG C C 34 178.060 177.520 0.540 1
1 355 . 15 1 1 A 34 34 ARG CA C 34 60.570 58.963 1.607 1
1 356 . 15 1 1 A 34 34 ARG CB C 34 30.070 29.766 0.304 1
1 359 . 15 1 1 A 34 34 ARG N N 34 118.260 119.992 -1.732 1
1 361 . 15 1 1 A 35 35 ILE H H 35 7.350 7.862 -0.512 1
1 362 . 15 1 1 A 35 35 ILE HA H 35 3.720 3.693 0.027 1
1 372 . 15 1 1 A 35 35 ILE C C 35 179.090 178.053 1.037 1
1 373 . 15 1 1 A 35 35 ILE CA C 35 64.060 65.377 -1.317 1
1 374 . 15 1 1 A 35 35 ILE CB C 35 38.030 37.336 0.694 1
1 378 . 15 1 1 A 35 35 ILE N N 35 116.750 119.392 -2.642 1
1 379 . 15 1 1 A 36 36 LYS H H 36 7.880 7.688 0.192 1
1 380 . 15 1 1 A 36 36 LYS HA H 36 4.090 3.973 0.117 1
1 389 . 15 1 1 A 36 36 LYS C C 36 178.560 178.893 -0.333 1
1 390 . 15 1 1 A 36 36 LYS CA C 36 57.650 59.891 -2.241 1
1 391 . 15 1 1 A 36 36 LYS CB C 36 32.090 32.242 -0.152 1
1 395 . 15 1 1 A 36 36 LYS N N 36 118.700 120.165 -1.465 1
1 396 . 15 1 1 A 37 37 LEU H H 37 7.860 7.421 0.439 1
1 397 . 15 1 1 A 37 37 LEU HA H 37 4.230 4.290 -0.060 1
1 407 . 15 1 1 A 37 37 LEU C C 37 175.880 176.747 -0.867 1
1 408 . 15 1 1 A 37 37 LEU CA C 37 54.090 55.402 -1.312 1
1 409 . 15 1 1 A 37 37 LEU CB C 37 43.310 42.324 0.986 1
1 413 . 15 1 1 A 37 37 LEU N N 37 116.380 117.565 -1.185 1
1 414 . 15 1 1 A 38 38 GLN H H 38 7.190 7.452 -0.262 1
1 415 . 15 1 1 A 38 38 GLN HA H 38 3.530 4.357 -0.827 1
1 422 . 15 1 1 A 38 38 GLN C C 38 177.480 176.252 1.228 1
1 423 . 15 1 1 A 38 38 GLN CA C 38 58.370 56.625 1.745 1
1 424 . 15 1 1 A 38 38 GLN CB C 38 28.300 28.710 -0.410 1
1 426 . 15 1 1 A 38 38 GLN N N 38 119.210 117.867 1.343 1
1 428 . 15 1 1 A 39 39 GLY H H 39 8.940 8.766 0.174 1
1 429 . 15 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 15 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 15 1 1 A 39 39 GLY C C 39 174.070 174.354 -0.284 1
1 432 . 15 1 1 A 39 39 GLY CA C 39 45.280 45.033 0.247 1
1 433 . 15 1 1 A 39 39 GLY N N 39 113.490 112.149 1.341 1
1 434 . 15 1 1 A 40 40 LYS H H 40 8.350 7.579 0.771 1
1 435 . 15 1 1 A 40 40 LYS HA H 40 4.400 4.577 -0.177 1
1 444 . 15 1 1 A 40 40 LYS C C 40 175.560 175.792 -0.232 1
1 445 . 15 1 1 A 40 40 LYS CA C 40 55.660 54.848 0.812 1
1 446 . 15 1 1 A 40 40 LYS CB C 40 32.870 33.682 -0.812 1
1 450 . 15 1 1 A 40 40 LYS N N 40 122.060 119.977 2.083 1
1 451 . 15 1 1 A 41 41 THR H H 41 8.410 8.555 -0.145 1
1 452 . 15 1 1 A 41 41 THR HA H 41 5.330 4.970 0.360 1
1 457 . 15 1 1 A 41 41 THR C C 41 174.860 174.410 0.450 1
1 458 . 15 1 1 A 41 41 THR CA C 41 62.040 61.721 0.319 1
1 459 . 15 1 1 A 41 41 THR CB C 41 69.420 70.874 -1.454 1
1 461 . 15 1 1 A 41 41 THR N N 41 118.150 118.083 0.067 1
1 462 . 15 1 1 A 42 42 VAL H H 42 9.140 9.123 0.017 1
1 463 . 15 1 1 A 42 42 VAL HA H 42 4.570 5.037 -0.467 1
1 471 . 15 1 1 A 42 42 VAL C C 42 172.970 173.541 -0.571 1
1 472 . 15 1 1 A 42 42 VAL CA C 42 59.450 59.206 0.244 1
1 473 . 15 1 1 A 42 42 VAL CB C 42 35.880 35.463 0.417 1
1 476 . 15 1 1 A 42 42 VAL N N 42 122.510 120.237 2.273 1
1 477 . 15 1 1 A 43 43 ARG H H 43 8.420 8.740 -0.320 1
1 478 . 15 1 1 A 43 43 ARG HA H 43 4.750 4.992 -0.242 1
1 485 . 15 1 1 A 43 43 ARG C C 43 175.650 174.914 0.736 1
1 486 . 15 1 1 A 43 43 ARG CA C 43 53.650 54.133 -0.483 1
1 487 . 15 1 1 A 43 43 ARG CB C 43 33.870 34.033 -0.163 1
1 490 . 15 1 1 A 43 43 ARG N N 43 120.640 122.609 -1.969 1
1 491 . 15 1 1 A 44 44 THR H H 44 8.370 8.575 -0.205 1
1 492 . 15 1 1 A 44 44 THR HA H 44 3.410 3.757 -0.347 1
1 497 . 15 1 1 A 44 44 THR C C 44 175.020 175.814 -0.794 1
1 498 . 15 1 1 A 44 44 THR CA C 44 65.660 65.014 0.646 1
1 499 . 15 1 1 A 44 44 THR CB C 44 69.400 68.340 1.060 1
1 501 . 15 1 1 A 44 44 THR N N 44 118.590 119.536 -0.946 1
1 502 . 15 1 1 A 45 45 GLY H H 45 9.090 8.713 0.377 1
1 503 . 15 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 15 1 1 A 45 45 GLY HA3 H 45 4.470 4.020 0.450 1
1 505 . 15 1 1 A 45 45 GLY C C 45 174.350 173.844 0.506 1
1 506 . 15 1 1 A 45 45 GLY CA C 45 45.000 44.937 0.063 1
1 507 . 15 1 1 A 45 45 GLY N N 45 117.350 114.972 2.378 1
1 508 . 15 1 1 A 46 46 ASP H H 46 8.010 7.919 0.091 1
1 509 . 15 1 1 A 46 46 ASP HA H 46 4.470 4.625 -0.155 1
1 512 . 15 1 1 A 46 46 ASP C C 46 174.570 174.378 0.192 1
1 513 . 15 1 1 A 46 46 ASP CA C 46 55.570 55.409 0.161 1
1 514 . 15 1 1 A 46 46 ASP CB C 46 41.680 41.534 0.146 1
1 515 . 15 1 1 A 46 46 ASP N N 46 122.240 122.212 0.028 1
1 516 . 15 1 1 A 47 47 VAL H H 47 8.330 8.386 -0.056 1
1 517 . 15 1 1 A 47 47 VAL HA H 47 4.950 4.888 0.062 1
1 525 . 15 1 1 A 47 47 VAL C C 47 176.330 175.616 0.714 1
1 526 . 15 1 1 A 47 47 VAL CA C 47 61.710 60.839 0.871 1
1 527 . 15 1 1 A 47 47 VAL CB C 47 32.900 35.295 -2.395 1
1 530 . 15 1 1 A 47 47 VAL N N 47 119.860 121.890 -2.030 1
1 531 . 15 1 1 A 48 48 ILE H H 48 9.160 8.712 0.448 1
1 532 . 15 1 1 A 48 48 ILE HA H 48 4.630 5.186 -0.556 1
1 542 . 15 1 1 A 48 48 ILE C C 48 174.400 174.428 -0.028 1
1 543 . 15 1 1 A 48 48 ILE CA C 48 58.990 59.315 -0.325 1
1 544 . 15 1 1 A 48 48 ILE CB C 48 41.810 42.180 -0.370 1
1 548 . 15 1 1 A 48 48 ILE N N 48 124.990 121.480 3.510 1
1 549 . 15 1 1 A 49 49 GLY H H 49 8.660 8.922 -0.262 1
1 550 . 15 1 1 A 49 49 GLY HA2 H 49 4.950 4.320 0.630 1
1 551 . 15 1 1 A 49 49 GLY HA3 H 49 3.620 4.361 -0.741 1
1 552 . 15 1 1 A 49 49 GLY C C 49 172.920 171.981 0.939 1
1 553 . 15 1 1 A 49 49 GLY CA C 49 44.580 44.400 0.180 1
1 554 . 15 1 1 A 49 49 GLY N N 49 112.060 109.301 2.759 1
1 555 . 15 1 1 A 50 50 ILE H H 50 8.810 9.035 -0.225 1
1 556 . 15 1 1 A 50 50 ILE HA H 50 4.370 4.779 -0.409 1
1 566 . 15 1 1 A 50 50 ILE C C 50 174.500 175.000 -0.500 1
1 567 . 15 1 1 A 50 50 ILE CA C 50 59.550 59.945 -0.395 1
1 568 . 15 1 1 A 50 50 ILE CB C 50 41.300 41.749 -0.449 1
1 572 . 15 1 1 A 50 50 ILE N N 50 123.220 125.117 -1.897 1
1 573 . 15 1 1 A 51 51 SER H H 51 8.540 8.962 -0.422 1
1 574 . 15 1 1 A 51 51 SER HA H 51 4.830 5.026 -0.196 1
1 577 . 15 1 1 A 51 51 SER C C 51 174.130 174.118 0.012 1
1 578 . 15 1 1 A 51 51 SER CA C 51 57.770 58.028 -0.258 1
1 579 . 15 1 1 A 51 51 SER CB C 51 63.040 64.211 -1.171 1
1 580 . 15 1 1 A 51 51 SER N N 51 121.430 123.823 -2.393 1
1 581 . 15 1 1 A 52 52 ILE H H 52 8.930 8.729 0.201 1
1 582 . 15 1 1 A 52 52 ILE HA H 52 4.290 4.610 -0.320 1
1 592 . 15 1 1 A 52 52 ILE C C 52 175.280 176.083 -0.803 1
1 593 . 15 1 1 A 52 52 ILE CA C 52 60.250 60.309 -0.059 1
1 594 . 15 1 1 A 52 52 ILE CB C 52 39.840 40.449 -0.609 1
1 598 . 15 1 1 A 52 52 ILE N N 52 127.060 126.942 0.118 1
1 599 . 15 1 1 A 53 53 LEU H H 53 9.380 9.489 -0.109 1
1 600 . 15 1 1 A 53 53 LEU HA H 53 3.890 4.097 -0.207 1
1 610 . 15 1 1 A 53 53 LEU C C 53 177.130 176.992 0.138 1
1 611 . 15 1 1 A 53 53 LEU CA C 53 55.560 56.208 -0.648 1
1 612 . 15 1 1 A 53 53 LEU CB C 53 39.370 40.684 -1.314 1
1 616 . 15 1 1 A 53 53 LEU N N 53 126.770 129.940 -3.170 1
1 617 . 15 1 1 A 54 54 GLY H H 54 8.310 8.704 -0.394 1
1 618 . 15 1 1 A 54 54 GLY HA2 H 54 3.490 3.906 -0.416 1
1 619 . 15 1 1 A 54 54 GLY HA3 H 54 4.080 3.907 0.173 1
1 620 . 15 1 1 A 54 54 GLY C C 54 173.690 173.951 -0.261 1
1 621 . 15 1 1 A 54 54 GLY CA C 54 45.340 45.756 -0.416 1
1 622 . 15 1 1 A 54 54 GLY N N 54 103.820 104.382 -0.562 1
1 623 . 15 1 1 A 55 55 LYS H H 55 7.730 7.853 -0.123 1
1 624 . 15 1 1 A 55 55 LYS HA H 55 4.560 4.826 -0.266 1
1 633 . 15 1 1 A 55 55 LYS C C 55 174.550 175.155 -0.605 1
1 634 . 15 1 1 A 55 55 LYS CA C 55 54.140 55.052 -0.912 1
1 635 . 15 1 1 A 55 55 LYS CB C 55 34.620 35.545 -0.925 1
1 639 . 15 1 1 A 55 55 LYS N N 55 121.160 120.232 0.928 1
1 640 . 15 1 1 A 56 56 GLU H H 56 8.490 8.826 -0.336 1
1 641 . 15 1 1 A 56 56 GLU HA H 56 4.280 4.698 -0.418 1
1 646 . 15 1 1 A 56 56 GLU C C 56 175.730 175.209 0.521 1
1 647 . 15 1 1 A 56 56 GLU CA C 56 56.730 56.328 0.402 1
1 648 . 15 1 1 A 56 56 GLU CB C 56 30.070 30.685 -0.615 1
1 650 . 15 1 1 A 56 56 GLU N N 56 124.090 128.824 -4.734 1
1 651 . 15 1 1 A 57 57 VAL H H 57 8.920 8.454 0.466 1
1 652 . 15 1 1 A 57 57 VAL HA H 57 4.030 4.820 -0.790 1
1 660 . 15 1 1 A 57 57 VAL C C 57 174.610 173.821 0.789 1
1 661 . 15 1 1 A 57 57 VAL CA C 57 61.680 59.547 2.133 1
1 662 . 15 1 1 A 57 57 VAL CB C 57 33.880 34.633 -0.753 1
1 665 . 15 1 1 A 57 57 VAL N N 57 129.960 126.605 3.355 1
1 666 . 15 1 1 A 58 58 LYS H H 58 7.860 8.691 -0.831 1
1 667 . 15 1 1 A 58 58 LYS HA H 58 5.120 4.826 0.294 1
1 676 . 15 1 1 A 58 58 LYS C C 58 175.380 175.777 -0.397 1
1 677 . 15 1 1 A 58 58 LYS CA C 58 55.200 54.892 0.308 1
1 678 . 15 1 1 A 58 58 LYS CB C 58 34.670 34.410 0.260 1
1 682 . 15 1 1 A 58 58 LYS N N 58 124.790 127.382 -2.592 1
1 683 . 15 1 1 A 59 59 PHE H H 59 9.270 9.117 0.153 1
1 684 . 15 1 1 A 59 59 PHE HA H 59 4.960 5.108 -0.148 1
1 692 . 15 1 1 A 59 59 PHE C C 59 173.950 174.288 -0.338 1
1 693 . 15 1 1 A 59 59 PHE CA C 59 55.910 56.255 -0.345 1
1 694 . 15 1 1 A 59 59 PHE CB C 59 42.950 42.229 0.721 1
1 700 . 15 1 1 A 59 59 PHE N N 59 118.270 122.362 -4.092 1
1 701 . 15 1 1 A 60 60 LYS H H 60 9.170 8.888 0.282 1
1 702 . 15 1 1 A 60 60 LYS HA H 60 4.910 4.992 -0.082 1
1 711 . 15 1 1 A 60 60 LYS C C 60 176.230 176.006 0.224 1
1 712 . 15 1 1 A 60 60 LYS CA C 60 53.910 54.558 -0.648 1
1 713 . 15 1 1 A 60 60 LYS CB C 60 35.170 35.063 0.107 1
1 717 . 15 1 1 A 60 60 LYS N N 60 121.960 124.108 -2.148 1
1 718 . 15 1 1 A 61 61 VAL H H 61 9.400 8.828 0.572 1
1 719 . 15 1 1 A 61 61 VAL HA H 61 4.170 4.018 0.152 1
1 727 . 15 1 1 A 61 61 VAL C C 61 175.500 175.354 0.146 1
1 728 . 15 1 1 A 61 61 VAL CA C 61 61.980 63.542 -1.562 1
1 729 . 15 1 1 A 61 61 VAL CB C 61 29.490 31.118 -1.628 1
1 732 . 15 1 1 A 61 61 VAL N N 61 127.140 127.084 0.056 1
1 733 . 15 1 1 A 62 62 VAL H H 62 8.390 8.667 -0.277 1
1 734 . 15 1 1 A 62 62 VAL HA H 62 3.650 3.972 -0.322 1
1 742 . 15 1 1 A 62 62 VAL C C 62 176.440 176.057 0.383 1
1 743 . 15 1 1 A 62 62 VAL CA C 62 64.930 64.424 0.506 1
1 744 . 15 1 1 A 62 62 VAL CB C 62 32.130 32.462 -0.332 1
1 747 . 15 1 1 A 62 62 VAL N N 62 132.840 129.372 3.468 1
1 748 . 15 1 1 A 63 63 GLN H H 63 7.470 7.134 0.336 1
1 749 . 15 1 1 A 63 63 GLN HA H 63 4.270 4.442 -0.172 1
1 756 . 15 1 1 A 63 63 GLN C C 63 172.290 173.300 -1.010 1
1 757 . 15 1 1 A 63 63 GLN CA C 63 56.640 55.442 1.198 1
1 758 . 15 1 1 A 63 63 GLN CB C 63 32.630 31.896 0.734 1
1 760 . 15 1 1 A 63 63 GLN N N 63 114.500 116.858 -2.358 1
1 762 . 15 1 1 A 64 64 ALA H H 64 8.200 8.618 -0.418 1
1 763 . 15 1 1 A 64 64 ALA HA H 64 4.830 5.297 -0.467 1
1 767 . 15 1 1 A 64 64 ALA C C 64 174.270 175.720 -1.450 1
1 768 . 15 1 1 A 64 64 ALA CA C 64 50.800 49.974 0.826 1
1 769 . 15 1 1 A 64 64 ALA CB C 64 20.100 21.524 -1.424 1
1 770 . 15 1 1 A 64 64 ALA N N 64 131.410 128.803 2.607 1
1 771 . 15 1 1 A 65 65 TYR H H 65 8.860 8.483 0.377 1
1 772 . 15 1 1 A 65 65 TYR HA H 65 4.540 4.969 -0.429 1
1 779 . 15 1 1 A 65 65 TYR CA C 65 54.270 55.036 -0.766 1
1 780 . 15 1 1 A 65 65 TYR CB C 65 41.360 40.436 0.924 1
1 785 . 15 1 1 A 65 65 TYR N N 65 124.140 119.993 4.147 1
1 786 . 15 1 1 A 66 66 PRO HA H 66 4.120 4.770 -0.650 1
1 793 . 15 1 1 A 66 66 PRO CA C 66 63.450 62.358 1.092 1
1 794 . 15 1 1 A 66 66 PRO CB C 66 34.170 32.830 1.340 1
1 797 . 15 1 1 A 67 67 SER H H 67 7.380 8.244 -0.864 1
1 798 . 15 1 1 A 67 67 SER HA H 67 4.720 4.977 -0.257 1
1 801 . 15 1 1 A 67 67 SER CA C 67 54.250 56.059 -1.809 1
1 802 . 15 1 1 A 67 67 SER CB C 67 64.530 63.826 0.704 1
1 803 . 15 1 1 A 67 67 SER N N 67 106.200 116.686 -10.486 1
1 804 . 15 1 1 A 68 68 PRO HA H 68 4.880 4.658 0.222 1
1 811 . 15 1 1 A 68 68 PRO CA C 68 62.990 62.463 0.527 1
1 812 . 15 1 1 A 68 68 PRO CB C 68 35.220 33.171 2.049 1
1 815 . 15 1 1 A 69 69 LEU H H 69 8.960 8.027 0.933 1
1 816 . 15 1 1 A 69 69 LEU HA H 69 4.430 5.116 -0.686 1
1 826 . 15 1 1 A 69 69 LEU C C 69 174.570 175.329 -0.759 1
1 827 . 15 1 1 A 69 69 LEU CA C 69 53.900 52.589 1.311 1
1 828 . 15 1 1 A 69 69 LEU CB C 69 44.210 46.097 -1.887 1
1 832 . 15 1 1 A 69 69 LEU N N 69 120.480 117.102 3.378 1
1 833 . 15 1 1 A 70 70 ARG H H 70 8.130 8.379 -0.249 1
1 834 . 15 1 1 A 70 70 ARG HA H 70 4.930 4.738 0.192 1
1 841 . 15 1 1 A 70 70 ARG C C 70 175.460 176.364 -0.904 1
1 842 . 15 1 1 A 70 70 ARG CA C 70 54.040 55.558 -1.518 1
1 843 . 15 1 1 A 70 70 ARG CB C 70 30.550 31.845 -1.295 1
1 846 . 15 1 1 A 70 70 ARG N N 70 125.180 119.636 5.544 1
1 847 . 15 1 1 A 71 71 VAL H H 71 8.450 8.231 0.219 1
1 848 . 15 1 1 A 71 71 VAL HA H 71 3.410 4.432 -1.022 1
1 856 . 15 1 1 A 71 71 VAL C C 71 175.460 175.499 -0.039 1
1 857 . 15 1 1 A 71 71 VAL CA C 71 65.210 62.174 3.036 1
1 858 . 15 1 1 A 71 71 VAL CB C 71 29.840 31.631 -1.791 1
1 861 . 15 1 1 A 71 71 VAL N N 71 128.170 122.700 5.470 1
1 862 . 15 1 1 A 72 72 GLU H H 72 8.620 8.396 0.224 1
1 863 . 15 1 1 A 72 72 GLU HA H 72 4.870 4.822 0.048 1
1 868 . 15 1 1 A 72 72 GLU C C 72 176.960 176.009 0.951 1
1 869 . 15 1 1 A 72 72 GLU CA C 72 54.330 54.437 -0.107 1
1 870 . 15 1 1 A 72 72 GLU CB C 72 33.280 33.105 0.175 1
1 872 . 15 1 1 A 72 72 GLU N N 72 127.670 127.059 0.611 1
1 873 . 15 1 1 A 73 73 ASP H H 73 8.700 9.032 -0.332 1
1 874 . 15 1 1 A 73 73 ASP HA H 73 4.150 4.263 -0.113 1
1 877 . 15 1 1 A 73 73 ASP C C 73 177.460 178.116 -0.656 1
1 878 . 15 1 1 A 73 73 ASP CA C 73 57.620 56.737 0.883 1
1 879 . 15 1 1 A 73 73 ASP CB C 73 40.360 40.535 -0.175 1
1 880 . 15 1 1 A 73 73 ASP N N 73 121.140 124.464 -3.324 1
1 881 . 15 1 1 A 74 74 ARG H H 74 7.760 7.725 0.035 1
1 882 . 15 1 1 A 74 74 ARG HA H 74 4.280 4.352 -0.072 1
1 889 . 15 1 1 A 74 74 ARG C C 74 176.510 176.729 -0.219 1
1 890 . 15 1 1 A 74 74 ARG CA C 74 55.450 56.811 -1.361 1
1 891 . 15 1 1 A 74 74 ARG CB C 74 29.990 30.804 -0.814 1
1 894 . 15 1 1 A 74 74 ARG N N 74 112.890 116.988 -4.098 1
1 895 . 15 1 1 A 75 75 THR H H 75 7.700 7.371 0.329 1
1 896 . 15 1 1 A 75 75 THR HA H 75 4.020 4.243 -0.223 1
1 901 . 15 1 1 A 75 75 THR C C 75 173.810 173.882 -0.072 1
1 902 . 15 1 1 A 75 75 THR CA C 75 64.060 64.160 -0.100 1
1 903 . 15 1 1 A 75 75 THR CB C 75 69.350 69.439 -0.089 1
1 905 . 15 1 1 A 75 75 THR N N 75 120.650 116.508 4.142 1
1 906 . 15 1 1 A 76 76 LYS H H 76 8.520 8.257 0.263 1
1 907 . 15 1 1 A 76 76 LYS HA H 76 4.270 4.682 -0.412 1
1 916 . 15 1 1 A 76 76 LYS C C 76 174.560 175.817 -1.257 1
1 917 . 15 1 1 A 76 76 LYS CA C 76 56.280 56.038 0.242 1
1 918 . 15 1 1 A 76 76 LYS CB C 76 33.120 33.584 -0.464 1
1 922 . 15 1 1 A 76 76 LYS N N 76 130.950 127.311 3.639 1
1 923 . 15 1 1 A 77 77 ILE H H 77 8.430 8.626 -0.196 1
1 924 . 15 1 1 A 77 77 ILE HA H 77 4.850 5.215 -0.365 1
1 934 . 15 1 1 A 77 77 ILE C C 77 174.650 175.055 -0.405 1
1 935 . 15 1 1 A 77 77 ILE CA C 77 59.820 60.041 -0.221 1
1 936 . 15 1 1 A 77 77 ILE CB C 77 38.280 40.844 -2.564 1
1 940 . 15 1 1 A 77 77 ILE N N 77 128.020 123.441 4.579 1
1 941 . 15 1 1 A 78 78 THR H H 78 8.870 8.807 0.063 1
1 942 . 15 1 1 A 78 78 THR HA H 78 4.470 5.125 -0.655 1
1 947 . 15 1 1 A 78 78 THR C C 78 172.760 173.044 -0.284 1
1 948 . 15 1 1 A 78 78 THR CA C 78 60.740 61.418 -0.678 1
1 949 . 15 1 1 A 78 78 THR CB C 78 71.320 71.771 -0.451 1
1 951 . 15 1 1 A 78 78 THR N N 78 123.870 123.689 0.181 1
1 952 . 15 1 1 A 79 79 LEU H H 79 8.820 8.970 -0.150 1
1 953 . 15 1 1 A 79 79 LEU HA H 79 5.140 5.123 0.017 1
1 963 . 15 1 1 A 79 79 LEU C C 79 176.610 176.170 0.440 1
1 964 . 15 1 1 A 79 79 LEU CA C 79 53.280 53.388 -0.108 1
1 965 . 15 1 1 A 79 79 LEU CB C 79 42.600 43.208 -0.608 1
1 969 . 15 1 1 A 79 79 LEU N N 79 127.070 126.594 0.476 1
1 970 . 15 1 1 A 80 80 VAL H H 80 8.800 8.538 0.262 1
1 971 . 15 1 1 A 80 80 VAL HA H 80 4.260 4.681 -0.421 1
1 979 . 15 1 1 A 80 80 VAL CA C 80 61.350 61.582 -0.232 1
1 980 . 15 1 1 A 80 80 VAL CB C 80 32.790 32.771 0.019 1
1 983 . 15 1 1 A 80 80 VAL N N 80 124.120 125.258 -1.138 1
1 984 . 15 1 1 A 81 81 THR H H 81 8.160 8.878 -0.718 1
1 985 . 15 1 1 A 81 81 THR HA H 81 4.410 5.162 -0.752 1
1 990 . 15 1 1 A 81 81 THR CA C 81 60.800 59.846 0.954 1
1 991 . 15 1 1 A 81 81 THR CB C 81 69.650 72.174 -2.524 1
1 993 . 15 1 1 A 81 81 THR N N 81 114.500 116.320 -1.820 1
1 1 . 16 1 1 A 9 9 GLY H H 9 8.390 7.527 0.863 1
1 2 . 16 1 1 A 9 9 GLY HA2 H 9 3.900 4.038 -0.138 1
1 3 . 16 1 1 A 9 9 GLY HA3 H 9 3.860 4.039 -0.179 1
1 4 . 16 1 1 A 9 9 GLY CA C 9 45.150 44.157 0.993 1
1 5 . 16 1 1 A 9 9 GLY N N 9 110.000 106.159 3.841 1
1 6 . 16 1 1 A 10 10 VAL H H 10 7.870 8.431 -0.561 1
1 7 . 16 1 1 A 10 10 VAL HA H 10 4.040 4.501 -0.461 1
1 15 . 16 1 1 A 10 10 VAL C C 10 175.880 175.303 0.577 1
1 16 . 16 1 1 A 10 10 VAL CA C 10 62.110 62.793 -0.683 1
1 17 . 16 1 1 A 10 10 VAL CB C 10 32.760 32.228 0.532 1
1 20 . 16 1 1 A 10 10 VAL N N 10 119.730 120.280 -0.550 1
1 21 . 16 1 1 A 11 11 ILE H H 11 8.230 8.917 -0.687 1
1 22 . 16 1 1 A 11 11 ILE HA H 11 4.090 5.028 -0.938 1
1 32 . 16 1 1 A 11 11 ILE C C 11 175.850 174.836 1.014 1
1 33 . 16 1 1 A 11 11 ILE CA C 11 60.800 59.395 1.405 1
1 34 . 16 1 1 A 11 11 ILE CB C 11 38.470 40.546 -2.076 1
1 38 . 16 1 1 A 11 11 ILE N N 11 125.570 127.774 -2.204 1
1 39 . 16 1 1 A 12 12 MET H H 12 8.370 9.009 -0.639 1
1 40 . 16 1 1 A 12 12 MET HA H 12 4.540 5.393 -0.853 1
1 48 . 16 1 1 A 12 12 MET C C 12 174.830 175.153 -0.323 1
1 49 . 16 1 1 A 12 12 MET CA C 12 54.790 53.615 1.175 1
1 50 . 16 1 1 A 12 12 MET CB C 12 32.640 35.363 -2.723 1
1 53 . 16 1 1 A 12 12 MET N N 12 125.930 124.469 1.461 1
1 54 . 16 1 1 A 13 13 SER H H 13 7.990 9.030 -1.040 1
1 55 . 16 1 1 A 13 13 SER HA H 13 5.030 5.503 -0.473 1
1 58 . 16 1 1 A 13 13 SER C C 13 174.330 173.232 1.098 1
1 59 . 16 1 1 A 13 13 SER CA C 13 57.320 55.770 1.550 1
1 60 . 16 1 1 A 13 13 SER CB C 13 64.790 66.224 -1.434 1
1 61 . 16 1 1 A 13 13 SER N N 13 116.400 117.586 -1.186 1
1 62 . 16 1 1 A 14 14 GLU H H 14 9.430 8.748 0.682 1
1 63 . 16 1 1 A 14 14 GLU HA H 14 5.250 5.132 0.118 1
1 68 . 16 1 1 A 14 14 GLU C C 14 172.980 173.926 -0.946 1
1 69 . 16 1 1 A 14 14 GLU CA C 14 55.390 55.340 0.050 1
1 70 . 16 1 1 A 14 14 GLU CB C 14 33.910 34.204 -0.294 1
1 72 . 16 1 1 A 14 14 GLU N N 14 123.670 121.895 1.775 1
1 73 . 16 1 1 A 15 15 LEU H H 15 8.930 8.897 0.033 1
1 74 . 16 1 1 A 15 15 LEU HA H 15 4.870 5.155 -0.285 1
1 84 . 16 1 1 A 15 15 LEU C C 15 174.000 174.484 -0.484 1
1 85 . 16 1 1 A 15 15 LEU CA C 15 53.020 53.580 -0.560 1
1 86 . 16 1 1 A 15 15 LEU CB C 15 46.040 45.809 0.231 1
1 90 . 16 1 1 A 15 15 LEU N N 15 125.350 126.303 -0.953 1
1 91 . 16 1 1 A 16 16 LYS H H 16 8.840 8.795 0.045 1
1 92 . 16 1 1 A 16 16 LYS HA H 16 5.360 4.892 0.468 1
1 101 . 16 1 1 A 16 16 LYS C C 16 175.660 175.389 0.271 1
1 102 . 16 1 1 A 16 16 LYS CA C 16 54.940 55.553 -0.613 1
1 103 . 16 1 1 A 16 16 LYS CB C 16 34.280 33.469 0.811 1
1 107 . 16 1 1 A 16 16 LYS N N 16 124.640 126.801 -2.161 1
1 108 . 16 1 1 A 17 17 LEU H H 17 8.820 9.017 -0.197 1
1 109 . 16 1 1 A 17 17 LEU HA H 17 5.430 5.237 0.193 1
1 119 . 16 1 1 A 17 17 LEU C C 17 174.630 175.823 -1.193 1
1 120 . 16 1 1 A 17 17 LEU CA C 17 52.900 53.444 -0.544 1
1 121 . 16 1 1 A 17 17 LEU CB C 17 46.910 45.432 1.478 1
1 125 . 16 1 1 A 17 17 LEU N N 17 123.460 126.933 -3.473 1
1 126 . 16 1 1 A 18 18 LYS H H 18 9.110 8.614 0.496 1
1 127 . 16 1 1 A 18 18 LYS HA H 18 5.490 4.974 0.516 1
1 136 . 16 1 1 A 18 18 LYS CA C 18 52.270 52.949 -0.679 1
1 137 . 16 1 1 A 18 18 LYS CB C 18 37.500 36.475 1.025 1
1 141 . 16 1 1 A 18 18 LYS N N 18 122.230 123.287 -1.057 1
1 142 . 16 1 1 A 19 19 PRO HA H 19 4.100 4.426 -0.326 1
1 149 . 16 1 1 A 19 19 PRO CA C 19 62.440 62.259 0.181 1
1 150 . 16 1 1 A 19 19 PRO CB C 19 30.640 32.379 -1.739 1
1 153 . 16 1 1 A 20 20 LEU H H 20 8.490 8.432 0.058 1
1 154 . 16 1 1 A 20 20 LEU HA H 20 4.320 4.214 0.106 1
1 164 . 16 1 1 A 20 20 LEU CA C 20 57.680 58.596 -0.916 1
1 165 . 16 1 1 A 20 20 LEU CB C 20 38.760 40.957 -2.197 1
1 169 . 16 1 1 A 20 20 LEU N N 20 123.250 119.582 3.668 1
1 170 . 16 1 1 A 21 21 PRO HA H 21 4.530 4.520 0.010 1
1 177 . 16 1 1 A 21 21 PRO CA C 21 62.880 62.311 0.569 1
1 178 . 16 1 1 A 21 21 PRO CB C 21 31.420 32.326 -0.906 1
1 181 . 16 1 1 A 22 22 LYS H H 22 8.180 8.411 -0.231 1
1 182 . 16 1 1 A 22 22 LYS HA H 22 4.110 4.430 -0.320 1
1 191 . 16 1 1 A 22 22 LYS C C 22 175.680 175.387 0.293 1
1 192 . 16 1 1 A 22 22 LYS CA C 22 56.210 55.793 0.417 1
1 193 . 16 1 1 A 22 22 LYS CB C 22 30.660 31.997 -1.337 1
1 197 . 16 1 1 A 22 22 LYS N N 22 119.160 121.651 -2.491 1
1 198 . 16 1 1 A 23 23 VAL H H 23 7.530 8.483 -0.953 1
1 199 . 16 1 1 A 23 23 VAL HA H 23 4.280 4.819 -0.539 1
1 207 . 16 1 1 A 23 23 VAL C C 23 173.690 173.094 0.596 1
1 208 . 16 1 1 A 23 23 VAL CA C 23 59.830 59.518 0.312 1
1 209 . 16 1 1 A 23 23 VAL CB C 23 34.550 35.509 -0.959 1
1 212 . 16 1 1 A 23 23 VAL N N 23 121.820 122.877 -1.057 1
1 213 . 16 1 1 A 24 24 GLU H H 24 8.270 8.966 -0.696 1
1 214 . 16 1 1 A 24 24 GLU HA H 24 4.330 5.007 -0.677 1
1 219 . 16 1 1 A 24 24 GLU C C 24 175.390 175.283 0.107 1
1 220 . 16 1 1 A 24 24 GLU CA C 24 55.220 54.736 0.484 1
1 221 . 16 1 1 A 24 24 GLU CB C 24 29.970 32.003 -2.033 1
1 223 . 16 1 1 A 24 24 GLU N N 24 125.610 127.129 -1.519 1
1 224 . 16 1 1 A 25 25 LEU H H 25 8.480 8.806 -0.326 1
1 225 . 16 1 1 A 25 25 LEU HA H 25 4.520 4.419 0.101 1
1 235 . 16 1 1 A 25 25 LEU CA C 25 51.660 51.843 -0.183 1
1 236 . 16 1 1 A 25 25 LEU CB C 25 41.750 40.927 0.823 1
1 240 . 16 1 1 A 25 25 LEU N N 25 125.880 126.216 -0.336 1
1 241 . 16 1 1 A 26 26 PRO HA H 26 4.760 4.620 0.140 1
1 248 . 16 1 1 A 26 26 PRO CA C 26 61.330 61.903 -0.573 1
1 249 . 16 1 1 A 26 26 PRO CB C 26 31.060 32.834 -1.774 1
1 252 . 16 1 1 A 27 27 PRO HA H 27 4.390 4.421 -0.031 1
1 259 . 16 1 1 A 27 27 PRO CA C 27 64.550 64.841 -0.291 1
1 260 . 16 1 1 A 27 27 PRO CB C 27 31.770 31.742 0.028 1
1 263 . 16 1 1 A 28 28 ASP H H 28 8.560 8.783 -0.223 1
1 264 . 16 1 1 A 28 28 ASP HA H 28 4.620 4.431 0.189 1
1 267 . 16 1 1 A 28 28 ASP C C 28 177.100 178.782 -1.682 1
1 268 . 16 1 1 A 28 28 ASP CA C 28 53.890 56.308 -2.418 1
1 269 . 16 1 1 A 28 28 ASP CB C 28 39.120 39.565 -0.445 1
1 270 . 16 1 1 A 28 28 ASP N N 28 115.820 117.840 -2.020 1
1 271 . 16 1 1 A 29 29 PHE H H 29 7.940 7.968 -0.028 1
1 272 . 16 1 1 A 29 29 PHE HA H 29 4.180 4.318 -0.138 1
1 280 . 16 1 1 A 29 29 PHE C C 29 176.740 178.262 -1.522 1
1 281 . 16 1 1 A 29 29 PHE CA C 29 61.020 61.029 -0.009 1
1 282 . 16 1 1 A 29 29 PHE CB C 29 39.230 38.748 0.482 1
1 288 . 16 1 1 A 29 29 PHE N N 29 119.610 118.216 1.394 1
1 289 . 16 1 1 A 30 30 VAL H H 30 8.010 8.453 -0.443 1
1 290 . 16 1 1 A 30 30 VAL HA H 30 3.350 3.771 -0.421 1
1 298 . 16 1 1 A 30 30 VAL C C 30 176.400 177.308 -0.908 1
1 299 . 16 1 1 A 30 30 VAL CA C 30 66.510 64.820 1.690 1
1 300 . 16 1 1 A 30 30 VAL CB C 30 31.020 31.079 -0.059 1
1 303 . 16 1 1 A 30 30 VAL N N 30 116.370 119.575 -3.205 1
1 304 . 16 1 1 A 31 31 ASP H H 31 7.420 8.139 -0.719 1
1 305 . 16 1 1 A 31 31 ASP HA H 31 4.310 4.368 -0.058 1
1 308 . 16 1 1 A 31 31 ASP C C 31 178.360 178.649 -0.289 1
1 309 . 16 1 1 A 31 31 ASP CA C 31 57.110 57.443 -0.333 1
1 310 . 16 1 1 A 31 31 ASP CB C 31 40.450 41.132 -0.682 1
1 311 . 16 1 1 A 31 31 ASP N N 31 119.190 121.630 -2.440 1
1 312 . 16 1 1 A 32 32 VAL H H 32 7.190 7.364 -0.174 1
1 313 . 16 1 1 A 32 32 VAL HA H 32 3.510 3.548 -0.038 1
1 321 . 16 1 1 A 32 32 VAL C C 32 178.100 178.500 -0.400 1
1 322 . 16 1 1 A 32 32 VAL CA C 32 65.570 66.399 -0.829 1
1 323 . 16 1 1 A 32 32 VAL CB C 32 31.410 31.338 0.072 1
1 326 . 16 1 1 A 32 32 VAL N N 32 119.830 119.103 0.727 1
1 327 . 16 1 1 A 33 33 ILE H H 33 7.660 8.448 -0.788 1
1 328 . 16 1 1 A 33 33 ILE HA H 33 3.170 3.535 -0.365 1
1 338 . 16 1 1 A 33 33 ILE C C 33 176.660 178.086 -1.426 1
1 339 . 16 1 1 A 33 33 ILE CA C 33 65.220 65.195 0.025 1
1 340 . 16 1 1 A 33 33 ILE CB C 33 37.500 37.666 -0.166 1
1 344 . 16 1 1 A 33 33 ILE N N 33 118.490 120.802 -2.312 1
1 345 . 16 1 1 A 34 34 ARG H H 34 7.830 7.785 0.045 1
1 346 . 16 1 1 A 34 34 ARG HA H 34 3.380 3.918 -0.538 1
1 354 . 16 1 1 A 34 34 ARG C C 34 178.060 178.034 0.026 1
1 355 . 16 1 1 A 34 34 ARG CA C 34 60.570 59.142 1.428 1
1 356 . 16 1 1 A 34 34 ARG CB C 34 30.070 29.809 0.261 1
1 359 . 16 1 1 A 34 34 ARG N N 34 118.260 119.997 -1.737 1
1 361 . 16 1 1 A 35 35 ILE H H 35 7.350 7.855 -0.505 1
1 362 . 16 1 1 A 35 35 ILE HA H 35 3.720 3.699 0.021 1
1 372 . 16 1 1 A 35 35 ILE C C 35 179.090 178.028 1.062 1
1 373 . 16 1 1 A 35 35 ILE CA C 35 64.060 65.379 -1.319 1
1 374 . 16 1 1 A 35 35 ILE CB C 35 38.030 37.380 0.650 1
1 378 . 16 1 1 A 35 35 ILE N N 35 116.750 119.530 -2.780 1
1 379 . 16 1 1 A 36 36 LYS H H 36 7.880 7.637 0.243 1
1 380 . 16 1 1 A 36 36 LYS HA H 36 4.090 3.942 0.148 1
1 389 . 16 1 1 A 36 36 LYS C C 36 178.560 178.939 -0.379 1
1 390 . 16 1 1 A 36 36 LYS CA C 36 57.650 59.779 -2.129 1
1 391 . 16 1 1 A 36 36 LYS CB C 36 32.090 32.171 -0.081 1
1 395 . 16 1 1 A 36 36 LYS N N 36 118.700 119.821 -1.121 1
1 396 . 16 1 1 A 37 37 LEU H H 37 7.860 7.395 0.465 1
1 397 . 16 1 1 A 37 37 LEU HA H 37 4.230 4.289 -0.059 1
1 407 . 16 1 1 A 37 37 LEU C C 37 175.880 176.767 -0.887 1
1 408 . 16 1 1 A 37 37 LEU CA C 37 54.090 55.698 -1.608 1
1 409 . 16 1 1 A 37 37 LEU CB C 37 43.310 42.502 0.808 1
1 413 . 16 1 1 A 37 37 LEU N N 37 116.380 117.587 -1.207 1
1 414 . 16 1 1 A 38 38 GLN H H 38 7.190 7.478 -0.288 1
1 415 . 16 1 1 A 38 38 GLN HA H 38 3.530 4.418 -0.888 1
1 422 . 16 1 1 A 38 38 GLN C C 38 177.480 176.264 1.216 1
1 423 . 16 1 1 A 38 38 GLN CA C 38 58.370 56.739 1.631 1
1 424 . 16 1 1 A 38 38 GLN CB C 38 28.300 28.689 -0.389 1
1 426 . 16 1 1 A 38 38 GLN N N 38 119.210 117.661 1.549 1
1 428 . 16 1 1 A 39 39 GLY H H 39 8.940 8.845 0.095 1
1 429 . 16 1 1 A 39 39 GLY HA2 H 39 3.540 3.989 -0.449 1
1 430 . 16 1 1 A 39 39 GLY HA3 H 39 4.220 3.990 0.230 1
1 431 . 16 1 1 A 39 39 GLY C C 39 174.070 174.428 -0.358 1
1 432 . 16 1 1 A 39 39 GLY CA C 39 45.280 45.041 0.239 1
1 433 . 16 1 1 A 39 39 GLY N N 39 113.490 112.398 1.092 1
1 434 . 16 1 1 A 40 40 LYS H H 40 8.350 7.629 0.721 1
1 435 . 16 1 1 A 40 40 LYS HA H 40 4.400 4.593 -0.193 1
1 444 . 16 1 1 A 40 40 LYS C C 40 175.560 175.733 -0.173 1
1 445 . 16 1 1 A 40 40 LYS CA C 40 55.660 54.728 0.932 1
1 446 . 16 1 1 A 40 40 LYS CB C 40 32.870 33.738 -0.868 1
1 450 . 16 1 1 A 40 40 LYS N N 40 122.060 119.969 2.091 1
1 451 . 16 1 1 A 41 41 THR H H 41 8.410 8.573 -0.163 1
1 452 . 16 1 1 A 41 41 THR HA H 41 5.330 4.973 0.357 1
1 457 . 16 1 1 A 41 41 THR C C 41 174.860 174.397 0.463 1
1 458 . 16 1 1 A 41 41 THR CA C 41 62.040 61.695 0.345 1
1 459 . 16 1 1 A 41 41 THR CB C 41 69.420 70.872 -1.452 1
1 461 . 16 1 1 A 41 41 THR N N 41 118.150 117.230 0.920 1
1 462 . 16 1 1 A 42 42 VAL H H 42 9.140 9.091 0.049 1
1 463 . 16 1 1 A 42 42 VAL HA H 42 4.570 5.001 -0.431 1
1 471 . 16 1 1 A 42 42 VAL C C 42 172.970 173.643 -0.673 1
1 472 . 16 1 1 A 42 42 VAL CA C 42 59.450 59.359 0.091 1
1 473 . 16 1 1 A 42 42 VAL CB C 42 35.880 35.411 0.469 1
1 476 . 16 1 1 A 42 42 VAL N N 42 122.510 120.677 1.833 1
1 477 . 16 1 1 A 43 43 ARG H H 43 8.420 8.725 -0.305 1
1 478 . 16 1 1 A 43 43 ARG HA H 43 4.750 4.950 -0.200 1
1 485 . 16 1 1 A 43 43 ARG C C 43 175.650 174.910 0.740 1
1 486 . 16 1 1 A 43 43 ARG CA C 43 53.650 54.111 -0.461 1
1 487 . 16 1 1 A 43 43 ARG CB C 43 33.870 33.855 0.015 1
1 490 . 16 1 1 A 43 43 ARG N N 43 120.640 123.004 -2.364 1
1 491 . 16 1 1 A 44 44 THR H H 44 8.370 8.564 -0.194 1
1 492 . 16 1 1 A 44 44 THR HA H 44 3.410 3.760 -0.350 1
1 497 . 16 1 1 A 44 44 THR C C 44 175.020 175.813 -0.793 1
1 498 . 16 1 1 A 44 44 THR CA C 44 65.660 65.009 0.651 1
1 499 . 16 1 1 A 44 44 THR CB C 44 69.400 68.336 1.064 1
1 501 . 16 1 1 A 44 44 THR N N 44 118.590 119.402 -0.812 1
1 502 . 16 1 1 A 45 45 GLY H H 45 9.090 8.759 0.331 1
1 503 . 16 1 1 A 45 45 GLY HA2 H 45 3.470 4.015 -0.545 1
1 504 . 16 1 1 A 45 45 GLY HA3 H 45 4.470 4.019 0.451 1
1 505 . 16 1 1 A 45 45 GLY C C 45 174.350 173.843 0.507 1
1 506 . 16 1 1 A 45 45 GLY CA C 45 45.000 44.938 0.062 1
1 507 . 16 1 1 A 45 45 GLY N N 45 117.350 114.957 2.393 1
1 508 . 16 1 1 A 46 46 ASP H H 46 8.010 7.900 0.110 1
1 509 . 16 1 1 A 46 46 ASP HA H 46 4.470 4.625 -0.155 1
1 512 . 16 1 1 A 46 46 ASP C C 46 174.570 174.445 0.125 1
1 513 . 16 1 1 A 46 46 ASP CA C 46 55.570 55.400 0.170 1
1 514 . 16 1 1 A 46 46 ASP CB C 46 41.680 41.462 0.218 1
1 515 . 16 1 1 A 46 46 ASP N N 46 122.240 122.205 0.035 1
1 516 . 16 1 1 A 47 47 VAL H H 47 8.330 8.432 -0.102 1
1 517 . 16 1 1 A 47 47 VAL HA H 47 4.950 4.918 0.032 1
1 525 . 16 1 1 A 47 47 VAL C C 47 176.330 175.513 0.817 1
1 526 . 16 1 1 A 47 47 VAL CA C 47 61.710 60.864 0.846 1
1 527 . 16 1 1 A 47 47 VAL CB C 47 32.900 35.300 -2.400 1
1 530 . 16 1 1 A 47 47 VAL N N 47 119.860 121.860 -2.000 1
1 531 . 16 1 1 A 48 48 ILE H H 48 9.160 8.701 0.459 1
1 532 . 16 1 1 A 48 48 ILE HA H 48 4.630 5.179 -0.549 1
1 542 . 16 1 1 A 48 48 ILE C C 48 174.400 174.460 -0.060 1
1 543 . 16 1 1 A 48 48 ILE CA C 48 58.990 59.283 -0.293 1
1 544 . 16 1 1 A 48 48 ILE CB C 48 41.810 42.200 -0.390 1
1 548 . 16 1 1 A 48 48 ILE N N 48 124.990 121.475 3.515 1
1 549 . 16 1 1 A 49 49 GLY H H 49 8.660 8.956 -0.296 1
1 550 . 16 1 1 A 49 49 GLY HA2 H 49 4.950 4.307 0.643 1
1 551 . 16 1 1 A 49 49 GLY HA3 H 49 3.620 4.349 -0.729 1
1 552 . 16 1 1 A 49 49 GLY C C 49 172.920 171.999 0.921 1
1 553 . 16 1 1 A 49 49 GLY CA C 49 44.580 44.422 0.158 1
1 554 . 16 1 1 A 49 49 GLY N N 49 112.060 109.368 2.692 1
1 555 . 16 1 1 A 50 50 ILE H H 50 8.810 9.075 -0.265 1
1 556 . 16 1 1 A 50 50 ILE HA H 50 4.370 4.804 -0.434 1
1 566 . 16 1 1 A 50 50 ILE C C 50 174.500 174.604 -0.104 1
1 567 . 16 1 1 A 50 50 ILE CA C 50 59.550 59.799 -0.249 1
1 568 . 16 1 1 A 50 50 ILE CB C 50 41.300 41.707 -0.407 1
1 572 . 16 1 1 A 50 50 ILE N N 50 123.220 125.144 -1.924 1
1 573 . 16 1 1 A 51 51 SER H H 51 8.540 8.834 -0.294 1
1 574 . 16 1 1 A 51 51 SER HA H 51 4.830 5.014 -0.184 1
1 577 . 16 1 1 A 51 51 SER C C 51 174.130 173.890 0.240 1
1 578 . 16 1 1 A 51 51 SER CA C 51 57.770 57.104 0.666 1
1 579 . 16 1 1 A 51 51 SER CB C 51 63.040 64.079 -1.039 1
1 580 . 16 1 1 A 51 51 SER N N 51 121.430 122.590 -1.160 1
1 581 . 16 1 1 A 52 52 ILE H H 52 8.930 8.704 0.226 1
1 582 . 16 1 1 A 52 52 ILE HA H 52 4.290 4.618 -0.328 1
1 592 . 16 1 1 A 52 52 ILE C C 52 175.280 176.048 -0.768 1
1 593 . 16 1 1 A 52 52 ILE CA C 52 60.250 60.260 -0.010 1
1 594 . 16 1 1 A 52 52 ILE CB C 52 39.840 40.528 -0.688 1
1 598 . 16 1 1 A 52 52 ILE N N 52 127.060 127.836 -0.776 1
1 599 . 16 1 1 A 53 53 LEU H H 53 9.380 9.476 -0.096 1
1 600 . 16 1 1 A 53 53 LEU HA H 53 3.890 4.098 -0.208 1
1 610 . 16 1 1 A 53 53 LEU C C 53 177.130 176.992 0.138 1
1 611 . 16 1 1 A 53 53 LEU CA C 53 55.560 56.209 -0.649 1
1 612 . 16 1 1 A 53 53 LEU CB C 53 39.370 40.660 -1.290 1
1 616 . 16 1 1 A 53 53 LEU N N 53 126.770 129.629 -2.859 1
1 617 . 16 1 1 A 54 54 GLY H H 54 8.310 8.713 -0.403 1
1 618 . 16 1 1 A 54 54 GLY HA2 H 54 3.490 3.899 -0.409 1
1 619 . 16 1 1 A 54 54 GLY HA3 H 54 4.080 3.900 0.180 1
1 620 . 16 1 1 A 54 54 GLY C C 54 173.690 173.753 -0.063 1
1 621 . 16 1 1 A 54 54 GLY CA C 54 45.340 45.709 -0.369 1
1 622 . 16 1 1 A 54 54 GLY N N 54 103.820 104.382 -0.562 1
1 623 . 16 1 1 A 55 55 LYS H H 55 7.730 7.973 -0.243 1
1 624 . 16 1 1 A 55 55 LYS HA H 55 4.560 4.758 -0.198 1
1 633 . 16 1 1 A 55 55 LYS C C 55 174.550 175.005 -0.455 1
1 634 . 16 1 1 A 55 55 LYS CA C 55 54.140 54.447 -0.307 1
1 635 . 16 1 1 A 55 55 LYS CB C 55 34.620 35.368 -0.748 1
1 639 . 16 1 1 A 55 55 LYS N N 55 121.160 120.108 1.052 1
1 640 . 16 1 1 A 56 56 GLU H H 56 8.490 8.781 -0.291 1
1 641 . 16 1 1 A 56 56 GLU HA H 56 4.280 4.696 -0.416 1
1 646 . 16 1 1 A 56 56 GLU C C 56 175.730 175.201 0.529 1
1 647 . 16 1 1 A 56 56 GLU CA C 56 56.730 56.326 0.404 1
1 648 . 16 1 1 A 56 56 GLU CB C 56 30.070 30.677 -0.607 1
1 650 . 16 1 1 A 56 56 GLU N N 56 124.090 124.697 -0.607 1
1 651 . 16 1 1 A 57 57 VAL H H 57 8.920 8.455 0.465 1
1 652 . 16 1 1 A 57 57 VAL HA H 57 4.030 4.806 -0.776 1
1 660 . 16 1 1 A 57 57 VAL C C 57 174.610 173.732 0.878 1
1 661 . 16 1 1 A 57 57 VAL CA C 57 61.680 59.550 2.130 1
1 662 . 16 1 1 A 57 57 VAL CB C 57 33.880 34.454 -0.574 1
1 665 . 16 1 1 A 57 57 VAL N N 57 129.960 126.614 3.346 1
1 666 . 16 1 1 A 58 58 LYS H H 58 7.860 8.715 -0.855 1
1 667 . 16 1 1 A 58 58 LYS HA H 58 5.120 4.832 0.288 1
1 676 . 16 1 1 A 58 58 LYS C C 58 175.380 175.684 -0.304 1
1 677 . 16 1 1 A 58 58 LYS CA C 58 55.200 54.704 0.496 1
1 678 . 16 1 1 A 58 58 LYS CB C 58 34.670 34.016 0.654 1
1 682 . 16 1 1 A 58 58 LYS N N 58 124.790 127.351 -2.561 1
1 683 . 16 1 1 A 59 59 PHE H H 59 9.270 9.091 0.179 1
1 684 . 16 1 1 A 59 59 PHE HA H 59 4.960 5.109 -0.149 1
1 692 . 16 1 1 A 59 59 PHE C C 59 173.950 174.351 -0.401 1
1 693 . 16 1 1 A 59 59 PHE CA C 59 55.910 56.421 -0.511 1
1 694 . 16 1 1 A 59 59 PHE CB C 59 42.950 41.885 1.065 1
1 700 . 16 1 1 A 59 59 PHE N N 59 118.270 122.893 -4.623 1
1 701 . 16 1 1 A 60 60 LYS H H 60 9.170 8.913 0.257 1
1 702 . 16 1 1 A 60 60 LYS HA H 60 4.910 4.999 -0.089 1
1 711 . 16 1 1 A 60 60 LYS C C 60 176.230 175.907 0.323 1
1 712 . 16 1 1 A 60 60 LYS CA C 60 53.910 54.513 -0.603 1
1 713 . 16 1 1 A 60 60 LYS CB C 60 35.170 34.963 0.207 1
1 717 . 16 1 1 A 60 60 LYS N N 60 121.960 124.339 -2.379 1
1 718 . 16 1 1 A 61 61 VAL H H 61 9.400 8.790 0.610 1
1 719 . 16 1 1 A 61 61 VAL HA H 61 4.170 4.075 0.095 1
1 727 . 16 1 1 A 61 61 VAL C C 61 175.500 175.369 0.131 1
1 728 . 16 1 1 A 61 61 VAL CA C 61 61.980 63.214 -1.234 1
1 729 . 16 1 1 A 61 61 VAL CB C 61 29.490 31.228 -1.738 1
1 732 . 16 1 1 A 61 61 VAL N N 61 127.140 126.960 0.180 1
1 733 . 16 1 1 A 62 62 VAL H H 62 8.390 8.849 -0.459 1
1 734 . 16 1 1 A 62 62 VAL HA H 62 3.650 3.973 -0.323 1
1 742 . 16 1 1 A 62 62 VAL C C 62 176.440 176.028 0.412 1
1 743 . 16 1 1 A 62 62 VAL CA C 62 64.930 64.446 0.484 1
1 744 . 16 1 1 A 62 62 VAL CB C 62 32.130 32.412 -0.282 1
1 747 . 16 1 1 A 62 62 VAL N N 62 132.840 129.237 3.603 1
1 748 . 16 1 1 A 63 63 GLN H H 63 7.470 7.153 0.317 1
1 749 . 16 1 1 A 63 63 GLN HA H 63 4.270 4.768 -0.498 1
1 756 . 16 1 1 A 63 63 GLN C C 63 172.290 173.371 -1.081 1
1 757 . 16 1 1 A 63 63 GLN CA C 63 56.640 55.481 1.159 1
1 758 . 16 1 1 A 63 63 GLN CB C 63 32.630 32.262 0.368 1
1 760 . 16 1 1 A 63 63 GLN N N 63 114.500 116.846 -2.346 1
1 762 . 16 1 1 A 64 64 ALA H H 64 8.200 8.849 -0.649 1
1 763 . 16 1 1 A 64 64 ALA HA H 64 4.830 5.313 -0.483 1
1 767 . 16 1 1 A 64 64 ALA C C 64 174.270 175.696 -1.426 1
1 768 . 16 1 1 A 64 64 ALA CA C 64 50.800 49.976 0.824 1
1 769 . 16 1 1 A 64 64 ALA CB C 64 20.100 21.655 -1.555 1
1 770 . 16 1 1 A 64 64 ALA N N 64 131.410 128.173 3.237 1
1 771 . 16 1 1 A 65 65 TYR H H 65 8.860 8.548 0.312 1
1 772 . 16 1 1 A 65 65 TYR HA H 65 4.540 5.003 -0.463 1
1 779 . 16 1 1 A 65 65 TYR CA C 65 54.270 55.019 -0.749 1
1 780 . 16 1 1 A 65 65 TYR CB C 65 41.360 40.372 0.988 1
1 785 . 16 1 1 A 65 65 TYR N N 65 124.140 119.999 4.141 1
1 786 . 16 1 1 A 66 66 PRO HA H 66 4.120 4.760 -0.640 1
1 793 . 16 1 1 A 66 66 PRO CA C 66 63.450 62.354 1.096 1
1 794 . 16 1 1 A 66 66 PRO CB C 66 34.170 32.769 1.401 1
1 797 . 16 1 1 A 67 67 SER H H 67 7.380 8.236 -0.856 1
1 798 . 16 1 1 A 67 67 SER HA H 67 4.720 4.975 -0.255 1
1 801 . 16 1 1 A 67 67 SER CA C 67 54.250 56.057 -1.807 1
1 802 . 16 1 1 A 67 67 SER CB C 67 64.530 63.822 0.708 1
1 803 . 16 1 1 A 67 67 SER N N 67 106.200 116.674 -10.474 1
1 804 . 16 1 1 A 68 68 PRO HA H 68 4.880 4.629 0.251 1
1 811 . 16 1 1 A 68 68 PRO CA C 68 62.990 62.488 0.502 1
1 812 . 16 1 1 A 68 68 PRO CB C 68 35.220 33.167 2.053 1
1 815 . 16 1 1 A 69 69 LEU H H 69 8.960 8.042 0.918 1
1 816 . 16 1 1 A 69 69 LEU HA H 69 4.430 5.117 -0.687 1
1 826 . 16 1 1 A 69 69 LEU C C 69 174.570 175.302 -0.732 1
1 827 . 16 1 1 A 69 69 LEU CA C 69 53.900 52.625 1.275 1
1 828 . 16 1 1 A 69 69 LEU CB C 69 44.210 46.100 -1.890 1
1 832 . 16 1 1 A 69 69 LEU N N 69 120.480 117.083 3.397 1
1 833 . 16 1 1 A 70 70 ARG H H 70 8.130 8.385 -0.255 1
1 834 . 16 1 1 A 70 70 ARG HA H 70 4.930 4.734 0.196 1
1 841 . 16 1 1 A 70 70 ARG C C 70 175.460 176.283 -0.823 1
1 842 . 16 1 1 A 70 70 ARG CA C 70 54.040 55.690 -1.650 1
1 843 . 16 1 1 A 70 70 ARG CB C 70 30.550 31.671 -1.121 1
1 846 . 16 1 1 A 70 70 ARG N N 70 125.180 119.741 5.439 1
1 847 . 16 1 1 A 71 71 VAL H H 71 8.450 8.247 0.203 1
1 848 . 16 1 1 A 71 71 VAL HA H 71 3.410 4.460 -1.050 1
1 856 . 16 1 1 A 71 71 VAL C C 71 175.460 175.689 -0.229 1
1 857 . 16 1 1 A 71 71 VAL CA C 71 65.210 62.228 2.982 1
1 858 . 16 1 1 A 71 71 VAL CB C 71 29.840 31.698 -1.858 1
1 861 . 16 1 1 A 71 71 VAL N N 71 128.170 122.841 5.329 1
1 862 . 16 1 1 A 72 72 GLU H H 72 8.620 8.684 -0.064 1
1 863 . 16 1 1 A 72 72 GLU HA H 72 4.870 4.723 0.147 1
1 868 . 16 1 1 A 72 72 GLU C C 72 176.960 176.313 0.647 1
1 869 . 16 1 1 A 72 72 GLU CA C 72 54.330 54.206 0.124 1
1 870 . 16 1 1 A 72 72 GLU CB C 72 33.280 32.165 1.115 1
1 872 . 16 1 1 A 72 72 GLU N N 72 127.670 126.857 0.813 1
1 873 . 16 1 1 A 73 73 ASP H H 73 8.700 8.807 -0.107 1
1 874 . 16 1 1 A 73 73 ASP HA H 73 4.150 4.276 -0.126 1
1 877 . 16 1 1 A 73 73 ASP C C 73 177.460 178.130 -0.670 1
1 878 . 16 1 1 A 73 73 ASP CA C 73 57.620 56.627 0.993 1
1 879 . 16 1 1 A 73 73 ASP CB C 73 40.360 40.605 -0.245 1
1 880 . 16 1 1 A 73 73 ASP N N 73 121.140 122.228 -1.088 1
1 881 . 16 1 1 A 74 74 ARG H H 74 7.760 7.621 0.139 1
1 882 . 16 1 1 A 74 74 ARG HA H 74 4.280 4.333 -0.053 1
1 889 . 16 1 1 A 74 74 ARG C C 74 176.510 176.673 -0.163 1
1 890 . 16 1 1 A 74 74 ARG CA C 74 55.450 56.738 -1.288 1
1 891 . 16 1 1 A 74 74 ARG CB C 74 29.990 30.793 -0.803 1
1 894 . 16 1 1 A 74 74 ARG N N 74 112.890 116.875 -3.985 1
1 895 . 16 1 1 A 75 75 THR H H 75 7.700 7.568 0.132 1
1 896 . 16 1 1 A 75 75 THR HA H 75 4.020 4.393 -0.373 1
1 901 . 16 1 1 A 75 75 THR C C 75 173.810 173.924 -0.114 1
1 902 . 16 1 1 A 75 75 THR CA C 75 64.060 63.952 0.108 1
1 903 . 16 1 1 A 75 75 THR CB C 75 69.350 69.345 0.005 1
1 905 . 16 1 1 A 75 75 THR N N 75 120.650 116.343 4.307 1
1 906 . 16 1 1 A 76 76 LYS H H 76 8.520 8.230 0.290 1
1 907 . 16 1 1 A 76 76 LYS HA H 76 4.270 4.675 -0.405 1
1 916 . 16 1 1 A 76 76 LYS C C 76 174.560 175.784 -1.224 1
1 917 . 16 1 1 A 76 76 LYS CA C 76 56.280 55.958 0.322 1
1 918 . 16 1 1 A 76 76 LYS CB C 76 33.120 33.725 -0.605 1
1 922 . 16 1 1 A 76 76 LYS N N 76 130.950 127.223 3.727 1
1 923 . 16 1 1 A 77 77 ILE H H 77 8.430 8.605 -0.175 1
1 924 . 16 1 1 A 77 77 ILE HA H 77 4.850 5.190 -0.340 1
1 934 . 16 1 1 A 77 77 ILE C C 77 174.650 174.852 -0.202 1
1 935 . 16 1 1 A 77 77 ILE CA C 77 59.820 60.171 -0.351 1
1 936 . 16 1 1 A 77 77 ILE CB C 77 38.280 40.882 -2.602 1
1 940 . 16 1 1 A 77 77 ILE N N 77 128.020 122.590 5.430 1
1 941 . 16 1 1 A 78 78 THR H H 78 8.870 8.795 0.075 1
1 942 . 16 1 1 A 78 78 THR HA H 78 4.470 5.119 -0.649 1
1 947 . 16 1 1 A 78 78 THR C C 78 172.760 173.485 -0.725 1
1 948 . 16 1 1 A 78 78 THR CA C 78 60.740 61.479 -0.739 1
1 949 . 16 1 1 A 78 78 THR CB C 78 71.320 71.406 -0.086 1
1 951 . 16 1 1 A 78 78 THR N N 78 123.870 124.138 -0.268 1
1 952 . 16 1 1 A 79 79 LEU H H 79 8.820 8.959 -0.139 1
1 953 . 16 1 1 A 79 79 LEU HA H 79 5.140 5.057 0.083 1
1 963 . 16 1 1 A 79 79 LEU C C 79 176.610 175.912 0.698 1
1 964 . 16 1 1 A 79 79 LEU CA C 79 53.280 53.367 -0.087 1
1 965 . 16 1 1 A 79 79 LEU CB C 79 42.600 42.764 -0.164 1
1 969 . 16 1 1 A 79 79 LEU N N 79 127.070 126.685 0.385 1
1 970 . 16 1 1 A 80 80 VAL H H 80 8.800 8.728 0.072 1
1 971 . 16 1 1 A 80 80 VAL HA H 80 4.260 4.768 -0.508 1
1 979 . 16 1 1 A 80 80 VAL CA C 80 61.350 61.719 -0.369 1
1 980 . 16 1 1 A 80 80 VAL CB C 80 32.790 32.817 -0.027 1
1 983 . 16 1 1 A 80 80 VAL N N 80 124.120 125.606 -1.486 1
1 984 . 16 1 1 A 81 81 THR H H 81 8.160 8.763 -0.603 1
1 985 . 16 1 1 A 81 81 THR HA H 81 4.410 5.341 -0.931 1
1 990 . 16 1 1 A 81 81 THR CA C 81 60.800 60.157 0.643 1
1 991 . 16 1 1 A 81 81 THR CB C 81 69.650 72.514 -2.864 1
1 993 . 16 1 1 A 81 81 THR N N 81 114.500 116.769 -2.269 1
1 1 . 17 1 1 A 9 9 GLY H H 9 8.390 8.734 -0.344 1
1 2 . 17 1 1 A 9 9 GLY HA2 H 9 3.900 3.857 0.043 1
1 3 . 17 1 1 A 9 9 GLY HA3 H 9 3.860 3.858 0.002 1
1 4 . 17 1 1 A 9 9 GLY CA C 9 45.150 47.386 -2.236 1
1 5 . 17 1 1 A 9 9 GLY N N 9 110.000 109.972 0.028 1
1 6 . 17 1 1 A 10 10 VAL H H 10 7.870 8.200 -0.330 1
1 7 . 17 1 1 A 10 10 VAL HA H 10 4.040 4.438 -0.398 1
1 15 . 17 1 1 A 10 10 VAL C C 10 175.880 175.376 0.504 1
1 16 . 17 1 1 A 10 10 VAL CA C 10 62.110 62.141 -0.031 1
1 17 . 17 1 1 A 10 10 VAL CB C 10 32.760 33.081 -0.321 1
1 20 . 17 1 1 A 10 10 VAL N N 10 119.730 123.321 -3.591 1
1 21 . 17 1 1 A 11 11 ILE H H 11 8.230 8.981 -0.751 1
1 22 . 17 1 1 A 11 11 ILE HA H 11 4.090 4.588 -0.498 1
1 32 . 17 1 1 A 11 11 ILE C C 11 175.850 175.116 0.734 1
1 33 . 17 1 1 A 11 11 ILE CA C 11 60.800 59.918 0.882 1
1 34 . 17 1 1 A 11 11 ILE CB C 11 38.470 38.551 -0.081 1
1 38 . 17 1 1 A 11 11 ILE N N 11 125.570 128.522 -2.952 1
1 39 . 17 1 1 A 12 12 MET H H 12 8.370 8.668 -0.298 1
1 40 . 17 1 1 A 12 12 MET HA H 12 4.540 4.982 -0.442 1
1 48 . 17 1 1 A 12 12 MET C C 12 174.830 175.713 -0.883 1
1 49 . 17 1 1 A 12 12 MET CA C 12 54.790 53.986 0.804 1
1 50 . 17 1 1 A 12 12 MET CB C 12 32.640 33.435 -0.795 1
1 53 . 17 1 1 A 12 12 MET N N 12 125.930 127.487 -1.557 1
1 54 . 17 1 1 A 13 13 SER H H 13 7.990 8.739 -0.749 1
1 55 . 17 1 1 A 13 13 SER HA H 13 5.030 5.443 -0.413 1
1 58 . 17 1 1 A 13 13 SER C C 13 174.330 173.815 0.515 1
1 59 . 17 1 1 A 13 13 SER CA C 13 57.320 55.971 1.349 1
1 60 . 17 1 1 A 13 13 SER CB C 13 64.790 66.109 -1.319 1
1 61 . 17 1 1 A 13 13 SER N N 13 116.400 118.371 -1.971 1
1 62 . 17 1 1 A 14 14 GLU H H 14 9.430 8.639 0.791 1
1 63 . 17 1 1 A 14 14 GLU HA H 14 5.250 5.415 -0.165 1
1 68 . 17 1 1 A 14 14 GLU C C 14 172.980 174.710 -1.730 1
1 69 . 17 1 1 A 14 14 GLU CA C 14 55.390 55.038 0.352 1
1 70 . 17 1 1 A 14 14 GLU CB C 14 33.910 34.490 -0.580 1
1 72 . 17 1 1 A 14 14 GLU N N 14 123.670 120.062 3.608 1
1 73 . 17 1 1 A 15 15 LEU H H 15 8.930 8.894 0.036 1
1 74 . 17 1 1 A 15 15 LEU HA H 15 4.870 5.163 -0.293 1
1 84 . 17 1 1 A 15 15 LEU C C 15 174.000 174.414 -0.414 1
1 85 . 17 1 1 A 15 15 LEU CA C 15 53.020 53.462 -0.442 1
1 86 . 17 1 1 A 15 15 LEU CB C 15 46.040 45.812 0.228 1
1 90 . 17 1 1 A 15 15 LEU N N 15 125.350 125.535 -0.185 1
1 91 . 17 1 1 A 16 16 LYS H H 16 8.840 8.747 0.093 1
1 92 . 17 1 1 A 16 16 LYS HA H 16 5.360 4.888 0.472 1
1 101 . 17 1 1 A 16 16 LYS C C 16 175.660 175.410 0.250 1
1 102 . 17 1 1 A 16 16 LYS CA C 16 54.940 55.612 -0.672 1
1 103 . 17 1 1 A 16 16 LYS CB C 16 34.280 33.655 0.625 1
1 107 . 17 1 1 A 16 16 LYS N N 16 124.640 126.863 -2.223 1
1 108 . 17 1 1 A 17 17 LEU H H 17 8.820 9.028 -0.208 1
1 109 . 17 1 1 A 17 17 LEU HA H 17 5.430 5.238 0.192 1
1 119 . 17 1 1 A 17 17 LEU C C 17 174.630 175.831 -1.201 1
1 120 . 17 1 1 A 17 17 LEU CA C 17 52.900 53.410 -0.510 1
1 121 . 17 1 1 A 17 17 LEU CB C 17 46.910 45.368 1.542 1
1 125 . 17 1 1 A 17 17 LEU N N 17 123.460 126.872 -3.412 1
1 126 . 17 1 1 A 18 18 LYS H H 18 9.110 8.603 0.507 1
1 127 . 17 1 1 A 18 18 LYS HA H 18 5.490 5.044 0.446 1
1 136 . 17 1 1 A 18 18 LYS CA C 18 52.270 52.946 -0.676 1
1 137 . 17 1 1 A 18 18 LYS CB C 18 37.500 36.455 1.045 1
1 141 . 17 1 1 A 18 18 LYS N N 18 122.230 123.128 -0.898 1
1 142 . 17 1 1 A 19 19 PRO HA H 19 4.100 4.390 -0.290 1
1 149 . 17 1 1 A 19 19 PRO CA C 19 62.440 62.290 0.150 1
1 150 . 17 1 1 A 19 19 PRO CB C 19 30.640 32.275 -1.635 1
1 153 . 17 1 1 A 20 20 LEU H H 20 8.490 8.381 0.109 1
1 154 . 17 1 1 A 20 20 LEU HA H 20 4.320 4.163 0.157 1
1 164 . 17 1 1 A 20 20 LEU CA C 20 57.680 58.707 -1.027 1
1 165 . 17 1 1 A 20 20 LEU CB C 20 38.760 40.658 -1.898 1
1 169 . 17 1 1 A 20 20 LEU N N 20 123.250 119.744 3.506 1
1 170 . 17 1 1 A 21 21 PRO HA H 21 4.530 4.528 0.002 1
1 177 . 17 1 1 A 21 21 PRO CA C 21 62.880 62.355 0.525 1
1 178 . 17 1 1 A 21 21 PRO CB C 21 31.420 32.433 -1.013 1
1 181 . 17 1 1 A 22 22 LYS H H 22 8.180 8.337 -0.157 1
1 182 . 17 1 1 A 22 22 LYS HA H 22 4.110 4.492 -0.382 1
1 191 . 17 1 1 A 22 22 LYS C C 22 175.680 175.284 0.396 1
1 192 . 17 1 1 A 22 22 LYS CA C 22 56.210 55.733 0.477 1
1 193 . 17 1 1 A 22 22 LYS CB C 22 30.660 31.852 -1.192 1
1 197 . 17 1 1 A 22 22 LYS N N 22 119.160 121.597 -2.437 1
1 198 . 17 1 1 A 23 23 VAL H H 23 7.530 7.888 -0.358 1
1 199 . 17 1 1 A 23 23 VAL HA H 23 4.280 4.742 -0.462 1
1 207 . 17 1 1 A 23 23 VAL C C 23 173.690 173.569 0.121 1
1 208 . 17 1 1 A 23 23 VAL CA C 23 59.830 59.584 0.246 1
1 209 . 17 1 1 A 23 23 VAL CB C 23 34.550 35.474 -0.924 1
1 212 . 17 1 1 A 23 23 VAL N N 23 121.820 124.824 -3.004 1
1 213 . 17 1 1 A 24 24 GLU H H 24 8.270 8.857 -0.587 1
1 214 . 17 1 1 A 24 24 GLU HA H 24 4.330 4.991 -0.661 1
1 219 . 17 1 1 A 24 24 GLU C C 24 175.390 174.783 0.607 1
1 220 . 17 1 1 A 24 24 GLU CA C 24 55.220 54.645 0.575 1
1 221 . 17 1 1 A 24 24 GLU CB C 24 29.970 32.731 -2.761 1
1 223 . 17 1 1 A 24 24 GLU N N 24 125.610 126.481 -0.871 1
1 224 . 17 1 1 A 25 25 LEU H H 25 8.480 8.745 -0.265 1
1 225 . 17 1 1 A 25 25 LEU HA H 25 4.520 4.394 0.126 1
1 235 . 17 1 1 A 25 25 LEU CA C 25 51.660 51.982 -0.322 1
1 236 . 17 1 1 A 25 25 LEU CB C 25 41.750 41.123 0.627 1
1 240 . 17 1 1 A 25 25 LEU N N 25 125.880 124.716 1.164 1
1 241 . 17 1 1 A 26 26 PRO HA H 26 4.760 4.583 0.177 1
1 248 . 17 1 1 A 26 26 PRO CA C 26 61.330 61.887 -0.557 1
1 249 . 17 1 1 A 26 26 PRO CB C 26 31.060 32.701 -1.641 1
1 252 . 17 1 1 A 27 27 PRO HA H 27 4.390 4.398 -0.008 1
1 259 . 17 1 1 A 27 27 PRO CA C 27 64.550 64.842 -0.292 1
1 260 . 17 1 1 A 27 27 PRO CB C 27 31.770 31.738 0.032 1
1 263 . 17 1 1 A 28 28 ASP H H 28 8.560 8.776 -0.216 1
1 264 . 17 1 1 A 28 28 ASP HA H 28 4.620 4.416 0.204 1
1 267 . 17 1 1 A 28 28 ASP C C 28 177.100 178.831 -1.731 1
1 268 . 17 1 1 A 28 28 ASP CA C 28 53.890 56.312 -2.422 1
1 269 . 17 1 1 A 28 28 ASP CB C 28 39.120 39.557 -0.437 1
1 270 . 17 1 1 A 28 28 ASP N N 28 115.820 117.824 -2.004 1
1 271 . 17 1 1 A 29 29 PHE H H 29 7.940 8.008 -0.068 1
1 272 . 17 1 1 A 29 29 PHE HA H 29 4.180 4.304 -0.124 1
1 280 . 17 1 1 A 29 29 PHE C C 29 176.740 178.234 -1.494 1
1 281 . 17 1 1 A 29 29 PHE CA C 29 61.020 61.015 0.005 1
1 282 . 17 1 1 A 29 29 PHE CB C 29 39.230 38.794 0.436 1
1 288 . 17 1 1 A 29 29 PHE N N 29 119.610 118.200 1.410 1
1 289 . 17 1 1 A 30 30 VAL H H 30 8.010 8.470 -0.460 1
1 290 . 17 1 1 A 30 30 VAL HA H 30 3.350 3.764 -0.414 1
1 298 . 17 1 1 A 30 30 VAL C C 30 176.400 177.377 -0.977 1
1 299 . 17 1 1 A 30 30 VAL CA C 30 66.510 64.820 1.690 1
1 300 . 17 1 1 A 30 30 VAL CB C 30 31.020 31.060 -0.040 1
1 303 . 17 1 1 A 30 30 VAL N N 30 116.370 119.561 -3.191 1
1 304 . 17 1 1 A 31 31 ASP H H 31 7.420 8.148 -0.728 1
1 305 . 17 1 1 A 31 31 ASP HA H 31 4.310 4.365 -0.055 1
1 308 . 17 1 1 A 31 31 ASP C C 31 178.360 178.624 -0.264 1
1 309 . 17 1 1 A 31 31 ASP CA C 31 57.110 57.345 -0.235 1
1 310 . 17 1 1 A 31 31 ASP CB C 31 40.450 41.158 -0.708 1
1 311 . 17 1 1 A 31 31 ASP N N 31 119.190 121.625 -2.435 1
1 312 . 17 1 1 A 32 32 VAL H H 32 7.190 7.520 -0.330 1
1 313 . 17 1 1 A 32 32 VAL HA H 32 3.510 3.546 -0.036 1
1 321 . 17 1 1 A 32 32 VAL C C 32 178.100 178.530 -0.430 1
1 322 . 17 1 1 A 32 32 VAL CA C 32 65.570 66.368 -0.798 1
1 323 . 17 1 1 A 32 32 VAL CB C 32 31.410 31.275 0.135 1
1 326 . 17 1 1 A 32 32 VAL N N 32 119.830 119.057 0.773 1
1 327 . 17 1 1 A 33 33 ILE H H 33 7.660 8.448 -0.788 1
1 328 . 17 1 1 A 33 33 ILE HA H 33 3.170 3.530 -0.360 1
1 338 . 17 1 1 A 33 33 ILE C C 33 176.660 178.055 -1.395 1
1 339 . 17 1 1 A 33 33 ILE CA C 33 65.220 65.195 0.025 1
1 340 . 17 1 1 A 33 33 ILE CB C 33 37.500 37.677 -0.177 1
1 344 . 17 1 1 A 33 33 ILE N N 33 118.490 120.824 -2.334 1
1 345 . 17 1 1 A 34 34 ARG H H 34 7.830 7.748 0.082 1
1 346 . 17 1 1 A 34 34 ARG HA H 34 3.380 3.895 -0.515 1
1 354 . 17 1 1 A 34 34 ARG C C 34 178.060 177.585 0.475 1
1 355 . 17 1 1 A 34 34 ARG CA C 34 60.570 58.911 1.659 1
1 356 . 17 1 1 A 34 34 ARG CB C 34 30.070 29.819 0.251 1
1 359 . 17 1 1 A 34 34 ARG N N 34 118.260 120.013 -1.753 1
1 361 . 17 1 1 A 35 35 ILE H H 35 7.350 7.866 -0.516 1
1 362 . 17 1 1 A 35 35 ILE HA H 35 3.720 3.700 0.020 1
1 372 . 17 1 1 A 35 35 ILE C C 35 179.090 178.011 1.079 1
1 373 . 17 1 1 A 35 35 ILE CA C 35 64.060 65.392 -1.332 1
1 374 . 17 1 1 A 35 35 ILE CB C 35 38.030 37.345 0.685 1
1 378 . 17 1 1 A 35 35 ILE N N 35 116.750 119.592 -2.842 1
1 379 . 17 1 1 A 36 36 LYS H H 36 7.880 7.678 0.202 1
1 380 . 17 1 1 A 36 36 LYS HA H 36 4.090 3.924 0.166 1
1 389 . 17 1 1 A 36 36 LYS C C 36 178.560 178.998 -0.438 1
1 390 . 17 1 1 A 36 36 LYS CA C 36 57.650 59.846 -2.196 1
1 391 . 17 1 1 A 36 36 LYS CB C 36 32.090 32.311 -0.221 1
1 395 . 17 1 1 A 36 36 LYS N N 36 118.700 119.785 -1.085 1
1 396 . 17 1 1 A 37 37 LEU H H 37 7.860 7.400 0.460 1
1 397 . 17 1 1 A 37 37 LEU HA H 37 4.230 4.280 -0.050 1
1 407 . 17 1 1 A 37 37 LEU C C 37 175.880 176.772 -0.892 1
1 408 . 17 1 1 A 37 37 LEU CA C 37 54.090 55.706 -1.616 1
1 409 . 17 1 1 A 37 37 LEU CB C 37 43.310 42.535 0.775 1
1 413 . 17 1 1 A 37 37 LEU N N 37 116.380 117.420 -1.040 1
1 414 . 17 1 1 A 38 38 GLN H H 38 7.190 7.483 -0.293 1
1 415 . 17 1 1 A 38 38 GLN HA H 38 3.530 4.480 -0.950 1
1 422 . 17 1 1 A 38 38 GLN C C 38 177.480 176.266 1.214 1
1 423 . 17 1 1 A 38 38 GLN CA C 38 58.370 56.847 1.523 1
1 424 . 17 1 1 A 38 38 GLN CB C 38 28.300 28.684 -0.384 1
1 426 . 17 1 1 A 38 38 GLN N N 38 119.210 117.646 1.564 1
1 428 . 17 1 1 A 39 39 GLY H H 39 8.940 8.798 0.142 1
1 429 . 17 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 17 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 17 1 1 A 39 39 GLY C C 39 174.070 174.407 -0.337 1
1 432 . 17 1 1 A 39 39 GLY CA C 39 45.280 45.040 0.240 1
1 433 . 17 1 1 A 39 39 GLY N N 39 113.490 112.406 1.084 1
1 434 . 17 1 1 A 40 40 LYS H H 40 8.350 7.636 0.714 1
1 435 . 17 1 1 A 40 40 LYS HA H 40 4.400 4.605 -0.205 1
1 444 . 17 1 1 A 40 40 LYS C C 40 175.560 175.731 -0.171 1
1 445 . 17 1 1 A 40 40 LYS CA C 40 55.660 54.701 0.959 1
1 446 . 17 1 1 A 40 40 LYS CB C 40 32.870 33.743 -0.873 1
1 450 . 17 1 1 A 40 40 LYS N N 40 122.060 119.984 2.076 1
1 451 . 17 1 1 A 41 41 THR H H 41 8.410 8.563 -0.153 1
1 452 . 17 1 1 A 41 41 THR HA H 41 5.330 5.026 0.304 1
1 457 . 17 1 1 A 41 41 THR C C 41 174.860 174.385 0.475 1
1 458 . 17 1 1 A 41 41 THR CA C 41 62.040 61.705 0.335 1
1 459 . 17 1 1 A 41 41 THR CB C 41 69.420 70.901 -1.481 1
1 461 . 17 1 1 A 41 41 THR N N 41 118.150 117.491 0.659 1
1 462 . 17 1 1 A 42 42 VAL H H 42 9.140 9.129 0.011 1
1 463 . 17 1 1 A 42 42 VAL HA H 42 4.570 5.023 -0.453 1
1 471 . 17 1 1 A 42 42 VAL C C 42 172.970 173.639 -0.669 1
1 472 . 17 1 1 A 42 42 VAL CA C 42 59.450 59.301 0.149 1
1 473 . 17 1 1 A 42 42 VAL CB C 42 35.880 35.363 0.517 1
1 476 . 17 1 1 A 42 42 VAL N N 42 122.510 120.659 1.851 1
1 477 . 17 1 1 A 43 43 ARG H H 43 8.420 8.747 -0.327 1
1 478 . 17 1 1 A 43 43 ARG HA H 43 4.750 4.963 -0.213 1
1 485 . 17 1 1 A 43 43 ARG C C 43 175.650 174.925 0.725 1
1 486 . 17 1 1 A 43 43 ARG CA C 43 53.650 54.107 -0.457 1
1 487 . 17 1 1 A 43 43 ARG CB C 43 33.870 33.898 -0.028 1
1 490 . 17 1 1 A 43 43 ARG N N 43 120.640 122.786 -2.146 1
1 491 . 17 1 1 A 44 44 THR H H 44 8.370 8.568 -0.198 1
1 492 . 17 1 1 A 44 44 THR HA H 44 3.410 3.767 -0.357 1
1 497 . 17 1 1 A 44 44 THR C C 44 175.020 175.814 -0.794 1
1 498 . 17 1 1 A 44 44 THR CA C 44 65.660 65.046 0.614 1
1 499 . 17 1 1 A 44 44 THR CB C 44 69.400 68.340 1.060 1
1 501 . 17 1 1 A 44 44 THR N N 44 118.590 119.350 -0.760 1
1 502 . 17 1 1 A 45 45 GLY H H 45 9.090 8.722 0.368 1
1 503 . 17 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 17 1 1 A 45 45 GLY HA3 H 45 4.470 4.021 0.449 1
1 505 . 17 1 1 A 45 45 GLY C C 45 174.350 173.844 0.506 1
1 506 . 17 1 1 A 45 45 GLY CA C 45 45.000 44.942 0.058 1
1 507 . 17 1 1 A 45 45 GLY N N 45 117.350 115.018 2.332 1
1 508 . 17 1 1 A 46 46 ASP H H 46 8.010 7.911 0.099 1
1 509 . 17 1 1 A 46 46 ASP HA H 46 4.470 4.625 -0.155 1
1 512 . 17 1 1 A 46 46 ASP C C 46 174.570 174.380 0.190 1
1 513 . 17 1 1 A 46 46 ASP CA C 46 55.570 55.430 0.140 1
1 514 . 17 1 1 A 46 46 ASP CB C 46 41.680 41.556 0.124 1
1 515 . 17 1 1 A 46 46 ASP N N 46 122.240 122.238 0.002 1
1 516 . 17 1 1 A 47 47 VAL H H 47 8.330 8.436 -0.106 1
1 517 . 17 1 1 A 47 47 VAL HA H 47 4.950 4.917 0.033 1
1 525 . 17 1 1 A 47 47 VAL C C 47 176.330 175.599 0.731 1
1 526 . 17 1 1 A 47 47 VAL CA C 47 61.710 60.861 0.849 1
1 527 . 17 1 1 A 47 47 VAL CB C 47 32.900 35.319 -2.419 1
1 530 . 17 1 1 A 47 47 VAL N N 47 119.860 121.832 -1.972 1
1 531 . 17 1 1 A 48 48 ILE H H 48 9.160 8.717 0.443 1
1 532 . 17 1 1 A 48 48 ILE HA H 48 4.630 5.178 -0.548 1
1 542 . 17 1 1 A 48 48 ILE C C 48 174.400 174.395 0.005 1
1 543 . 17 1 1 A 48 48 ILE CA C 48 58.990 59.284 -0.294 1
1 544 . 17 1 1 A 48 48 ILE CB C 48 41.810 42.093 -0.283 1
1 548 . 17 1 1 A 48 48 ILE N N 48 124.990 121.462 3.528 1
1 549 . 17 1 1 A 49 49 GLY H H 49 8.660 8.921 -0.261 1
1 550 . 17 1 1 A 49 49 GLY HA2 H 49 4.950 4.312 0.638 1
1 551 . 17 1 1 A 49 49 GLY HA3 H 49 3.620 4.354 -0.734 1
1 552 . 17 1 1 A 49 49 GLY C C 49 172.920 171.992 0.928 1
1 553 . 17 1 1 A 49 49 GLY CA C 49 44.580 44.378 0.202 1
1 554 . 17 1 1 A 49 49 GLY N N 49 112.060 109.311 2.749 1
1 555 . 17 1 1 A 50 50 ILE H H 50 8.810 9.010 -0.200 1
1 556 . 17 1 1 A 50 50 ILE HA H 50 4.370 4.798 -0.428 1
1 566 . 17 1 1 A 50 50 ILE C C 50 174.500 174.703 -0.203 1
1 567 . 17 1 1 A 50 50 ILE CA C 50 59.550 59.849 -0.299 1
1 568 . 17 1 1 A 50 50 ILE CB C 50 41.300 41.856 -0.556 1
1 572 . 17 1 1 A 50 50 ILE N N 50 123.220 124.937 -1.717 1
1 573 . 17 1 1 A 51 51 SER H H 51 8.540 8.861 -0.321 1
1 574 . 17 1 1 A 51 51 SER HA H 51 4.830 5.015 -0.185 1
1 577 . 17 1 1 A 51 51 SER C C 51 174.130 173.864 0.266 1
1 578 . 17 1 1 A 51 51 SER CA C 51 57.770 57.116 0.654 1
1 579 . 17 1 1 A 51 51 SER CB C 51 63.040 64.017 -0.977 1
1 580 . 17 1 1 A 51 51 SER N N 51 121.430 122.571 -1.141 1
1 581 . 17 1 1 A 52 52 ILE H H 52 8.930 8.733 0.197 1
1 582 . 17 1 1 A 52 52 ILE HA H 52 4.290 4.608 -0.318 1
1 592 . 17 1 1 A 52 52 ILE C C 52 175.280 176.087 -0.807 1
1 593 . 17 1 1 A 52 52 ILE CA C 52 60.250 60.303 -0.053 1
1 594 . 17 1 1 A 52 52 ILE CB C 52 39.840 40.462 -0.622 1
1 598 . 17 1 1 A 52 52 ILE N N 52 127.060 127.834 -0.774 1
1 599 . 17 1 1 A 53 53 LEU H H 53 9.380 9.489 -0.109 1
1 600 . 17 1 1 A 53 53 LEU HA H 53 3.890 4.097 -0.207 1
1 610 . 17 1 1 A 53 53 LEU C C 53 177.130 176.992 0.138 1
1 611 . 17 1 1 A 53 53 LEU CA C 53 55.560 56.207 -0.647 1
1 612 . 17 1 1 A 53 53 LEU CB C 53 39.370 40.658 -1.288 1
1 616 . 17 1 1 A 53 53 LEU N N 53 126.770 129.946 -3.176 1
1 617 . 17 1 1 A 54 54 GLY H H 54 8.310 8.711 -0.401 1
1 618 . 17 1 1 A 54 54 GLY HA2 H 54 3.490 3.905 -0.415 1
1 619 . 17 1 1 A 54 54 GLY HA3 H 54 4.080 3.906 0.174 1
1 620 . 17 1 1 A 54 54 GLY C C 54 173.690 173.968 -0.278 1
1 621 . 17 1 1 A 54 54 GLY CA C 54 45.340 45.783 -0.443 1
1 622 . 17 1 1 A 54 54 GLY N N 54 103.820 104.382 -0.562 1
1 623 . 17 1 1 A 55 55 LYS H H 55 7.730 7.842 -0.112 1
1 624 . 17 1 1 A 55 55 LYS HA H 55 4.560 4.818 -0.258 1
1 633 . 17 1 1 A 55 55 LYS C C 55 174.550 175.118 -0.568 1
1 634 . 17 1 1 A 55 55 LYS CA C 55 54.140 55.013 -0.873 1
1 635 . 17 1 1 A 55 55 LYS CB C 55 34.620 35.387 -0.767 1
1 639 . 17 1 1 A 55 55 LYS N N 55 121.160 120.399 0.761 1
1 640 . 17 1 1 A 56 56 GLU H H 56 8.490 8.812 -0.322 1
1 641 . 17 1 1 A 56 56 GLU HA H 56 4.280 4.693 -0.413 1
1 646 . 17 1 1 A 56 56 GLU C C 56 175.730 175.226 0.504 1
1 647 . 17 1 1 A 56 56 GLU CA C 56 56.730 56.325 0.405 1
1 648 . 17 1 1 A 56 56 GLU CB C 56 30.070 30.684 -0.614 1
1 650 . 17 1 1 A 56 56 GLU N N 56 124.090 128.429 -4.339 1
1 651 . 17 1 1 A 57 57 VAL H H 57 8.920 8.433 0.487 1
1 652 . 17 1 1 A 57 57 VAL HA H 57 4.030 4.831 -0.801 1
1 660 . 17 1 1 A 57 57 VAL C C 57 174.610 173.808 0.802 1
1 661 . 17 1 1 A 57 57 VAL CA C 57 61.680 59.530 2.150 1
1 662 . 17 1 1 A 57 57 VAL CB C 57 33.880 34.436 -0.556 1
1 665 . 17 1 1 A 57 57 VAL N N 57 129.960 126.756 3.204 1
1 666 . 17 1 1 A 58 58 LYS H H 58 7.860 8.729 -0.869 1
1 667 . 17 1 1 A 58 58 LYS HA H 58 5.120 4.821 0.299 1
1 676 . 17 1 1 A 58 58 LYS C C 58 175.380 175.807 -0.427 1
1 677 . 17 1 1 A 58 58 LYS CA C 58 55.200 54.818 0.382 1
1 678 . 17 1 1 A 58 58 LYS CB C 58 34.670 34.192 0.478 1
1 682 . 17 1 1 A 58 58 LYS N N 58 124.790 127.368 -2.578 1
1 683 . 17 1 1 A 59 59 PHE H H 59 9.270 9.120 0.150 1
1 684 . 17 1 1 A 59 59 PHE HA H 59 4.960 5.179 -0.219 1
1 692 . 17 1 1 A 59 59 PHE C C 59 173.950 174.285 -0.335 1
1 693 . 17 1 1 A 59 59 PHE CA C 59 55.910 56.216 -0.306 1
1 694 . 17 1 1 A 59 59 PHE CB C 59 42.950 42.158 0.792 1
1 700 . 17 1 1 A 59 59 PHE N N 59 118.270 122.707 -4.437 1
1 701 . 17 1 1 A 60 60 LYS H H 60 9.170 8.876 0.294 1
1 702 . 17 1 1 A 60 60 LYS HA H 60 4.910 5.000 -0.090 1
1 711 . 17 1 1 A 60 60 LYS C C 60 176.230 175.925 0.305 1
1 712 . 17 1 1 A 60 60 LYS CA C 60 53.910 54.514 -0.604 1
1 713 . 17 1 1 A 60 60 LYS CB C 60 35.170 35.097 0.073 1
1 717 . 17 1 1 A 60 60 LYS N N 60 121.960 124.134 -2.174 1
1 718 . 17 1 1 A 61 61 VAL H H 61 9.400 8.811 0.589 1
1 719 . 17 1 1 A 61 61 VAL HA H 61 4.170 4.051 0.119 1
1 727 . 17 1 1 A 61 61 VAL C C 61 175.500 175.385 0.115 1
1 728 . 17 1 1 A 61 61 VAL CA C 61 61.980 63.281 -1.301 1
1 729 . 17 1 1 A 61 61 VAL CB C 61 29.490 31.171 -1.681 1
1 732 . 17 1 1 A 61 61 VAL N N 61 127.140 127.018 0.122 1
1 733 . 17 1 1 A 62 62 VAL H H 62 8.390 8.724 -0.334 1
1 734 . 17 1 1 A 62 62 VAL HA H 62 3.650 3.971 -0.321 1
1 742 . 17 1 1 A 62 62 VAL C C 62 176.440 176.025 0.415 1
1 743 . 17 1 1 A 62 62 VAL CA C 62 64.930 64.436 0.494 1
1 744 . 17 1 1 A 62 62 VAL CB C 62 32.130 32.399 -0.269 1
1 747 . 17 1 1 A 62 62 VAL N N 62 132.840 129.360 3.480 1
1 748 . 17 1 1 A 63 63 GLN H H 63 7.470 7.135 0.335 1
1 749 . 17 1 1 A 63 63 GLN HA H 63 4.270 4.502 -0.232 1
1 756 . 17 1 1 A 63 63 GLN C C 63 172.290 173.394 -1.104 1
1 757 . 17 1 1 A 63 63 GLN CA C 63 56.640 55.512 1.128 1
1 758 . 17 1 1 A 63 63 GLN CB C 63 32.630 32.325 0.305 1
1 760 . 17 1 1 A 63 63 GLN N N 63 114.500 116.779 -2.279 1
1 762 . 17 1 1 A 64 64 ALA H H 64 8.200 8.307 -0.107 1
1 763 . 17 1 1 A 64 64 ALA HA H 64 4.830 5.348 -0.518 1
1 767 . 17 1 1 A 64 64 ALA C C 64 174.270 175.449 -1.179 1
1 768 . 17 1 1 A 64 64 ALA CA C 64 50.800 49.993 0.807 1
1 769 . 17 1 1 A 64 64 ALA CB C 64 20.100 21.912 -1.812 1
1 770 . 17 1 1 A 64 64 ALA N N 64 131.410 128.417 2.993 1
1 771 . 17 1 1 A 65 65 TYR H H 65 8.860 8.535 0.325 1
1 772 . 17 1 1 A 65 65 TYR HA H 65 4.540 4.965 -0.425 1
1 779 . 17 1 1 A 65 65 TYR CA C 65 54.270 55.131 -0.861 1
1 780 . 17 1 1 A 65 65 TYR CB C 65 41.360 40.580 0.780 1
1 785 . 17 1 1 A 65 65 TYR N N 65 124.140 119.968 4.172 1
1 786 . 17 1 1 A 66 66 PRO HA H 66 4.120 4.752 -0.632 1
1 793 . 17 1 1 A 66 66 PRO CA C 66 63.450 62.365 1.085 1
1 794 . 17 1 1 A 66 66 PRO CB C 66 34.170 32.738 1.432 1
1 797 . 17 1 1 A 67 67 SER H H 67 7.380 8.232 -0.852 1
1 798 . 17 1 1 A 67 67 SER HA H 67 4.720 5.017 -0.297 1
1 801 . 17 1 1 A 67 67 SER CA C 67 54.250 56.053 -1.803 1
1 802 . 17 1 1 A 67 67 SER CB C 67 64.530 63.771 0.759 1
1 803 . 17 1 1 A 67 67 SER N N 67 106.200 116.675 -10.475 1
1 804 . 17 1 1 A 68 68 PRO HA H 68 4.880 4.651 0.229 1
1 811 . 17 1 1 A 68 68 PRO CA C 68 62.990 62.496 0.494 1
1 812 . 17 1 1 A 68 68 PRO CB C 68 35.220 33.223 1.997 1
1 815 . 17 1 1 A 69 69 LEU H H 69 8.960 8.033 0.927 1
1 816 . 17 1 1 A 69 69 LEU HA H 69 4.430 5.116 -0.686 1
1 826 . 17 1 1 A 69 69 LEU C C 69 174.570 175.289 -0.719 1
1 827 . 17 1 1 A 69 69 LEU CA C 69 53.900 52.588 1.312 1
1 828 . 17 1 1 A 69 69 LEU CB C 69 44.210 46.100 -1.890 1
1 832 . 17 1 1 A 69 69 LEU N N 69 120.480 117.053 3.427 1
1 833 . 17 1 1 A 70 70 ARG H H 70 8.130 8.380 -0.250 1
1 834 . 17 1 1 A 70 70 ARG HA H 70 4.930 4.758 0.172 1
1 841 . 17 1 1 A 70 70 ARG C C 70 175.460 176.260 -0.800 1
1 842 . 17 1 1 A 70 70 ARG CA C 70 54.040 55.666 -1.626 1
1 843 . 17 1 1 A 70 70 ARG CB C 70 30.550 31.746 -1.196 1
1 846 . 17 1 1 A 70 70 ARG N N 70 125.180 119.643 5.537 1
1 847 . 17 1 1 A 71 71 VAL H H 71 8.450 8.303 0.147 1
1 848 . 17 1 1 A 71 71 VAL HA H 71 3.410 4.429 -1.019 1
1 856 . 17 1 1 A 71 71 VAL C C 71 175.460 175.470 -0.010 1
1 857 . 17 1 1 A 71 71 VAL CA C 71 65.210 62.336 2.874 1
1 858 . 17 1 1 A 71 71 VAL CB C 71 29.840 31.522 -1.682 1
1 861 . 17 1 1 A 71 71 VAL N N 71 128.170 122.718 5.452 1
1 862 . 17 1 1 A 72 72 GLU H H 72 8.620 8.585 0.035 1
1 863 . 17 1 1 A 72 72 GLU HA H 72 4.870 4.815 0.055 1
1 868 . 17 1 1 A 72 72 GLU C C 72 176.960 175.846 1.114 1
1 869 . 17 1 1 A 72 72 GLU CA C 72 54.330 54.437 -0.107 1
1 870 . 17 1 1 A 72 72 GLU CB C 72 33.280 33.227 0.053 1
1 872 . 17 1 1 A 72 72 GLU N N 72 127.670 127.063 0.607 1
1 873 . 17 1 1 A 73 73 ASP H H 73 8.700 8.957 -0.257 1
1 874 . 17 1 1 A 73 73 ASP HA H 73 4.150 4.263 -0.113 1
1 877 . 17 1 1 A 73 73 ASP C C 73 177.460 178.109 -0.649 1
1 878 . 17 1 1 A 73 73 ASP CA C 73 57.620 56.738 0.882 1
1 879 . 17 1 1 A 73 73 ASP CB C 73 40.360 40.570 -0.210 1
1 880 . 17 1 1 A 73 73 ASP N N 73 121.140 124.449 -3.309 1
1 881 . 17 1 1 A 74 74 ARG H H 74 7.760 7.727 0.033 1
1 882 . 17 1 1 A 74 74 ARG HA H 74 4.280 4.330 -0.050 1
1 889 . 17 1 1 A 74 74 ARG C C 74 176.510 176.772 -0.262 1
1 890 . 17 1 1 A 74 74 ARG CA C 74 55.450 57.044 -1.594 1
1 891 . 17 1 1 A 74 74 ARG CB C 74 29.990 30.853 -0.863 1
1 894 . 17 1 1 A 74 74 ARG N N 74 112.890 116.815 -3.925 1
1 895 . 17 1 1 A 75 75 THR H H 75 7.700 7.495 0.205 1
1 896 . 17 1 1 A 75 75 THR HA H 75 4.020 4.353 -0.333 1
1 901 . 17 1 1 A 75 75 THR C C 75 173.810 173.872 -0.062 1
1 902 . 17 1 1 A 75 75 THR CA C 75 64.060 63.817 0.243 1
1 903 . 17 1 1 A 75 75 THR CB C 75 69.350 69.365 -0.015 1
1 905 . 17 1 1 A 75 75 THR N N 75 120.650 115.989 4.661 1
1 906 . 17 1 1 A 76 76 LYS H H 76 8.520 8.309 0.211 1
1 907 . 17 1 1 A 76 76 LYS HA H 76 4.270 4.711 -0.441 1
1 916 . 17 1 1 A 76 76 LYS C C 76 174.560 175.702 -1.142 1
1 917 . 17 1 1 A 76 76 LYS CA C 76 56.280 55.741 0.539 1
1 918 . 17 1 1 A 76 76 LYS CB C 76 33.120 33.863 -0.743 1
1 922 . 17 1 1 A 76 76 LYS N N 76 130.950 127.299 3.651 1
1 923 . 17 1 1 A 77 77 ILE H H 77 8.430 8.594 -0.164 1
1 924 . 17 1 1 A 77 77 ILE HA H 77 4.850 5.148 -0.298 1
1 934 . 17 1 1 A 77 77 ILE C C 77 174.650 174.949 -0.299 1
1 935 . 17 1 1 A 77 77 ILE CA C 77 59.820 60.089 -0.269 1
1 936 . 17 1 1 A 77 77 ILE CB C 77 38.280 40.870 -2.590 1
1 940 . 17 1 1 A 77 77 ILE N N 77 128.020 122.540 5.480 1
1 941 . 17 1 1 A 78 78 THR H H 78 8.870 8.794 0.076 1
1 942 . 17 1 1 A 78 78 THR HA H 78 4.470 5.121 -0.651 1
1 947 . 17 1 1 A 78 78 THR C C 78 172.760 173.473 -0.713 1
1 948 . 17 1 1 A 78 78 THR CA C 78 60.740 61.385 -0.645 1
1 949 . 17 1 1 A 78 78 THR CB C 78 71.320 71.549 -0.229 1
1 951 . 17 1 1 A 78 78 THR N N 78 123.870 124.128 -0.258 1
1 952 . 17 1 1 A 79 79 LEU H H 79 8.820 8.994 -0.174 1
1 953 . 17 1 1 A 79 79 LEU HA H 79 5.140 5.115 0.025 1
1 963 . 17 1 1 A 79 79 LEU C C 79 176.610 175.765 0.845 1
1 964 . 17 1 1 A 79 79 LEU CA C 79 53.280 53.367 -0.087 1
1 965 . 17 1 1 A 79 79 LEU CB C 79 42.600 42.925 -0.325 1
1 969 . 17 1 1 A 79 79 LEU N N 79 127.070 126.532 0.538 1
1 970 . 17 1 1 A 80 80 VAL H H 80 8.800 8.500 0.300 1
1 971 . 17 1 1 A 80 80 VAL HA H 80 4.260 4.560 -0.300 1
1 979 . 17 1 1 A 80 80 VAL CA C 80 61.350 61.710 -0.360 1
1 980 . 17 1 1 A 80 80 VAL CB C 80 32.790 31.880 0.910 1
1 983 . 17 1 1 A 80 80 VAL N N 80 124.120 125.749 -1.629 1
1 984 . 17 1 1 A 81 81 THR H H 81 8.160 8.822 -0.662 1
1 985 . 17 1 1 A 81 81 THR HA H 81 4.410 5.097 -0.687 1
1 990 . 17 1 1 A 81 81 THR CA C 81 60.800 59.884 0.916 1
1 991 . 17 1 1 A 81 81 THR CB C 81 69.650 72.070 -2.420 1
1 993 . 17 1 1 A 81 81 THR N N 81 114.500 116.511 -2.011 1
1 1 . 18 1 1 A 9 9 GLY H H 9 8.390 8.298 0.092 1
1 2 . 18 1 1 A 9 9 GLY HA2 H 9 3.900 4.170 -0.270 1
1 3 . 18 1 1 A 9 9 GLY HA3 H 9 3.860 4.172 -0.312 1
1 4 . 18 1 1 A 9 9 GLY CA C 9 45.150 44.848 0.302 1
1 5 . 18 1 1 A 9 9 GLY N N 9 110.000 112.925 -2.925 1
1 6 . 18 1 1 A 10 10 VAL H H 10 7.870 8.530 -0.660 1
1 7 . 18 1 1 A 10 10 VAL HA H 10 4.040 3.653 0.387 1
1 15 . 18 1 1 A 10 10 VAL C C 10 175.880 174.899 0.981 1
1 16 . 18 1 1 A 10 10 VAL CA C 10 62.110 62.616 -0.506 1
1 17 . 18 1 1 A 10 10 VAL CB C 10 32.760 30.631 2.129 1
1 20 . 18 1 1 A 10 10 VAL N N 10 119.730 117.850 1.880 1
1 21 . 18 1 1 A 11 11 ILE H H 11 8.230 8.081 0.149 1
1 22 . 18 1 1 A 11 11 ILE HA H 11 4.090 4.638 -0.548 1
1 32 . 18 1 1 A 11 11 ILE C C 11 175.850 175.447 0.403 1
1 33 . 18 1 1 A 11 11 ILE CA C 11 60.800 59.479 1.321 1
1 34 . 18 1 1 A 11 11 ILE CB C 11 38.470 40.784 -2.314 1
1 38 . 18 1 1 A 11 11 ILE N N 11 125.570 122.990 2.580 1
1 39 . 18 1 1 A 12 12 MET H H 12 8.370 8.989 -0.619 1
1 40 . 18 1 1 A 12 12 MET HA H 12 4.540 5.165 -0.625 1
1 48 . 18 1 1 A 12 12 MET C C 12 174.830 176.032 -1.202 1
1 49 . 18 1 1 A 12 12 MET CA C 12 54.790 54.456 0.334 1
1 50 . 18 1 1 A 12 12 MET CB C 12 32.640 34.446 -1.806 1
1 53 . 18 1 1 A 12 12 MET N N 12 125.930 126.341 -0.411 1
1 54 . 18 1 1 A 13 13 SER H H 13 7.990 8.790 -0.800 1
1 55 . 18 1 1 A 13 13 SER HA H 13 5.030 5.485 -0.455 1
1 58 . 18 1 1 A 13 13 SER C C 13 174.330 173.827 0.503 1
1 59 . 18 1 1 A 13 13 SER CA C 13 57.320 55.788 1.532 1
1 60 . 18 1 1 A 13 13 SER CB C 13 64.790 66.302 -1.512 1
1 61 . 18 1 1 A 13 13 SER N N 13 116.400 116.841 -0.441 1
1 62 . 18 1 1 A 14 14 GLU H H 14 9.430 8.661 0.769 1
1 63 . 18 1 1 A 14 14 GLU HA H 14 5.250 5.421 -0.171 1
1 68 . 18 1 1 A 14 14 GLU C C 14 172.980 174.849 -1.869 1
1 69 . 18 1 1 A 14 14 GLU CA C 14 55.390 55.130 0.260 1
1 70 . 18 1 1 A 14 14 GLU CB C 14 33.910 34.389 -0.479 1
1 72 . 18 1 1 A 14 14 GLU N N 14 123.670 119.994 3.676 1
1 73 . 18 1 1 A 15 15 LEU H H 15 8.930 8.884 0.046 1
1 74 . 18 1 1 A 15 15 LEU HA H 15 4.870 5.118 -0.248 1
1 84 . 18 1 1 A 15 15 LEU C C 15 174.000 174.525 -0.525 1
1 85 . 18 1 1 A 15 15 LEU CA C 15 53.020 53.931 -0.911 1
1 86 . 18 1 1 A 15 15 LEU CB C 15 46.040 46.054 -0.014 1
1 90 . 18 1 1 A 15 15 LEU N N 15 125.350 125.927 -0.577 1
1 91 . 18 1 1 A 16 16 LYS H H 16 8.840 8.695 0.145 1
1 92 . 18 1 1 A 16 16 LYS HA H 16 5.360 4.978 0.382 1
1 101 . 18 1 1 A 16 16 LYS C C 16 175.660 175.611 0.049 1
1 102 . 18 1 1 A 16 16 LYS CA C 16 54.940 55.108 -0.168 1
1 103 . 18 1 1 A 16 16 LYS CB C 16 34.280 34.687 -0.407 1
1 107 . 18 1 1 A 16 16 LYS N N 16 124.640 126.864 -2.224 1
1 108 . 18 1 1 A 17 17 LEU H H 17 8.820 9.011 -0.191 1
1 109 . 18 1 1 A 17 17 LEU HA H 17 5.430 5.178 0.252 1
1 119 . 18 1 1 A 17 17 LEU C C 17 174.630 175.341 -0.711 1
1 120 . 18 1 1 A 17 17 LEU CA C 17 52.900 53.455 -0.555 1
1 121 . 18 1 1 A 17 17 LEU CB C 17 46.910 45.391 1.519 1
1 125 . 18 1 1 A 17 17 LEU N N 17 123.460 126.143 -2.683 1
1 126 . 18 1 1 A 18 18 LYS H H 18 9.110 8.670 0.440 1
1 127 . 18 1 1 A 18 18 LYS HA H 18 5.490 5.020 0.470 1
1 136 . 18 1 1 A 18 18 LYS CA C 18 52.270 52.877 -0.607 1
1 137 . 18 1 1 A 18 18 LYS CB C 18 37.500 35.784 1.716 1
1 141 . 18 1 1 A 18 18 LYS N N 18 122.230 123.690 -1.460 1
1 142 . 18 1 1 A 19 19 PRO HA H 19 4.100 4.914 -0.814 1
1 149 . 18 1 1 A 19 19 PRO CA C 19 62.440 62.863 -0.423 1
1 150 . 18 1 1 A 19 19 PRO CB C 19 30.640 32.300 -1.660 1
1 153 . 18 1 1 A 20 20 LEU H H 20 8.490 8.608 -0.118 1
1 154 . 18 1 1 A 20 20 LEU HA H 20 4.320 4.283 0.037 1
1 164 . 18 1 1 A 20 20 LEU CA C 20 57.680 58.782 -1.102 1
1 165 . 18 1 1 A 20 20 LEU CB C 20 38.760 40.938 -2.178 1
1 169 . 18 1 1 A 20 20 LEU N N 20 123.250 119.755 3.495 1
1 170 . 18 1 1 A 21 21 PRO HA H 21 4.530 4.559 -0.029 1
1 177 . 18 1 1 A 21 21 PRO CA C 21 62.880 62.408 0.472 1
1 178 . 18 1 1 A 21 21 PRO CB C 21 31.420 32.396 -0.976 1
1 181 . 18 1 1 A 22 22 LYS H H 22 8.180 8.404 -0.224 1
1 182 . 18 1 1 A 22 22 LYS HA H 22 4.110 4.535 -0.425 1
1 191 . 18 1 1 A 22 22 LYS C C 22 175.680 175.342 0.338 1
1 192 . 18 1 1 A 22 22 LYS CA C 22 56.210 55.773 0.437 1
1 193 . 18 1 1 A 22 22 LYS CB C 22 30.660 32.371 -1.711 1
1 197 . 18 1 1 A 22 22 LYS N N 22 119.160 121.651 -2.491 1
1 198 . 18 1 1 A 23 23 VAL H H 23 7.530 8.065 -0.535 1
1 199 . 18 1 1 A 23 23 VAL HA H 23 4.280 4.782 -0.502 1
1 207 . 18 1 1 A 23 23 VAL C C 23 173.690 173.177 0.513 1
1 208 . 18 1 1 A 23 23 VAL CA C 23 59.830 59.627 0.203 1
1 209 . 18 1 1 A 23 23 VAL CB C 23 34.550 35.573 -1.023 1
1 212 . 18 1 1 A 23 23 VAL N N 23 121.820 125.279 -3.459 1
1 213 . 18 1 1 A 24 24 GLU H H 24 8.270 8.988 -0.718 1
1 214 . 18 1 1 A 24 24 GLU HA H 24 4.330 5.065 -0.735 1
1 219 . 18 1 1 A 24 24 GLU C C 24 175.390 174.804 0.586 1
1 220 . 18 1 1 A 24 24 GLU CA C 24 55.220 54.443 0.777 1
1 221 . 18 1 1 A 24 24 GLU CB C 24 29.970 32.615 -2.645 1
1 223 . 18 1 1 A 24 24 GLU N N 24 125.610 128.074 -2.464 1
1 224 . 18 1 1 A 25 25 LEU H H 25 8.480 8.766 -0.286 1
1 225 . 18 1 1 A 25 25 LEU HA H 25 4.520 4.440 0.080 1
1 235 . 18 1 1 A 25 25 LEU CA C 25 51.660 51.767 -0.107 1
1 236 . 18 1 1 A 25 25 LEU CB C 25 41.750 40.992 0.758 1
1 240 . 18 1 1 A 25 25 LEU N N 25 125.880 128.417 -2.537 1
1 241 . 18 1 1 A 26 26 PRO HA H 26 4.760 4.618 0.142 1
1 248 . 18 1 1 A 26 26 PRO CA C 26 61.330 61.891 -0.561 1
1 249 . 18 1 1 A 26 26 PRO CB C 26 31.060 32.823 -1.763 1
1 252 . 18 1 1 A 27 27 PRO HA H 27 4.390 4.407 -0.017 1
1 259 . 18 1 1 A 27 27 PRO CA C 27 64.550 64.837 -0.287 1
1 260 . 18 1 1 A 27 27 PRO CB C 27 31.770 31.735 0.035 1
1 263 . 18 1 1 A 28 28 ASP H H 28 8.560 8.777 -0.217 1
1 264 . 18 1 1 A 28 28 ASP HA H 28 4.620 4.417 0.203 1
1 267 . 18 1 1 A 28 28 ASP C C 28 177.100 178.833 -1.733 1
1 268 . 18 1 1 A 28 28 ASP CA C 28 53.890 56.313 -2.423 1
1 269 . 18 1 1 A 28 28 ASP CB C 28 39.120 39.646 -0.526 1
1 270 . 18 1 1 A 28 28 ASP N N 28 115.820 117.832 -2.012 1
1 271 . 18 1 1 A 29 29 PHE H H 29 7.940 7.977 -0.037 1
1 272 . 18 1 1 A 29 29 PHE HA H 29 4.180 4.316 -0.136 1
1 280 . 18 1 1 A 29 29 PHE C C 29 176.740 178.250 -1.510 1
1 281 . 18 1 1 A 29 29 PHE CA C 29 61.020 61.036 -0.016 1
1 282 . 18 1 1 A 29 29 PHE CB C 29 39.230 38.754 0.476 1
1 288 . 18 1 1 A 29 29 PHE N N 29 119.610 118.394 1.216 1
1 289 . 18 1 1 A 30 30 VAL H H 30 8.010 8.439 -0.429 1
1 290 . 18 1 1 A 30 30 VAL HA H 30 3.350 3.748 -0.398 1
1 298 . 18 1 1 A 30 30 VAL C C 30 176.400 177.150 -0.750 1
1 299 . 18 1 1 A 30 30 VAL CA C 30 66.510 64.797 1.713 1
1 300 . 18 1 1 A 30 30 VAL CB C 30 31.020 31.024 -0.004 1
1 303 . 18 1 1 A 30 30 VAL N N 30 116.370 119.583 -3.213 1
1 304 . 18 1 1 A 31 31 ASP H H 31 7.420 7.985 -0.565 1
1 305 . 18 1 1 A 31 31 ASP HA H 31 4.310 4.360 -0.050 1
1 308 . 18 1 1 A 31 31 ASP C C 31 178.360 178.913 -0.553 1
1 309 . 18 1 1 A 31 31 ASP CA C 31 57.110 57.125 -0.015 1
1 310 . 18 1 1 A 31 31 ASP CB C 31 40.450 40.839 -0.389 1
1 311 . 18 1 1 A 31 31 ASP N N 31 119.190 121.631 -2.441 1
1 312 . 18 1 1 A 32 32 VAL H H 32 7.190 7.375 -0.185 1
1 313 . 18 1 1 A 32 32 VAL HA H 32 3.510 3.562 -0.052 1
1 321 . 18 1 1 A 32 32 VAL C C 32 178.100 178.540 -0.440 1
1 322 . 18 1 1 A 32 32 VAL CA C 32 65.570 66.386 -0.816 1
1 323 . 18 1 1 A 32 32 VAL CB C 32 31.410 31.282 0.128 1
1 326 . 18 1 1 A 32 32 VAL N N 32 119.830 120.279 -0.449 1
1 327 . 18 1 1 A 33 33 ILE H H 33 7.660 8.469 -0.809 1
1 328 . 18 1 1 A 33 33 ILE HA H 33 3.170 3.585 -0.415 1
1 338 . 18 1 1 A 33 33 ILE C C 33 176.660 178.178 -1.518 1
1 339 . 18 1 1 A 33 33 ILE CA C 33 65.220 65.264 -0.044 1
1 340 . 18 1 1 A 33 33 ILE CB C 33 37.500 37.687 -0.187 1
1 344 . 18 1 1 A 33 33 ILE N N 33 118.490 120.863 -2.373 1
1 345 . 18 1 1 A 34 34 ARG H H 34 7.830 7.742 0.088 1
1 346 . 18 1 1 A 34 34 ARG HA H 34 3.380 3.916 -0.536 1
1 354 . 18 1 1 A 34 34 ARG C C 34 178.060 177.270 0.790 1
1 355 . 18 1 1 A 34 34 ARG CA C 34 60.570 58.877 1.693 1
1 356 . 18 1 1 A 34 34 ARG CB C 34 30.070 29.693 0.377 1
1 359 . 18 1 1 A 34 34 ARG N N 34 118.260 120.009 -1.749 1
1 361 . 18 1 1 A 35 35 ILE H H 35 7.350 7.884 -0.534 1
1 362 . 18 1 1 A 35 35 ILE HA H 35 3.720 3.714 0.006 1
1 372 . 18 1 1 A 35 35 ILE C C 35 179.090 178.093 0.997 1
1 373 . 18 1 1 A 35 35 ILE CA C 35 64.060 65.383 -1.323 1
1 374 . 18 1 1 A 35 35 ILE CB C 35 38.030 37.396 0.634 1
1 378 . 18 1 1 A 35 35 ILE N N 35 116.750 119.468 -2.718 1
1 379 . 18 1 1 A 36 36 LYS H H 36 7.880 7.660 0.220 1
1 380 . 18 1 1 A 36 36 LYS HA H 36 4.090 4.001 0.089 1
1 389 . 18 1 1 A 36 36 LYS C C 36 178.560 178.953 -0.393 1
1 390 . 18 1 1 A 36 36 LYS CA C 36 57.650 59.760 -2.110 1
1 391 . 18 1 1 A 36 36 LYS CB C 36 32.090 32.206 -0.116 1
1 395 . 18 1 1 A 36 36 LYS N N 36 118.700 119.834 -1.134 1
1 396 . 18 1 1 A 37 37 LEU H H 37 7.860 7.468 0.392 1
1 397 . 18 1 1 A 37 37 LEU HA H 37 4.230 4.327 -0.097 1
1 407 . 18 1 1 A 37 37 LEU C C 37 175.880 176.788 -0.908 1
1 408 . 18 1 1 A 37 37 LEU CA C 37 54.090 55.699 -1.609 1
1 409 . 18 1 1 A 37 37 LEU CB C 37 43.310 42.528 0.782 1
1 413 . 18 1 1 A 37 37 LEU N N 37 116.380 117.468 -1.088 1
1 414 . 18 1 1 A 38 38 GLN H H 38 7.190 7.590 -0.400 1
1 415 . 18 1 1 A 38 38 GLN HA H 38 3.530 4.458 -0.928 1
1 422 . 18 1 1 A 38 38 GLN C C 38 177.480 176.267 1.213 1
1 423 . 18 1 1 A 38 38 GLN CA C 38 58.370 56.735 1.635 1
1 424 . 18 1 1 A 38 38 GLN CB C 38 28.300 28.799 -0.499 1
1 426 . 18 1 1 A 38 38 GLN N N 38 119.210 117.680 1.530 1
1 428 . 18 1 1 A 39 39 GLY H H 39 8.940 8.879 0.061 1
1 429 . 18 1 1 A 39 39 GLY HA2 H 39 3.540 3.995 -0.455 1
1 430 . 18 1 1 A 39 39 GLY HA3 H 39 4.220 3.995 0.225 1
1 431 . 18 1 1 A 39 39 GLY C C 39 174.070 174.434 -0.364 1
1 432 . 18 1 1 A 39 39 GLY CA C 39 45.280 45.049 0.231 1
1 433 . 18 1 1 A 39 39 GLY N N 39 113.490 112.150 1.340 1
1 434 . 18 1 1 A 40 40 LYS H H 40 8.350 7.584 0.766 1
1 435 . 18 1 1 A 40 40 LYS HA H 40 4.400 4.605 -0.205 1
1 444 . 18 1 1 A 40 40 LYS C C 40 175.560 175.854 -0.294 1
1 445 . 18 1 1 A 40 40 LYS CA C 40 55.660 54.656 1.004 1
1 446 . 18 1 1 A 40 40 LYS CB C 40 32.870 33.754 -0.884 1
1 450 . 18 1 1 A 40 40 LYS N N 40 122.060 119.986 2.074 1
1 451 . 18 1 1 A 41 41 THR H H 41 8.410 8.582 -0.172 1
1 452 . 18 1 1 A 41 41 THR HA H 41 5.330 4.994 0.336 1
1 457 . 18 1 1 A 41 41 THR C C 41 174.860 174.272 0.588 1
1 458 . 18 1 1 A 41 41 THR CA C 41 62.040 61.678 0.362 1
1 459 . 18 1 1 A 41 41 THR CB C 41 69.420 70.878 -1.458 1
1 461 . 18 1 1 A 41 41 THR N N 41 118.150 117.204 0.946 1
1 462 . 18 1 1 A 42 42 VAL H H 42 9.140 9.054 0.086 1
1 463 . 18 1 1 A 42 42 VAL HA H 42 4.570 5.051 -0.481 1
1 471 . 18 1 1 A 42 42 VAL C C 42 172.970 174.288 -1.318 1
1 472 . 18 1 1 A 42 42 VAL CA C 42 59.450 59.146 0.304 1
1 473 . 18 1 1 A 42 42 VAL CB C 42 35.880 35.544 0.336 1
1 476 . 18 1 1 A 42 42 VAL N N 42 122.510 119.742 2.768 1
1 477 . 18 1 1 A 43 43 ARG H H 43 8.420 8.670 -0.250 1
1 478 . 18 1 1 A 43 43 ARG HA H 43 4.750 4.872 -0.122 1
1 485 . 18 1 1 A 43 43 ARG C C 43 175.650 175.836 -0.186 1
1 486 . 18 1 1 A 43 43 ARG CA C 43 53.650 53.874 -0.224 1
1 487 . 18 1 1 A 43 43 ARG CB C 43 33.870 33.962 -0.092 1
1 490 . 18 1 1 A 43 43 ARG N N 43 120.640 122.966 -2.326 1
1 491 . 18 1 1 A 44 44 THR H H 44 8.370 8.571 -0.201 1
1 492 . 18 1 1 A 44 44 THR HA H 44 3.410 3.760 -0.350 1
1 497 . 18 1 1 A 44 44 THR C C 44 175.020 175.810 -0.790 1
1 498 . 18 1 1 A 44 44 THR CA C 44 65.660 65.024 0.636 1
1 499 . 18 1 1 A 44 44 THR CB C 44 69.400 68.329 1.071 1
1 501 . 18 1 1 A 44 44 THR N N 44 118.590 117.597 0.993 1
1 502 . 18 1 1 A 45 45 GLY H H 45 9.090 8.806 0.284 1
1 503 . 18 1 1 A 45 45 GLY HA2 H 45 3.470 4.015 -0.545 1
1 504 . 18 1 1 A 45 45 GLY HA3 H 45 4.470 4.020 0.450 1
1 505 . 18 1 1 A 45 45 GLY C C 45 174.350 173.843 0.507 1
1 506 . 18 1 1 A 45 45 GLY CA C 45 45.000 44.941 0.059 1
1 507 . 18 1 1 A 45 45 GLY N N 45 117.350 114.972 2.378 1
1 508 . 18 1 1 A 46 46 ASP H H 46 8.010 7.873 0.137 1
1 509 . 18 1 1 A 46 46 ASP HA H 46 4.470 4.626 -0.156 1
1 512 . 18 1 1 A 46 46 ASP C C 46 174.570 174.464 0.106 1
1 513 . 18 1 1 A 46 46 ASP CA C 46 55.570 55.428 0.142 1
1 514 . 18 1 1 A 46 46 ASP CB C 46 41.680 41.543 0.137 1
1 515 . 18 1 1 A 46 46 ASP N N 46 122.240 122.231 0.009 1
1 516 . 18 1 1 A 47 47 VAL H H 47 8.330 8.385 -0.055 1
1 517 . 18 1 1 A 47 47 VAL HA H 47 4.950 4.921 0.029 1
1 525 . 18 1 1 A 47 47 VAL C C 47 176.330 175.343 0.987 1
1 526 . 18 1 1 A 47 47 VAL CA C 47 61.710 60.928 0.782 1
1 527 . 18 1 1 A 47 47 VAL CB C 47 32.900 34.857 -1.957 1
1 530 . 18 1 1 A 47 47 VAL N N 47 119.860 121.877 -2.017 1
1 531 . 18 1 1 A 48 48 ILE H H 48 9.160 8.669 0.491 1
1 532 . 18 1 1 A 48 48 ILE HA H 48 4.630 5.088 -0.458 1
1 542 . 18 1 1 A 48 48 ILE C C 48 174.400 174.307 0.093 1
1 543 . 18 1 1 A 48 48 ILE CA C 48 58.990 59.321 -0.331 1
1 544 . 18 1 1 A 48 48 ILE CB C 48 41.810 42.236 -0.426 1
1 548 . 18 1 1 A 48 48 ILE N N 48 124.990 121.623 3.367 1
1 549 . 18 1 1 A 49 49 GLY H H 49 8.660 8.956 -0.296 1
1 550 . 18 1 1 A 49 49 GLY HA2 H 49 4.950 4.194 0.756 1
1 551 . 18 1 1 A 49 49 GLY HA3 H 49 3.620 4.233 -0.613 1
1 552 . 18 1 1 A 49 49 GLY C C 49 172.920 171.907 1.013 1
1 553 . 18 1 1 A 49 49 GLY CA C 49 44.580 44.378 0.202 1
1 554 . 18 1 1 A 49 49 GLY N N 49 112.060 109.851 2.209 1
1 555 . 18 1 1 A 50 50 ILE H H 50 8.810 8.842 -0.032 1
1 556 . 18 1 1 A 50 50 ILE HA H 50 4.370 4.784 -0.414 1
1 566 . 18 1 1 A 50 50 ILE C C 50 174.500 174.738 -0.238 1
1 567 . 18 1 1 A 50 50 ILE CA C 50 59.550 59.855 -0.305 1
1 568 . 18 1 1 A 50 50 ILE CB C 50 41.300 41.603 -0.303 1
1 572 . 18 1 1 A 50 50 ILE N N 50 123.220 125.550 -2.330 1
1 573 . 18 1 1 A 51 51 SER H H 51 8.540 8.842 -0.302 1
1 574 . 18 1 1 A 51 51 SER HA H 51 4.830 4.987 -0.157 1
1 577 . 18 1 1 A 51 51 SER C C 51 174.130 173.871 0.259 1
1 578 . 18 1 1 A 51 51 SER CA C 51 57.770 57.130 0.640 1
1 579 . 18 1 1 A 51 51 SER CB C 51 63.040 63.987 -0.947 1
1 580 . 18 1 1 A 51 51 SER N N 51 121.430 122.312 -0.882 1
1 581 . 18 1 1 A 52 52 ILE H H 52 8.930 8.753 0.177 1
1 582 . 18 1 1 A 52 52 ILE HA H 52 4.290 4.596 -0.306 1
1 592 . 18 1 1 A 52 52 ILE C C 52 175.280 175.999 -0.719 1
1 593 . 18 1 1 A 52 52 ILE CA C 52 60.250 60.195 0.055 1
1 594 . 18 1 1 A 52 52 ILE CB C 52 39.840 40.524 -0.684 1
1 598 . 18 1 1 A 52 52 ILE N N 52 127.060 127.238 -0.178 1
1 599 . 18 1 1 A 53 53 LEU H H 53 9.380 9.448 -0.068 1
1 600 . 18 1 1 A 53 53 LEU HA H 53 3.890 4.083 -0.193 1
1 610 . 18 1 1 A 53 53 LEU C C 53 177.130 176.987 0.143 1
1 611 . 18 1 1 A 53 53 LEU CA C 53 55.560 56.197 -0.637 1
1 612 . 18 1 1 A 53 53 LEU CB C 53 39.370 40.656 -1.286 1
1 616 . 18 1 1 A 53 53 LEU N N 53 126.770 129.539 -2.769 1
1 617 . 18 1 1 A 54 54 GLY H H 54 8.310 8.691 -0.381 1
1 618 . 18 1 1 A 54 54 GLY HA2 H 54 3.490 3.898 -0.408 1
1 619 . 18 1 1 A 54 54 GLY HA3 H 54 4.080 3.899 0.181 1
1 620 . 18 1 1 A 54 54 GLY C C 54 173.690 173.777 -0.087 1
1 621 . 18 1 1 A 54 54 GLY CA C 54 45.340 45.741 -0.401 1
1 622 . 18 1 1 A 54 54 GLY N N 54 103.820 104.389 -0.569 1
1 623 . 18 1 1 A 55 55 LYS H H 55 7.730 7.848 -0.118 1
1 624 . 18 1 1 A 55 55 LYS HA H 55 4.560 4.748 -0.188 1
1 633 . 18 1 1 A 55 55 LYS C C 55 174.550 174.998 -0.448 1
1 634 . 18 1 1 A 55 55 LYS CA C 55 54.140 54.392 -0.252 1
1 635 . 18 1 1 A 55 55 LYS CB C 55 34.620 35.679 -1.059 1
1 639 . 18 1 1 A 55 55 LYS N N 55 121.160 119.803 1.357 1
1 640 . 18 1 1 A 56 56 GLU H H 56 8.490 8.797 -0.307 1
1 641 . 18 1 1 A 56 56 GLU HA H 56 4.280 4.661 -0.381 1
1 646 . 18 1 1 A 56 56 GLU C C 56 175.730 175.113 0.617 1
1 647 . 18 1 1 A 56 56 GLU CA C 56 56.730 56.365 0.365 1
1 648 . 18 1 1 A 56 56 GLU CB C 56 30.070 30.747 -0.677 1
1 650 . 18 1 1 A 56 56 GLU N N 56 124.090 124.876 -0.786 1
1 651 . 18 1 1 A 57 57 VAL H H 57 8.920 8.350 0.570 1
1 652 . 18 1 1 A 57 57 VAL HA H 57 4.030 4.721 -0.691 1
1 660 . 18 1 1 A 57 57 VAL C C 57 174.610 173.202 1.408 1
1 661 . 18 1 1 A 57 57 VAL CA C 57 61.680 59.423 2.257 1
1 662 . 18 1 1 A 57 57 VAL CB C 57 33.880 34.251 -0.371 1
1 665 . 18 1 1 A 57 57 VAL N N 57 129.960 125.970 3.990 1
1 666 . 18 1 1 A 58 58 LYS H H 58 7.860 8.611 -0.751 1
1 667 . 18 1 1 A 58 58 LYS HA H 58 5.120 4.597 0.523 1
1 676 . 18 1 1 A 58 58 LYS C C 58 175.380 175.640 -0.260 1
1 677 . 18 1 1 A 58 58 LYS CA C 58 55.200 54.657 0.543 1
1 678 . 18 1 1 A 58 58 LYS CB C 58 34.670 33.846 0.824 1
1 682 . 18 1 1 A 58 58 LYS N N 58 124.790 127.104 -2.314 1
1 683 . 18 1 1 A 59 59 PHE H H 59 9.270 8.845 0.425 1
1 684 . 18 1 1 A 59 59 PHE HA H 59 4.960 5.115 -0.155 1
1 692 . 18 1 1 A 59 59 PHE C C 59 173.950 174.435 -0.485 1
1 693 . 18 1 1 A 59 59 PHE CA C 59 55.910 56.389 -0.479 1
1 694 . 18 1 1 A 59 59 PHE CB C 59 42.950 42.056 0.894 1
1 700 . 18 1 1 A 59 59 PHE N N 59 118.270 122.962 -4.692 1
1 701 . 18 1 1 A 60 60 LYS H H 60 9.170 8.942 0.228 1
1 702 . 18 1 1 A 60 60 LYS HA H 60 4.910 4.929 -0.019 1
1 711 . 18 1 1 A 60 60 LYS C C 60 176.230 175.996 0.234 1
1 712 . 18 1 1 A 60 60 LYS CA C 60 53.910 54.536 -0.626 1
1 713 . 18 1 1 A 60 60 LYS CB C 60 35.170 35.017 0.153 1
1 717 . 18 1 1 A 60 60 LYS N N 60 121.960 124.387 -2.427 1
1 718 . 18 1 1 A 61 61 VAL H H 61 9.400 8.834 0.566 1
1 719 . 18 1 1 A 61 61 VAL HA H 61 4.170 4.016 0.154 1
1 727 . 18 1 1 A 61 61 VAL C C 61 175.500 175.263 0.237 1
1 728 . 18 1 1 A 61 61 VAL CA C 61 61.980 63.535 -1.555 1
1 729 . 18 1 1 A 61 61 VAL CB C 61 29.490 31.107 -1.617 1
1 732 . 18 1 1 A 61 61 VAL N N 61 127.140 127.094 0.046 1
1 733 . 18 1 1 A 62 62 VAL H H 62 8.390 8.639 -0.249 1
1 734 . 18 1 1 A 62 62 VAL HA H 62 3.650 3.968 -0.318 1
1 742 . 18 1 1 A 62 62 VAL C C 62 176.440 176.072 0.368 1
1 743 . 18 1 1 A 62 62 VAL CA C 62 64.930 64.428 0.502 1
1 744 . 18 1 1 A 62 62 VAL CB C 62 32.130 32.450 -0.320 1
1 747 . 18 1 1 A 62 62 VAL N N 62 132.840 129.461 3.379 1
1 748 . 18 1 1 A 63 63 GLN H H 63 7.470 7.187 0.283 1
1 749 . 18 1 1 A 63 63 GLN HA H 63 4.270 4.760 -0.490 1
1 756 . 18 1 1 A 63 63 GLN C C 63 172.290 173.327 -1.037 1
1 757 . 18 1 1 A 63 63 GLN CA C 63 56.640 54.797 1.843 1
1 758 . 18 1 1 A 63 63 GLN CB C 63 32.630 32.648 -0.018 1
1 760 . 18 1 1 A 63 63 GLN N N 63 114.500 119.011 -4.511 1
1 762 . 18 1 1 A 64 64 ALA H H 64 8.200 8.536 -0.336 1
1 763 . 18 1 1 A 64 64 ALA HA H 64 4.830 5.373 -0.543 1
1 767 . 18 1 1 A 64 64 ALA C C 64 174.270 175.463 -1.193 1
1 768 . 18 1 1 A 64 64 ALA CA C 64 50.800 49.964 0.836 1
1 769 . 18 1 1 A 64 64 ALA CB C 64 20.100 21.761 -1.661 1
1 770 . 18 1 1 A 64 64 ALA N N 64 131.410 125.500 5.910 1
1 771 . 18 1 1 A 65 65 TYR H H 65 8.860 8.540 0.320 1
1 772 . 18 1 1 A 65 65 TYR HA H 65 4.540 4.965 -0.425 1
1 779 . 18 1 1 A 65 65 TYR CA C 65 54.270 55.095 -0.825 1
1 780 . 18 1 1 A 65 65 TYR CB C 65 41.360 40.447 0.913 1
1 785 . 18 1 1 A 65 65 TYR N N 65 124.140 120.184 3.956 1
1 786 . 18 1 1 A 66 66 PRO HA H 66 4.120 4.705 -0.585 1
1 793 . 18 1 1 A 66 66 PRO CA C 66 63.450 62.344 1.106 1
1 794 . 18 1 1 A 66 66 PRO CB C 66 34.170 32.767 1.403 1
1 797 . 18 1 1 A 67 67 SER H H 67 7.380 8.224 -0.844 1
1 798 . 18 1 1 A 67 67 SER HA H 67 4.720 5.016 -0.296 1
1 801 . 18 1 1 A 67 67 SER CA C 67 54.250 55.976 -1.726 1
1 802 . 18 1 1 A 67 67 SER CB C 67 64.530 63.932 0.598 1
1 803 . 18 1 1 A 67 67 SER N N 67 106.200 116.827 -10.627 1
1 804 . 18 1 1 A 68 68 PRO HA H 68 4.880 4.651 0.229 1
1 811 . 18 1 1 A 68 68 PRO CA C 68 62.990 62.472 0.518 1
1 812 . 18 1 1 A 68 68 PRO CB C 68 35.220 33.210 2.010 1
1 815 . 18 1 1 A 69 69 LEU H H 69 8.960 7.919 1.041 1
1 816 . 18 1 1 A 69 69 LEU HA H 69 4.430 5.118 -0.688 1
1 826 . 18 1 1 A 69 69 LEU C C 69 174.570 175.142 -0.572 1
1 827 . 18 1 1 A 69 69 LEU CA C 69 53.900 52.588 1.312 1
1 828 . 18 1 1 A 69 69 LEU CB C 69 44.210 46.126 -1.916 1
1 832 . 18 1 1 A 69 69 LEU N N 69 120.480 117.121 3.359 1
1 833 . 18 1 1 A 70 70 ARG H H 70 8.130 8.375 -0.245 1
1 834 . 18 1 1 A 70 70 ARG HA H 70 4.930 4.819 0.111 1
1 841 . 18 1 1 A 70 70 ARG C C 70 175.460 176.114 -0.654 1
1 842 . 18 1 1 A 70 70 ARG CA C 70 54.040 55.449 -1.409 1
1 843 . 18 1 1 A 70 70 ARG CB C 70 30.550 31.930 -1.380 1
1 846 . 18 1 1 A 70 70 ARG N N 70 125.180 119.653 5.527 1
1 847 . 18 1 1 A 71 71 VAL H H 71 8.450 8.224 0.226 1
1 848 . 18 1 1 A 71 71 VAL HA H 71 3.410 4.435 -1.025 1
1 856 . 18 1 1 A 71 71 VAL C C 71 175.460 175.929 -0.469 1
1 857 . 18 1 1 A 71 71 VAL CA C 71 65.210 62.330 2.880 1
1 858 . 18 1 1 A 71 71 VAL CB C 71 29.840 31.617 -1.777 1
1 861 . 18 1 1 A 71 71 VAL N N 71 128.170 122.556 5.614 1
1 862 . 18 1 1 A 72 72 GLU H H 72 8.620 8.460 0.160 1
1 863 . 18 1 1 A 72 72 GLU HA H 72 4.870 4.744 0.126 1
1 868 . 18 1 1 A 72 72 GLU C C 72 176.960 176.311 0.649 1
1 869 . 18 1 1 A 72 72 GLU CA C 72 54.330 54.156 0.174 1
1 870 . 18 1 1 A 72 72 GLU CB C 72 33.280 32.198 1.082 1
1 872 . 18 1 1 A 72 72 GLU N N 72 127.670 126.980 0.690 1
1 873 . 18 1 1 A 73 73 ASP H H 73 8.700 8.809 -0.109 1
1 874 . 18 1 1 A 73 73 ASP HA H 73 4.150 4.291 -0.141 1
1 877 . 18 1 1 A 73 73 ASP C C 73 177.460 178.111 -0.651 1
1 878 . 18 1 1 A 73 73 ASP CA C 73 57.620 56.654 0.966 1
1 879 . 18 1 1 A 73 73 ASP CB C 73 40.360 40.542 -0.182 1
1 880 . 18 1 1 A 73 73 ASP N N 73 121.140 122.055 -0.915 1
1 881 . 18 1 1 A 74 74 ARG H H 74 7.760 7.646 0.114 1
1 882 . 18 1 1 A 74 74 ARG HA H 74 4.280 4.344 -0.064 1
1 889 . 18 1 1 A 74 74 ARG C C 74 176.510 176.696 -0.186 1
1 890 . 18 1 1 A 74 74 ARG CA C 74 55.450 56.868 -1.418 1
1 891 . 18 1 1 A 74 74 ARG CB C 74 29.990 30.752 -0.762 1
1 894 . 18 1 1 A 74 74 ARG N N 74 112.890 116.697 -3.807 1
1 895 . 18 1 1 A 75 75 THR H H 75 7.700 7.619 0.081 1
1 896 . 18 1 1 A 75 75 THR HA H 75 4.020 4.416 -0.396 1
1 901 . 18 1 1 A 75 75 THR C C 75 173.810 173.837 -0.027 1
1 902 . 18 1 1 A 75 75 THR CA C 75 64.060 63.638 0.422 1
1 903 . 18 1 1 A 75 75 THR CB C 75 69.350 69.307 0.043 1
1 905 . 18 1 1 A 75 75 THR N N 75 120.650 116.213 4.437 1
1 906 . 18 1 1 A 76 76 LYS H H 76 8.520 8.329 0.191 1
1 907 . 18 1 1 A 76 76 LYS HA H 76 4.270 4.675 -0.405 1
1 916 . 18 1 1 A 76 76 LYS C C 76 174.560 175.804 -1.244 1
1 917 . 18 1 1 A 76 76 LYS CA C 76 56.280 55.932 0.348 1
1 918 . 18 1 1 A 76 76 LYS CB C 76 33.120 33.831 -0.711 1
1 922 . 18 1 1 A 76 76 LYS N N 76 130.950 127.318 3.632 1
1 923 . 18 1 1 A 77 77 ILE H H 77 8.430 8.634 -0.204 1
1 924 . 18 1 1 A 77 77 ILE HA H 77 4.850 5.190 -0.340 1
1 934 . 18 1 1 A 77 77 ILE C C 77 174.650 175.230 -0.580 1
1 935 . 18 1 1 A 77 77 ILE CA C 77 59.820 59.900 -0.080 1
1 936 . 18 1 1 A 77 77 ILE CB C 77 38.280 40.614 -2.334 1
1 940 . 18 1 1 A 77 77 ILE N N 77 128.020 123.174 4.846 1
1 941 . 18 1 1 A 78 78 THR H H 78 8.870 8.721 0.149 1
1 942 . 18 1 1 A 78 78 THR HA H 78 4.470 5.111 -0.641 1
1 947 . 18 1 1 A 78 78 THR C C 78 172.760 172.954 -0.194 1
1 948 . 18 1 1 A 78 78 THR CA C 78 60.740 61.317 -0.577 1
1 949 . 18 1 1 A 78 78 THR CB C 78 71.320 72.014 -0.694 1
1 951 . 18 1 1 A 78 78 THR N N 78 123.870 123.496 0.374 1
1 952 . 18 1 1 A 79 79 LEU H H 79 8.820 8.937 -0.117 1
1 953 . 18 1 1 A 79 79 LEU HA H 79 5.140 5.025 0.115 1
1 963 . 18 1 1 A 79 79 LEU C C 79 176.610 175.859 0.751 1
1 964 . 18 1 1 A 79 79 LEU CA C 79 53.280 53.253 0.027 1
1 965 . 18 1 1 A 79 79 LEU CB C 79 42.600 42.792 -0.192 1
1 969 . 18 1 1 A 79 79 LEU N N 79 127.070 126.566 0.504 1
1 970 . 18 1 1 A 80 80 VAL H H 80 8.800 8.839 -0.039 1
1 971 . 18 1 1 A 80 80 VAL HA H 80 4.260 4.686 -0.426 1
1 979 . 18 1 1 A 80 80 VAL CA C 80 61.350 61.610 -0.260 1
1 980 . 18 1 1 A 80 80 VAL CB C 80 32.790 32.828 -0.038 1
1 983 . 18 1 1 A 80 80 VAL N N 80 124.120 125.644 -1.524 1
1 984 . 18 1 1 A 81 81 THR H H 81 8.160 8.723 -0.563 1
1 985 . 18 1 1 A 81 81 THR HA H 81 4.410 5.130 -0.720 1
1 990 . 18 1 1 A 81 81 THR CA C 81 60.800 60.795 0.005 1
1 991 . 18 1 1 A 81 81 THR CB C 81 69.650 70.433 -0.783 1
1 993 . 18 1 1 A 81 81 THR N N 81 114.500 118.964 -4.464 1
1 1 . 19 1 1 A 9 9 GLY H H 9 8.390 7.729 0.661 1
1 2 . 19 1 1 A 9 9 GLY HA2 H 9 3.900 4.058 -0.158 1
1 3 . 19 1 1 A 9 9 GLY HA3 H 9 3.860 4.058 -0.198 1
1 4 . 19 1 1 A 9 9 GLY CA C 9 45.150 44.918 0.232 1
1 5 . 19 1 1 A 9 9 GLY N N 9 110.000 108.558 1.442 1
1 6 . 19 1 1 A 10 10 VAL H H 10 7.870 8.521 -0.651 1
1 7 . 19 1 1 A 10 10 VAL HA H 10 4.040 4.721 -0.681 1
1 15 . 19 1 1 A 10 10 VAL C C 10 175.880 174.789 1.091 1
1 16 . 19 1 1 A 10 10 VAL CA C 10 62.110 60.716 1.394 1
1 17 . 19 1 1 A 10 10 VAL CB C 10 32.760 36.000 -3.240 1
1 20 . 19 1 1 A 10 10 VAL N N 10 119.730 120.453 -0.723 1
1 21 . 19 1 1 A 11 11 ILE H H 11 8.230 8.934 -0.704 1
1 22 . 19 1 1 A 11 11 ILE HA H 11 4.090 4.742 -0.652 1
1 32 . 19 1 1 A 11 11 ILE C C 11 175.850 174.737 1.113 1
1 33 . 19 1 1 A 11 11 ILE CA C 11 60.800 59.995 0.805 1
1 34 . 19 1 1 A 11 11 ILE CB C 11 38.470 39.773 -1.303 1
1 38 . 19 1 1 A 11 11 ILE N N 11 125.570 127.213 -1.643 1
1 39 . 19 1 1 A 12 12 MET H H 12 8.370 8.774 -0.404 1
1 40 . 19 1 1 A 12 12 MET HA H 12 4.540 4.968 -0.428 1
1 48 . 19 1 1 A 12 12 MET C C 12 174.830 175.728 -0.898 1
1 49 . 19 1 1 A 12 12 MET CA C 12 54.790 54.006 0.784 1
1 50 . 19 1 1 A 12 12 MET CB C 12 32.640 33.611 -0.971 1
1 53 . 19 1 1 A 12 12 MET N N 12 125.930 127.506 -1.576 1
1 54 . 19 1 1 A 13 13 SER H H 13 7.990 8.758 -0.768 1
1 55 . 19 1 1 A 13 13 SER HA H 13 5.030 5.587 -0.557 1
1 58 . 19 1 1 A 13 13 SER C C 13 174.330 173.278 1.052 1
1 59 . 19 1 1 A 13 13 SER CA C 13 57.320 55.992 1.328 1
1 60 . 19 1 1 A 13 13 SER CB C 13 64.790 66.131 -1.341 1
1 61 . 19 1 1 A 13 13 SER N N 13 116.400 117.630 -1.230 1
1 62 . 19 1 1 A 14 14 GLU H H 14 9.430 8.750 0.680 1
1 63 . 19 1 1 A 14 14 GLU HA H 14 5.250 5.129 0.121 1
1 68 . 19 1 1 A 14 14 GLU C C 14 172.980 173.909 -0.929 1
1 69 . 19 1 1 A 14 14 GLU CA C 14 55.390 55.398 -0.008 1
1 70 . 19 1 1 A 14 14 GLU CB C 14 33.910 34.299 -0.389 1
1 72 . 19 1 1 A 14 14 GLU N N 14 123.670 122.313 1.357 1
1 73 . 19 1 1 A 15 15 LEU H H 15 8.930 8.938 -0.008 1
1 74 . 19 1 1 A 15 15 LEU HA H 15 4.870 5.212 -0.342 1
1 84 . 19 1 1 A 15 15 LEU C C 15 174.000 174.391 -0.391 1
1 85 . 19 1 1 A 15 15 LEU CA C 15 53.020 53.584 -0.564 1
1 86 . 19 1 1 A 15 15 LEU CB C 15 46.040 45.796 0.244 1
1 90 . 19 1 1 A 15 15 LEU N N 15 125.350 126.851 -1.501 1
1 91 . 19 1 1 A 16 16 LYS H H 16 8.840 8.796 0.044 1
1 92 . 19 1 1 A 16 16 LYS HA H 16 5.360 4.908 0.452 1
1 101 . 19 1 1 A 16 16 LYS C C 16 175.660 175.360 0.300 1
1 102 . 19 1 1 A 16 16 LYS CA C 16 54.940 55.627 -0.687 1
1 103 . 19 1 1 A 16 16 LYS CB C 16 34.280 33.717 0.563 1
1 107 . 19 1 1 A 16 16 LYS N N 16 124.640 126.984 -2.344 1
1 108 . 19 1 1 A 17 17 LEU H H 17 8.820 9.032 -0.212 1
1 109 . 19 1 1 A 17 17 LEU HA H 17 5.430 5.250 0.180 1
1 119 . 19 1 1 A 17 17 LEU C C 17 174.630 175.354 -0.724 1
1 120 . 19 1 1 A 17 17 LEU CA C 17 52.900 53.416 -0.516 1
1 121 . 19 1 1 A 17 17 LEU CB C 17 46.910 45.322 1.588 1
1 125 . 19 1 1 A 17 17 LEU N N 17 123.460 127.024 -3.564 1
1 126 . 19 1 1 A 18 18 LYS H H 18 9.110 8.726 0.384 1
1 127 . 19 1 1 A 18 18 LYS HA H 18 5.490 5.075 0.415 1
1 136 . 19 1 1 A 18 18 LYS CA C 18 52.270 52.773 -0.503 1
1 137 . 19 1 1 A 18 18 LYS CB C 18 37.500 36.095 1.405 1
1 141 . 19 1 1 A 18 18 LYS N N 18 122.230 123.727 -1.497 1
1 142 . 19 1 1 A 19 19 PRO HA H 19 4.100 4.398 -0.298 1
1 149 . 19 1 1 A 19 19 PRO CA C 19 62.440 62.605 -0.165 1
1 150 . 19 1 1 A 19 19 PRO CB C 19 30.640 32.124 -1.484 1
1 153 . 19 1 1 A 20 20 LEU H H 20 8.490 8.350 0.140 1
1 154 . 19 1 1 A 20 20 LEU HA H 20 4.320 4.254 0.066 1
1 164 . 19 1 1 A 20 20 LEU CA C 20 57.680 58.688 -1.008 1
1 165 . 19 1 1 A 20 20 LEU CB C 20 38.760 41.044 -2.284 1
1 169 . 19 1 1 A 20 20 LEU N N 20 123.250 119.606 3.644 1
1 170 . 19 1 1 A 21 21 PRO HA H 21 4.530 4.526 0.004 1
1 177 . 19 1 1 A 21 21 PRO CA C 21 62.880 62.547 0.333 1
1 178 . 19 1 1 A 21 21 PRO CB C 21 31.420 32.015 -0.595 1
1 181 . 19 1 1 A 22 22 LYS H H 22 8.180 8.358 -0.178 1
1 182 . 19 1 1 A 22 22 LYS HA H 22 4.110 4.542 -0.432 1
1 191 . 19 1 1 A 22 22 LYS C C 22 175.680 175.344 0.336 1
1 192 . 19 1 1 A 22 22 LYS CA C 22 56.210 55.792 0.418 1
1 193 . 19 1 1 A 22 22 LYS CB C 22 30.660 32.890 -2.230 1
1 197 . 19 1 1 A 22 22 LYS N N 22 119.160 121.819 -2.659 1
1 198 . 19 1 1 A 23 23 VAL H H 23 7.530 8.492 -0.962 1
1 199 . 19 1 1 A 23 23 VAL HA H 23 4.280 4.742 -0.462 1
1 207 . 19 1 1 A 23 23 VAL C C 23 173.690 172.707 0.983 1
1 208 . 19 1 1 A 23 23 VAL CA C 23 59.830 59.515 0.315 1
1 209 . 19 1 1 A 23 23 VAL CB C 23 34.550 35.678 -1.128 1
1 212 . 19 1 1 A 23 23 VAL N N 23 121.820 125.445 -3.625 1
1 213 . 19 1 1 A 24 24 GLU H H 24 8.270 8.881 -0.611 1
1 214 . 19 1 1 A 24 24 GLU HA H 24 4.330 4.730 -0.400 1
1 219 . 19 1 1 A 24 24 GLU C C 24 175.390 175.021 0.369 1
1 220 . 19 1 1 A 24 24 GLU CA C 24 55.220 55.025 0.195 1
1 221 . 19 1 1 A 24 24 GLU CB C 24 29.970 31.383 -1.413 1
1 223 . 19 1 1 A 24 24 GLU N N 24 125.610 128.293 -2.683 1
1 224 . 19 1 1 A 25 25 LEU H H 25 8.480 8.702 -0.222 1
1 225 . 19 1 1 A 25 25 LEU HA H 25 4.520 4.477 0.043 1
1 235 . 19 1 1 A 25 25 LEU CA C 25 51.660 51.211 0.449 1
1 236 . 19 1 1 A 25 25 LEU CB C 25 41.750 41.042 0.708 1
1 240 . 19 1 1 A 25 25 LEU N N 25 125.880 129.137 -3.257 1
1 241 . 19 1 1 A 26 26 PRO HA H 26 4.760 4.633 0.127 1
1 248 . 19 1 1 A 26 26 PRO CA C 26 61.330 61.900 -0.570 1
1 249 . 19 1 1 A 26 26 PRO CB C 26 31.060 32.629 -1.569 1
1 252 . 19 1 1 A 27 27 PRO HA H 27 4.390 4.273 0.117 1
1 259 . 19 1 1 A 27 27 PRO CA C 27 64.550 65.263 -0.713 1
1 260 . 19 1 1 A 27 27 PRO CB C 27 31.770 31.839 -0.069 1
1 263 . 19 1 1 A 28 28 ASP H H 28 8.560 8.902 -0.342 1
1 264 . 19 1 1 A 28 28 ASP HA H 28 4.620 4.421 0.199 1
1 267 . 19 1 1 A 28 28 ASP C C 28 177.100 178.807 -1.707 1
1 268 . 19 1 1 A 28 28 ASP CA C 28 53.890 56.270 -2.380 1
1 269 . 19 1 1 A 28 28 ASP CB C 28 39.120 39.571 -0.451 1
1 270 . 19 1 1 A 28 28 ASP N N 28 115.820 117.259 -1.439 1
1 271 . 19 1 1 A 29 29 PHE H H 29 7.940 7.788 0.152 1
1 272 . 19 1 1 A 29 29 PHE HA H 29 4.180 4.316 -0.136 1
1 280 . 19 1 1 A 29 29 PHE C C 29 176.740 178.341 -1.601 1
1 281 . 19 1 1 A 29 29 PHE CA C 29 61.020 60.615 0.405 1
1 282 . 19 1 1 A 29 29 PHE CB C 29 39.230 39.160 0.070 1
1 288 . 19 1 1 A 29 29 PHE N N 29 119.610 118.482 1.128 1
1 289 . 19 1 1 A 30 30 VAL H H 30 8.010 8.544 -0.534 1
1 290 . 19 1 1 A 30 30 VAL HA H 30 3.350 3.618 -0.268 1
1 298 . 19 1 1 A 30 30 VAL C C 30 176.400 177.510 -1.110 1
1 299 . 19 1 1 A 30 30 VAL CA C 30 66.510 66.684 -0.174 1
1 300 . 19 1 1 A 30 30 VAL CB C 30 31.020 31.387 -0.367 1
1 303 . 19 1 1 A 30 30 VAL N N 30 116.370 119.033 -2.663 1
1 304 . 19 1 1 A 31 31 ASP H H 31 7.420 8.039 -0.619 1
1 305 . 19 1 1 A 31 31 ASP HA H 31 4.310 4.409 -0.099 1
1 308 . 19 1 1 A 31 31 ASP C C 31 178.360 178.792 -0.432 1
1 309 . 19 1 1 A 31 31 ASP CA C 31 57.110 57.387 -0.277 1
1 310 . 19 1 1 A 31 31 ASP CB C 31 40.450 40.495 -0.045 1
1 311 . 19 1 1 A 31 31 ASP N N 31 119.190 120.823 -1.633 1
1 312 . 19 1 1 A 32 32 VAL H H 32 7.190 7.641 -0.451 1
1 313 . 19 1 1 A 32 32 VAL HA H 32 3.510 3.530 -0.020 1
1 321 . 19 1 1 A 32 32 VAL C C 32 178.100 178.578 -0.478 1
1 322 . 19 1 1 A 32 32 VAL CA C 32 65.570 66.345 -0.775 1
1 323 . 19 1 1 A 32 32 VAL CB C 32 31.410 31.354 0.056 1
1 326 . 19 1 1 A 32 32 VAL N N 32 119.830 120.230 -0.400 1
1 327 . 19 1 1 A 33 33 ILE H H 33 7.660 8.566 -0.906 1
1 328 . 19 1 1 A 33 33 ILE HA H 33 3.170 3.504 -0.334 1
1 338 . 19 1 1 A 33 33 ILE C C 33 176.660 178.167 -1.507 1
1 339 . 19 1 1 A 33 33 ILE CA C 33 65.220 65.231 -0.011 1
1 340 . 19 1 1 A 33 33 ILE CB C 33 37.500 37.812 -0.312 1
1 344 . 19 1 1 A 33 33 ILE N N 33 118.490 120.869 -2.379 1
1 345 . 19 1 1 A 34 34 ARG H H 34 7.830 7.772 0.058 1
1 346 . 19 1 1 A 34 34 ARG HA H 34 3.380 3.925 -0.545 1
1 354 . 19 1 1 A 34 34 ARG C C 34 178.060 177.613 0.447 1
1 355 . 19 1 1 A 34 34 ARG CA C 34 60.570 58.887 1.683 1
1 356 . 19 1 1 A 34 34 ARG CB C 34 30.070 29.702 0.368 1
1 359 . 19 1 1 A 34 34 ARG N N 34 118.260 119.965 -1.705 1
1 361 . 19 1 1 A 35 35 ILE H H 35 7.350 7.844 -0.494 1
1 362 . 19 1 1 A 35 35 ILE HA H 35 3.720 3.698 0.022 1
1 372 . 19 1 1 A 35 35 ILE C C 35 179.090 178.124 0.966 1
1 373 . 19 1 1 A 35 35 ILE CA C 35 64.060 65.323 -1.263 1
1 374 . 19 1 1 A 35 35 ILE CB C 35 38.030 37.587 0.443 1
1 378 . 19 1 1 A 35 35 ILE N N 35 116.750 119.276 -2.526 1
1 379 . 19 1 1 A 36 36 LYS H H 36 7.880 7.667 0.213 1
1 380 . 19 1 1 A 36 36 LYS HA H 36 4.090 3.938 0.152 1
1 389 . 19 1 1 A 36 36 LYS C C 36 178.560 178.911 -0.351 1
1 390 . 19 1 1 A 36 36 LYS CA C 36 57.650 59.757 -2.107 1
1 391 . 19 1 1 A 36 36 LYS CB C 36 32.090 32.070 0.020 1
1 395 . 19 1 1 A 36 36 LYS N N 36 118.700 119.728 -1.028 1
1 396 . 19 1 1 A 37 37 LEU H H 37 7.860 7.428 0.432 1
1 397 . 19 1 1 A 37 37 LEU HA H 37 4.230 4.296 -0.066 1
1 407 . 19 1 1 A 37 37 LEU C C 37 175.880 176.760 -0.880 1
1 408 . 19 1 1 A 37 37 LEU CA C 37 54.090 55.609 -1.519 1
1 409 . 19 1 1 A 37 37 LEU CB C 37 43.310 42.478 0.832 1
1 413 . 19 1 1 A 37 37 LEU N N 37 116.380 117.557 -1.177 1
1 414 . 19 1 1 A 38 38 GLN H H 38 7.190 7.530 -0.340 1
1 415 . 19 1 1 A 38 38 GLN HA H 38 3.530 4.216 -0.686 1
1 422 . 19 1 1 A 38 38 GLN C C 38 177.480 176.258 1.222 1
1 423 . 19 1 1 A 38 38 GLN CA C 38 58.370 56.731 1.639 1
1 424 . 19 1 1 A 38 38 GLN CB C 38 28.300 28.719 -0.419 1
1 426 . 19 1 1 A 38 38 GLN N N 38 119.210 117.669 1.541 1
1 428 . 19 1 1 A 39 39 GLY H H 39 8.940 8.839 0.101 1
1 429 . 19 1 1 A 39 39 GLY HA2 H 39 3.540 3.988 -0.448 1
1 430 . 19 1 1 A 39 39 GLY HA3 H 39 4.220 3.989 0.231 1
1 431 . 19 1 1 A 39 39 GLY C C 39 174.070 174.456 -0.386 1
1 432 . 19 1 1 A 39 39 GLY CA C 39 45.280 45.039 0.241 1
1 433 . 19 1 1 A 39 39 GLY N N 39 113.490 112.155 1.335 1
1 434 . 19 1 1 A 40 40 LYS H H 40 8.350 7.613 0.737 1
1 435 . 19 1 1 A 40 40 LYS HA H 40 4.400 4.592 -0.192 1
1 444 . 19 1 1 A 40 40 LYS C C 40 175.560 175.729 -0.169 1
1 445 . 19 1 1 A 40 40 LYS CA C 40 55.660 54.731 0.929 1
1 446 . 19 1 1 A 40 40 LYS CB C 40 32.870 33.733 -0.863 1
1 450 . 19 1 1 A 40 40 LYS N N 40 122.060 119.967 2.093 1
1 451 . 19 1 1 A 41 41 THR H H 41 8.410 8.585 -0.175 1
1 452 . 19 1 1 A 41 41 THR HA H 41 5.330 5.008 0.322 1
1 457 . 19 1 1 A 41 41 THR C C 41 174.860 174.394 0.466 1
1 458 . 19 1 1 A 41 41 THR CA C 41 62.040 61.657 0.383 1
1 459 . 19 1 1 A 41 41 THR CB C 41 69.420 70.898 -1.478 1
1 461 . 19 1 1 A 41 41 THR N N 41 118.150 117.221 0.929 1
1 462 . 19 1 1 A 42 42 VAL H H 42 9.140 9.147 -0.007 1
1 463 . 19 1 1 A 42 42 VAL HA H 42 4.570 5.030 -0.460 1
1 471 . 19 1 1 A 42 42 VAL C C 42 172.970 173.636 -0.666 1
1 472 . 19 1 1 A 42 42 VAL CA C 42 59.450 59.233 0.217 1
1 473 . 19 1 1 A 42 42 VAL CB C 42 35.880 35.384 0.496 1
1 476 . 19 1 1 A 42 42 VAL N N 42 122.510 120.653 1.857 1
1 477 . 19 1 1 A 43 43 ARG H H 43 8.420 8.727 -0.307 1
1 478 . 19 1 1 A 43 43 ARG HA H 43 4.750 4.997 -0.247 1
1 485 . 19 1 1 A 43 43 ARG C C 43 175.650 174.945 0.705 1
1 486 . 19 1 1 A 43 43 ARG CA C 43 53.650 54.025 -0.375 1
1 487 . 19 1 1 A 43 43 ARG CB C 43 33.870 33.918 -0.048 1
1 490 . 19 1 1 A 43 43 ARG N N 43 120.640 122.768 -2.128 1
1 491 . 19 1 1 A 44 44 THR H H 44 8.370 8.572 -0.202 1
1 492 . 19 1 1 A 44 44 THR HA H 44 3.410 3.786 -0.376 1
1 497 . 19 1 1 A 44 44 THR C C 44 175.020 175.824 -0.804 1
1 498 . 19 1 1 A 44 44 THR CA C 44 65.660 65.042 0.618 1
1 499 . 19 1 1 A 44 44 THR CB C 44 69.400 68.355 1.045 1
1 501 . 19 1 1 A 44 44 THR N N 44 118.590 119.374 -0.784 1
1 502 . 19 1 1 A 45 45 GLY H H 45 9.090 8.787 0.303 1
1 503 . 19 1 1 A 45 45 GLY HA2 H 45 3.470 4.024 -0.554 1
1 504 . 19 1 1 A 45 45 GLY HA3 H 45 4.470 4.030 0.440 1
1 505 . 19 1 1 A 45 45 GLY C C 45 174.350 173.852 0.498 1
1 506 . 19 1 1 A 45 45 GLY CA C 45 45.000 44.952 0.048 1
1 507 . 19 1 1 A 45 45 GLY N N 45 117.350 115.000 2.350 1
1 508 . 19 1 1 A 46 46 ASP H H 46 8.010 7.892 0.118 1
1 509 . 19 1 1 A 46 46 ASP HA H 46 4.470 4.629 -0.159 1
1 512 . 19 1 1 A 46 46 ASP C C 46 174.570 174.504 0.066 1
1 513 . 19 1 1 A 46 46 ASP CA C 46 55.570 55.462 0.108 1
1 514 . 19 1 1 A 46 46 ASP CB C 46 41.680 41.526 0.154 1
1 515 . 19 1 1 A 46 46 ASP N N 46 122.240 122.260 -0.020 1
1 516 . 19 1 1 A 47 47 VAL H H 47 8.330 8.505 -0.175 1
1 517 . 19 1 1 A 47 47 VAL HA H 47 4.950 4.943 0.007 1
1 525 . 19 1 1 A 47 47 VAL C C 47 176.330 175.593 0.737 1
1 526 . 19 1 1 A 47 47 VAL CA C 47 61.710 60.906 0.804 1
1 527 . 19 1 1 A 47 47 VAL CB C 47 32.900 35.216 -2.316 1
1 530 . 19 1 1 A 47 47 VAL N N 47 119.860 121.825 -1.965 1
1 531 . 19 1 1 A 48 48 ILE H H 48 9.160 8.697 0.463 1
1 532 . 19 1 1 A 48 48 ILE HA H 48 4.630 5.187 -0.557 1
1 542 . 19 1 1 A 48 48 ILE C C 48 174.400 174.454 -0.054 1
1 543 . 19 1 1 A 48 48 ILE CA C 48 58.990 59.272 -0.282 1
1 544 . 19 1 1 A 48 48 ILE CB C 48 41.810 42.130 -0.320 1
1 548 . 19 1 1 A 48 48 ILE N N 48 124.990 121.613 3.377 1
1 549 . 19 1 1 A 49 49 GLY H H 49 8.660 8.962 -0.302 1
1 550 . 19 1 1 A 49 49 GLY HA2 H 49 4.950 4.308 0.642 1
1 551 . 19 1 1 A 49 49 GLY HA3 H 49 3.620 4.350 -0.730 1
1 552 . 19 1 1 A 49 49 GLY C C 49 172.920 171.931 0.989 1
1 553 . 19 1 1 A 49 49 GLY CA C 49 44.580 44.421 0.159 1
1 554 . 19 1 1 A 49 49 GLY N N 49 112.060 109.370 2.690 1
1 555 . 19 1 1 A 50 50 ILE H H 50 8.810 9.119 -0.309 1
1 556 . 19 1 1 A 50 50 ILE HA H 50 4.370 4.833 -0.463 1
1 566 . 19 1 1 A 50 50 ILE C C 50 174.500 174.633 -0.133 1
1 567 . 19 1 1 A 50 50 ILE CA C 50 59.550 59.865 -0.315 1
1 568 . 19 1 1 A 50 50 ILE CB C 50 41.300 41.293 0.007 1
1 572 . 19 1 1 A 50 50 ILE N N 50 123.220 125.373 -2.153 1
1 573 . 19 1 1 A 51 51 SER H H 51 8.540 8.834 -0.294 1
1 574 . 19 1 1 A 51 51 SER HA H 51 4.830 5.016 -0.186 1
1 577 . 19 1 1 A 51 51 SER C C 51 174.130 173.868 0.262 1
1 578 . 19 1 1 A 51 51 SER CA C 51 57.770 57.064 0.706 1
1 579 . 19 1 1 A 51 51 SER CB C 51 63.040 64.129 -1.089 1
1 580 . 19 1 1 A 51 51 SER N N 51 121.430 122.515 -1.085 1
1 581 . 19 1 1 A 52 52 ILE H H 52 8.930 8.702 0.228 1
1 582 . 19 1 1 A 52 52 ILE HA H 52 4.290 4.575 -0.285 1
1 592 . 19 1 1 A 52 52 ILE C C 52 175.280 176.017 -0.737 1
1 593 . 19 1 1 A 52 52 ILE CA C 52 60.250 60.225 0.025 1
1 594 . 19 1 1 A 52 52 ILE CB C 52 39.840 40.511 -0.671 1
1 598 . 19 1 1 A 52 52 ILE N N 52 127.060 127.844 -0.784 1
1 599 . 19 1 1 A 53 53 LEU H H 53 9.380 9.433 -0.053 1
1 600 . 19 1 1 A 53 53 LEU HA H 53 3.890 4.072 -0.182 1
1 610 . 19 1 1 A 53 53 LEU C C 53 177.130 176.984 0.146 1
1 611 . 19 1 1 A 53 53 LEU CA C 53 55.560 56.185 -0.625 1
1 612 . 19 1 1 A 53 53 LEU CB C 53 39.370 40.637 -1.267 1
1 616 . 19 1 1 A 53 53 LEU N N 53 126.770 129.581 -2.811 1
1 617 . 19 1 1 A 54 54 GLY H H 54 8.310 8.695 -0.385 1
1 618 . 19 1 1 A 54 54 GLY HA2 H 54 3.490 3.903 -0.413 1
1 619 . 19 1 1 A 54 54 GLY HA3 H 54 4.080 3.903 0.177 1
1 620 . 19 1 1 A 54 54 GLY C C 54 173.690 174.000 -0.310 1
1 621 . 19 1 1 A 54 54 GLY CA C 54 45.340 45.768 -0.428 1
1 622 . 19 1 1 A 54 54 GLY N N 54 103.820 104.371 -0.551 1
1 623 . 19 1 1 A 55 55 LYS H H 55 7.730 7.813 -0.083 1
1 624 . 19 1 1 A 55 55 LYS HA H 55 4.560 4.871 -0.311 1
1 633 . 19 1 1 A 55 55 LYS C C 55 174.550 175.102 -0.552 1
1 634 . 19 1 1 A 55 55 LYS CA C 55 54.140 54.965 -0.825 1
1 635 . 19 1 1 A 55 55 LYS CB C 55 34.620 35.594 -0.974 1
1 639 . 19 1 1 A 55 55 LYS N N 55 121.160 120.248 0.912 1
1 640 . 19 1 1 A 56 56 GLU H H 56 8.490 8.821 -0.331 1
1 641 . 19 1 1 A 56 56 GLU HA H 56 4.280 4.701 -0.421 1
1 646 . 19 1 1 A 56 56 GLU C C 56 175.730 175.213 0.517 1
1 647 . 19 1 1 A 56 56 GLU CA C 56 56.730 56.334 0.396 1
1 648 . 19 1 1 A 56 56 GLU CB C 56 30.070 30.671 -0.601 1
1 650 . 19 1 1 A 56 56 GLU N N 56 124.090 128.394 -4.304 1
1 651 . 19 1 1 A 57 57 VAL H H 57 8.920 8.459 0.461 1
1 652 . 19 1 1 A 57 57 VAL HA H 57 4.030 4.829 -0.799 1
1 660 . 19 1 1 A 57 57 VAL C C 57 174.610 173.831 0.779 1
1 661 . 19 1 1 A 57 57 VAL CA C 57 61.680 59.684 1.996 1
1 662 . 19 1 1 A 57 57 VAL CB C 57 33.880 34.559 -0.679 1
1 665 . 19 1 1 A 57 57 VAL N N 57 129.960 126.619 3.341 1
1 666 . 19 1 1 A 58 58 LYS H H 58 7.860 8.721 -0.861 1
1 667 . 19 1 1 A 58 58 LYS HA H 58 5.120 4.828 0.292 1
1 676 . 19 1 1 A 58 58 LYS C C 58 175.380 175.653 -0.273 1
1 677 . 19 1 1 A 58 58 LYS CA C 58 55.200 54.770 0.430 1
1 678 . 19 1 1 A 58 58 LYS CB C 58 34.670 34.287 0.383 1
1 682 . 19 1 1 A 58 58 LYS N N 58 124.790 127.373 -2.583 1
1 683 . 19 1 1 A 59 59 PHE H H 59 9.270 9.111 0.159 1
1 684 . 19 1 1 A 59 59 PHE HA H 59 4.960 5.148 -0.188 1
1 692 . 19 1 1 A 59 59 PHE C C 59 173.950 174.283 -0.333 1
1 693 . 19 1 1 A 59 59 PHE CA C 59 55.910 56.254 -0.344 1
1 694 . 19 1 1 A 59 59 PHE CB C 59 42.950 42.229 0.721 1
1 700 . 19 1 1 A 59 59 PHE N N 59 118.270 122.381 -4.111 1
1 701 . 19 1 1 A 60 60 LYS H H 60 9.170 8.902 0.268 1
1 702 . 19 1 1 A 60 60 LYS HA H 60 4.910 5.013 -0.103 1
1 711 . 19 1 1 A 60 60 LYS C C 60 176.230 175.847 0.383 1
1 712 . 19 1 1 A 60 60 LYS CA C 60 53.910 54.644 -0.734 1
1 713 . 19 1 1 A 60 60 LYS CB C 60 35.170 35.054 0.116 1
1 717 . 19 1 1 A 60 60 LYS N N 60 121.960 124.137 -2.177 1
1 718 . 19 1 1 A 61 61 VAL H H 61 9.400 8.822 0.578 1
1 719 . 19 1 1 A 61 61 VAL HA H 61 4.170 4.119 0.051 1
1 727 . 19 1 1 A 61 61 VAL C C 61 175.500 175.388 0.112 1
1 728 . 19 1 1 A 61 61 VAL CA C 61 61.980 63.139 -1.159 1
1 729 . 19 1 1 A 61 61 VAL CB C 61 29.490 31.299 -1.809 1
1 732 . 19 1 1 A 61 61 VAL N N 61 127.140 126.914 0.226 1
1 733 . 19 1 1 A 62 62 VAL H H 62 8.390 8.776 -0.386 1
1 734 . 19 1 1 A 62 62 VAL HA H 62 3.650 3.998 -0.348 1
1 742 . 19 1 1 A 62 62 VAL C C 62 176.440 176.124 0.316 1
1 743 . 19 1 1 A 62 62 VAL CA C 62 64.930 64.470 0.460 1
1 744 . 19 1 1 A 62 62 VAL CB C 62 32.130 32.504 -0.374 1
1 747 . 19 1 1 A 62 62 VAL N N 62 132.840 129.244 3.596 1
1 748 . 19 1 1 A 63 63 GLN H H 63 7.470 7.293 0.177 1
1 749 . 19 1 1 A 63 63 GLN HA H 63 4.270 4.746 -0.476 1
1 756 . 19 1 1 A 63 63 GLN C C 63 172.290 173.342 -1.052 1
1 757 . 19 1 1 A 63 63 GLN CA C 63 56.640 54.872 1.768 1
1 758 . 19 1 1 A 63 63 GLN CB C 63 32.630 32.853 -0.223 1
1 760 . 19 1 1 A 63 63 GLN N N 63 114.500 119.263 -4.763 1
1 762 . 19 1 1 A 64 64 ALA H H 64 8.200 8.560 -0.360 1
1 763 . 19 1 1 A 64 64 ALA HA H 64 4.830 5.393 -0.563 1
1 767 . 19 1 1 A 64 64 ALA C C 64 174.270 175.531 -1.261 1
1 768 . 19 1 1 A 64 64 ALA CA C 64 50.800 50.072 0.728 1
1 769 . 19 1 1 A 64 64 ALA CB C 64 20.100 21.841 -1.741 1
1 770 . 19 1 1 A 64 64 ALA N N 64 131.410 125.476 5.934 1
1 771 . 19 1 1 A 65 65 TYR H H 65 8.860 8.557 0.303 1
1 772 . 19 1 1 A 65 65 TYR HA H 65 4.540 5.003 -0.463 1
1 779 . 19 1 1 A 65 65 TYR CA C 65 54.270 55.019 -0.749 1
1 780 . 19 1 1 A 65 65 TYR CB C 65 41.360 40.370 0.990 1
1 785 . 19 1 1 A 65 65 TYR N N 65 124.140 120.189 3.951 1
1 786 . 19 1 1 A 66 66 PRO HA H 66 4.120 4.645 -0.525 1
1 793 . 19 1 1 A 66 66 PRO CA C 66 63.450 62.322 1.128 1
1 794 . 19 1 1 A 66 66 PRO CB C 66 34.170 32.742 1.428 1
1 797 . 19 1 1 A 67 67 SER H H 67 7.380 8.166 -0.786 1
1 798 . 19 1 1 A 67 67 SER HA H 67 4.720 4.960 -0.240 1
1 801 . 19 1 1 A 67 67 SER CA C 67 54.250 55.996 -1.746 1
1 802 . 19 1 1 A 67 67 SER CB C 67 64.530 63.794 0.736 1
1 803 . 19 1 1 A 67 67 SER N N 67 106.200 116.625 -10.425 1
1 804 . 19 1 1 A 68 68 PRO HA H 68 4.880 4.623 0.257 1
1 811 . 19 1 1 A 68 68 PRO CA C 68 62.990 62.476 0.514 1
1 812 . 19 1 1 A 68 68 PRO CB C 68 35.220 33.237 1.983 1
1 815 . 19 1 1 A 69 69 LEU H H 69 8.960 8.038 0.922 1
1 816 . 19 1 1 A 69 69 LEU HA H 69 4.430 5.113 -0.683 1
1 826 . 19 1 1 A 69 69 LEU C C 69 174.570 175.333 -0.763 1
1 827 . 19 1 1 A 69 69 LEU CA C 69 53.900 52.585 1.315 1
1 828 . 19 1 1 A 69 69 LEU CB C 69 44.210 46.097 -1.887 1
1 832 . 19 1 1 A 69 69 LEU N N 69 120.480 117.073 3.407 1
1 833 . 19 1 1 A 70 70 ARG H H 70 8.130 8.375 -0.245 1
1 834 . 19 1 1 A 70 70 ARG HA H 70 4.930 4.779 0.151 1
1 841 . 19 1 1 A 70 70 ARG C C 70 175.460 176.111 -0.651 1
1 842 . 19 1 1 A 70 70 ARG CA C 70 54.040 55.660 -1.620 1
1 843 . 19 1 1 A 70 70 ARG CB C 70 30.550 31.820 -1.270 1
1 846 . 19 1 1 A 70 70 ARG N N 70 125.180 119.658 5.522 1
1 847 . 19 1 1 A 71 71 VAL H H 71 8.450 8.216 0.234 1
1 848 . 19 1 1 A 71 71 VAL HA H 71 3.410 4.446 -1.036 1
1 856 . 19 1 1 A 71 71 VAL C C 71 175.460 175.636 -0.176 1
1 857 . 19 1 1 A 71 71 VAL CA C 71 65.210 62.131 3.079 1
1 858 . 19 1 1 A 71 71 VAL CB C 71 29.840 31.992 -2.152 1
1 861 . 19 1 1 A 71 71 VAL N N 71 128.170 122.443 5.727 1
1 862 . 19 1 1 A 72 72 GLU H H 72 8.620 8.447 0.173 1
1 863 . 19 1 1 A 72 72 GLU HA H 72 4.870 4.714 0.156 1
1 868 . 19 1 1 A 72 72 GLU C C 72 176.960 176.310 0.650 1
1 869 . 19 1 1 A 72 72 GLU CA C 72 54.330 54.206 0.124 1
1 870 . 19 1 1 A 72 72 GLU CB C 72 33.280 32.164 1.116 1
1 872 . 19 1 1 A 72 72 GLU N N 72 127.670 126.923 0.747 1
1 873 . 19 1 1 A 73 73 ASP H H 73 8.700 8.808 -0.108 1
1 874 . 19 1 1 A 73 73 ASP HA H 73 4.150 4.277 -0.127 1
1 877 . 19 1 1 A 73 73 ASP C C 73 177.460 177.573 -0.113 1
1 878 . 19 1 1 A 73 73 ASP CA C 73 57.620 56.666 0.954 1
1 879 . 19 1 1 A 73 73 ASP CB C 73 40.360 40.559 -0.199 1
1 880 . 19 1 1 A 73 73 ASP N N 73 121.140 122.228 -1.088 1
1 881 . 19 1 1 A 74 74 ARG H H 74 7.760 8.171 -0.411 1
1 882 . 19 1 1 A 74 74 ARG HA H 74 4.280 4.288 -0.008 1
1 889 . 19 1 1 A 74 74 ARG C C 74 176.510 176.552 -0.042 1
1 890 . 19 1 1 A 74 74 ARG CA C 74 55.450 57.398 -1.948 1
1 891 . 19 1 1 A 74 74 ARG CB C 74 29.990 29.980 0.010 1
1 894 . 19 1 1 A 74 74 ARG N N 74 112.890 115.383 -2.493 1
1 895 . 19 1 1 A 75 75 THR H H 75 7.700 7.547 0.153 1
1 896 . 19 1 1 A 75 75 THR HA H 75 4.020 4.273 -0.253 1
1 901 . 19 1 1 A 75 75 THR C C 75 173.810 173.924 -0.114 1
1 902 . 19 1 1 A 75 75 THR CA C 75 64.060 63.829 0.231 1
1 903 . 19 1 1 A 75 75 THR CB C 75 69.350 69.612 -0.262 1
1 905 . 19 1 1 A 75 75 THR N N 75 120.650 117.108 3.542 1
1 906 . 19 1 1 A 76 76 LYS H H 76 8.520 8.257 0.263 1
1 907 . 19 1 1 A 76 76 LYS HA H 76 4.270 4.617 -0.347 1
1 916 . 19 1 1 A 76 76 LYS C C 76 174.560 175.817 -1.257 1
1 917 . 19 1 1 A 76 76 LYS CA C 76 56.280 56.033 0.247 1
1 918 . 19 1 1 A 76 76 LYS CB C 76 33.120 33.553 -0.433 1
1 922 . 19 1 1 A 76 76 LYS N N 76 130.950 127.168 3.782 1
1 923 . 19 1 1 A 77 77 ILE H H 77 8.430 8.644 -0.214 1
1 924 . 19 1 1 A 77 77 ILE HA H 77 4.850 5.171 -0.321 1
1 934 . 19 1 1 A 77 77 ILE C C 77 174.650 174.895 -0.245 1
1 935 . 19 1 1 A 77 77 ILE CA C 77 59.820 60.099 -0.279 1
1 936 . 19 1 1 A 77 77 ILE CB C 77 38.280 40.905 -2.625 1
1 940 . 19 1 1 A 77 77 ILE N N 77 128.020 122.950 5.070 1
1 941 . 19 1 1 A 78 78 THR H H 78 8.870 8.794 0.076 1
1 942 . 19 1 1 A 78 78 THR HA H 78 4.470 5.101 -0.631 1
1 947 . 19 1 1 A 78 78 THR C C 78 172.760 173.403 -0.643 1
1 948 . 19 1 1 A 78 78 THR CA C 78 60.740 61.343 -0.603 1
1 949 . 19 1 1 A 78 78 THR CB C 78 71.320 71.558 -0.238 1
1 951 . 19 1 1 A 78 78 THR N N 78 123.870 123.967 -0.097 1
1 952 . 19 1 1 A 79 79 LEU H H 79 8.820 8.929 -0.109 1
1 953 . 19 1 1 A 79 79 LEU HA H 79 5.140 5.059 0.081 1
1 963 . 19 1 1 A 79 79 LEU C C 79 176.610 175.889 0.721 1
1 964 . 19 1 1 A 79 79 LEU CA C 79 53.280 53.336 -0.056 1
1 965 . 19 1 1 A 79 79 LEU CB C 79 42.600 42.776 -0.176 1
1 969 . 19 1 1 A 79 79 LEU N N 79 127.070 126.471 0.599 1
1 970 . 19 1 1 A 80 80 VAL H H 80 8.800 8.760 0.040 1
1 971 . 19 1 1 A 80 80 VAL HA H 80 4.260 4.662 -0.402 1
1 979 . 19 1 1 A 80 80 VAL CA C 80 61.350 61.339 0.011 1
1 980 . 19 1 1 A 80 80 VAL CB C 80 32.790 33.134 -0.344 1
1 983 . 19 1 1 A 80 80 VAL N N 80 124.120 125.736 -1.616 1
1 984 . 19 1 1 A 81 81 THR H H 81 8.160 8.283 -0.123 1
1 985 . 19 1 1 A 81 81 THR HA H 81 4.410 4.988 -0.578 1
1 990 . 19 1 1 A 81 81 THR CA C 81 60.800 60.548 0.252 1
1 991 . 19 1 1 A 81 81 THR CB C 81 69.650 71.333 -1.683 1
1 993 . 19 1 1 A 81 81 THR N N 81 114.500 118.243 -3.743 1
1 1 . 20 1 1 A 9 9 GLY H H 9 8.390 8.662 -0.272 1
1 2 . 20 1 1 A 9 9 GLY HA2 H 9 3.900 4.211 -0.311 1
1 3 . 20 1 1 A 9 9 GLY HA3 H 9 3.860 4.213 -0.353 1
1 4 . 20 1 1 A 9 9 GLY CA C 9 45.150 45.663 -0.513 1
1 5 . 20 1 1 A 9 9 GLY N N 9 110.000 111.853 -1.853 1
1 6 . 20 1 1 A 10 10 VAL H H 10 7.870 8.285 -0.415 1
1 7 . 20 1 1 A 10 10 VAL HA H 10 4.040 4.747 -0.707 1
1 15 . 20 1 1 A 10 10 VAL C C 10 175.880 174.282 1.598 1
1 16 . 20 1 1 A 10 10 VAL CA C 10 62.110 60.393 1.717 1
1 17 . 20 1 1 A 10 10 VAL CB C 10 32.760 36.144 -3.384 1
1 20 . 20 1 1 A 10 10 VAL N N 10 119.730 121.617 -1.887 1
1 21 . 20 1 1 A 11 11 ILE H H 11 8.230 8.505 -0.275 1
1 22 . 20 1 1 A 11 11 ILE HA H 11 4.090 4.641 -0.551 1
1 32 . 20 1 1 A 11 11 ILE C C 11 175.850 175.303 0.547 1
1 33 . 20 1 1 A 11 11 ILE CA C 11 60.800 60.248 0.552 1
1 34 . 20 1 1 A 11 11 ILE CB C 11 38.470 38.801 -0.331 1
1 38 . 20 1 1 A 11 11 ILE N N 11 125.570 126.126 -0.556 1
1 39 . 20 1 1 A 12 12 MET H H 12 8.370 8.902 -0.532 1
1 40 . 20 1 1 A 12 12 MET HA H 12 4.540 5.315 -0.775 1
1 48 . 20 1 1 A 12 12 MET C C 12 174.830 174.896 -0.066 1
1 49 . 20 1 1 A 12 12 MET CA C 12 54.790 53.601 1.189 1
1 50 . 20 1 1 A 12 12 MET CB C 12 32.640 35.818 -3.178 1
1 53 . 20 1 1 A 12 12 MET N N 12 125.930 123.766 2.164 1
1 54 . 20 1 1 A 13 13 SER H H 13 7.990 8.947 -0.957 1
1 55 . 20 1 1 A 13 13 SER HA H 13 5.030 5.422 -0.392 1
1 58 . 20 1 1 A 13 13 SER C C 13 174.330 173.842 0.488 1
1 59 . 20 1 1 A 13 13 SER CA C 13 57.320 56.071 1.249 1
1 60 . 20 1 1 A 13 13 SER CB C 13 64.790 65.635 -0.845 1
1 61 . 20 1 1 A 13 13 SER N N 13 116.400 117.915 -1.515 1
1 62 . 20 1 1 A 14 14 GLU H H 14 9.430 8.554 0.876 1
1 63 . 20 1 1 A 14 14 GLU HA H 14 5.250 5.422 -0.172 1
1 68 . 20 1 1 A 14 14 GLU C C 14 172.980 174.810 -1.830 1
1 69 . 20 1 1 A 14 14 GLU CA C 14 55.390 55.027 0.363 1
1 70 . 20 1 1 A 14 14 GLU CB C 14 33.910 34.542 -0.632 1
1 72 . 20 1 1 A 14 14 GLU N N 14 123.670 119.811 3.859 1
1 73 . 20 1 1 A 15 15 LEU H H 15 8.930 8.950 -0.020 1
1 74 . 20 1 1 A 15 15 LEU HA H 15 4.870 5.039 -0.169 1
1 84 . 20 1 1 A 15 15 LEU C C 15 174.000 174.496 -0.496 1
1 85 . 20 1 1 A 15 15 LEU CA C 15 53.020 53.552 -0.532 1
1 86 . 20 1 1 A 15 15 LEU CB C 15 46.040 45.503 0.537 1
1 90 . 20 1 1 A 15 15 LEU N N 15 125.350 125.700 -0.350 1
1 91 . 20 1 1 A 16 16 LYS H H 16 8.840 8.717 0.123 1
1 92 . 20 1 1 A 16 16 LYS HA H 16 5.360 4.851 0.509 1
1 101 . 20 1 1 A 16 16 LYS C C 16 175.660 175.341 0.319 1
1 102 . 20 1 1 A 16 16 LYS CA C 16 54.940 55.527 -0.587 1
1 103 . 20 1 1 A 16 16 LYS CB C 16 34.280 33.805 0.475 1
1 107 . 20 1 1 A 16 16 LYS N N 16 124.640 127.085 -2.445 1
1 108 . 20 1 1 A 17 17 LEU H H 17 8.820 8.932 -0.112 1
1 109 . 20 1 1 A 17 17 LEU HA H 17 5.430 5.204 0.226 1
1 119 . 20 1 1 A 17 17 LEU C C 17 174.630 175.287 -0.657 1
1 120 . 20 1 1 A 17 17 LEU CA C 17 52.900 53.282 -0.382 1
1 121 . 20 1 1 A 17 17 LEU CB C 17 46.910 45.213 1.697 1
1 125 . 20 1 1 A 17 17 LEU N N 17 123.460 126.586 -3.126 1
1 126 . 20 1 1 A 18 18 LYS H H 18 9.110 8.672 0.438 1
1 127 . 20 1 1 A 18 18 LYS HA H 18 5.490 5.032 0.458 1
1 136 . 20 1 1 A 18 18 LYS CA C 18 52.270 52.913 -0.643 1
1 137 . 20 1 1 A 18 18 LYS CB C 18 37.500 35.999 1.501 1
1 141 . 20 1 1 A 18 18 LYS N N 18 122.230 123.755 -1.525 1
1 142 . 20 1 1 A 19 19 PRO HA H 19 4.100 4.925 -0.825 1
1 149 . 20 1 1 A 19 19 PRO CA C 19 62.440 62.838 -0.398 1
1 150 . 20 1 1 A 19 19 PRO CB C 19 30.640 32.309 -1.669 1
1 153 . 20 1 1 A 20 20 LEU H H 20 8.490 8.591 -0.101 1
1 154 . 20 1 1 A 20 20 LEU HA H 20 4.320 4.199 0.121 1
1 164 . 20 1 1 A 20 20 LEU CA C 20 57.680 58.791 -1.111 1
1 165 . 20 1 1 A 20 20 LEU CB C 20 38.760 40.551 -1.791 1
1 169 . 20 1 1 A 20 20 LEU N N 20 123.250 119.875 3.375 1
1 170 . 20 1 1 A 21 21 PRO HA H 21 4.530 4.556 -0.026 1
1 177 . 20 1 1 A 21 21 PRO CA C 21 62.880 62.408 0.472 1
1 178 . 20 1 1 A 21 21 PRO CB C 21 31.420 32.434 -1.014 1
1 181 . 20 1 1 A 22 22 LYS H H 22 8.180 8.379 -0.199 1
1 182 . 20 1 1 A 22 22 LYS HA H 22 4.110 4.537 -0.427 1
1 191 . 20 1 1 A 22 22 LYS C C 22 175.680 175.323 0.357 1
1 192 . 20 1 1 A 22 22 LYS CA C 22 56.210 55.767 0.443 1
1 193 . 20 1 1 A 22 22 LYS CB C 22 30.660 32.189 -1.529 1
1 197 . 20 1 1 A 22 22 LYS N N 22 119.160 121.637 -2.477 1
1 198 . 20 1 1 A 23 23 VAL H H 23 7.530 7.974 -0.444 1
1 199 . 20 1 1 A 23 23 VAL HA H 23 4.280 4.804 -0.524 1
1 207 . 20 1 1 A 23 23 VAL C C 23 173.690 173.242 0.448 1
1 208 . 20 1 1 A 23 23 VAL CA C 23 59.830 59.633 0.197 1
1 209 . 20 1 1 A 23 23 VAL CB C 23 34.550 35.585 -1.035 1
1 212 . 20 1 1 A 23 23 VAL N N 23 121.820 125.294 -3.474 1
1 213 . 20 1 1 A 24 24 GLU H H 24 8.270 8.966 -0.696 1
1 214 . 20 1 1 A 24 24 GLU HA H 24 4.330 4.983 -0.653 1
1 219 . 20 1 1 A 24 24 GLU C C 24 175.390 175.216 0.174 1
1 220 . 20 1 1 A 24 24 GLU CA C 24 55.220 54.628 0.592 1
1 221 . 20 1 1 A 24 24 GLU CB C 24 29.970 33.084 -3.114 1
1 223 . 20 1 1 A 24 24 GLU N N 24 125.610 127.143 -1.533 1
1 224 . 20 1 1 A 25 25 LEU H H 25 8.480 8.779 -0.299 1
1 225 . 20 1 1 A 25 25 LEU HA H 25 4.520 4.442 0.078 1
1 235 . 20 1 1 A 25 25 LEU CA C 25 51.660 51.866 -0.206 1
1 236 . 20 1 1 A 25 25 LEU CB C 25 41.750 40.873 0.877 1
1 240 . 20 1 1 A 25 25 LEU N N 25 125.880 125.561 0.319 1
1 241 . 20 1 1 A 26 26 PRO HA H 26 4.760 4.604 0.156 1
1 248 . 20 1 1 A 26 26 PRO CA C 26 61.330 61.889 -0.559 1
1 249 . 20 1 1 A 26 26 PRO CB C 26 31.060 32.727 -1.667 1
1 252 . 20 1 1 A 27 27 PRO HA H 27 4.390 4.391 -0.001 1
1 259 . 20 1 1 A 27 27 PRO CA C 27 64.550 64.836 -0.286 1
1 260 . 20 1 1 A 27 27 PRO CB C 27 31.770 31.735 0.035 1
1 263 . 20 1 1 A 28 28 ASP H H 28 8.560 8.792 -0.232 1
1 264 . 20 1 1 A 28 28 ASP HA H 28 4.620 4.429 0.191 1
1 267 . 20 1 1 A 28 28 ASP C C 28 177.100 178.761 -1.661 1
1 268 . 20 1 1 A 28 28 ASP CA C 28 53.890 56.300 -2.410 1
1 269 . 20 1 1 A 28 28 ASP CB C 28 39.120 39.590 -0.470 1
1 270 . 20 1 1 A 28 28 ASP N N 28 115.820 117.818 -1.998 1
1 271 . 20 1 1 A 29 29 PHE H H 29 7.940 7.977 -0.037 1
1 272 . 20 1 1 A 29 29 PHE HA H 29 4.180 4.335 -0.155 1
1 280 . 20 1 1 A 29 29 PHE C C 29 176.740 178.212 -1.472 1
1 281 . 20 1 1 A 29 29 PHE CA C 29 61.020 61.116 -0.096 1
1 282 . 20 1 1 A 29 29 PHE CB C 29 39.230 38.584 0.646 1
1 288 . 20 1 1 A 29 29 PHE N N 29 119.610 118.211 1.399 1
1 289 . 20 1 1 A 30 30 VAL H H 30 8.010 8.455 -0.445 1
1 290 . 20 1 1 A 30 30 VAL HA H 30 3.350 3.750 -0.400 1
1 298 . 20 1 1 A 30 30 VAL C C 30 176.400 177.156 -0.756 1
1 299 . 20 1 1 A 30 30 VAL CA C 30 66.510 64.810 1.700 1
1 300 . 20 1 1 A 30 30 VAL CB C 30 31.020 30.992 0.028 1
1 303 . 20 1 1 A 30 30 VAL N N 30 116.370 119.411 -3.041 1
1 304 . 20 1 1 A 31 31 ASP H H 31 7.420 8.007 -0.587 1
1 305 . 20 1 1 A 31 31 ASP HA H 31 4.310 4.365 -0.055 1
1 308 . 20 1 1 A 31 31 ASP C C 31 178.360 178.891 -0.531 1
1 309 . 20 1 1 A 31 31 ASP CA C 31 57.110 57.109 0.001 1
1 310 . 20 1 1 A 31 31 ASP CB C 31 40.450 40.898 -0.448 1
1 311 . 20 1 1 A 31 31 ASP N N 31 119.190 121.734 -2.544 1
1 312 . 20 1 1 A 32 32 VAL H H 32 7.190 7.383 -0.193 1
1 313 . 20 1 1 A 32 32 VAL HA H 32 3.510 3.560 -0.050 1
1 321 . 20 1 1 A 32 32 VAL C C 32 178.100 178.399 -0.299 1
1 322 . 20 1 1 A 32 32 VAL CA C 32 65.570 66.376 -0.806 1
1 323 . 20 1 1 A 32 32 VAL CB C 32 31.410 31.303 0.107 1
1 326 . 20 1 1 A 32 32 VAL N N 32 119.830 120.233 -0.403 1
1 327 . 20 1 1 A 33 33 ILE H H 33 7.660 8.445 -0.785 1
1 328 . 20 1 1 A 33 33 ILE HA H 33 3.170 3.612 -0.442 1
1 338 . 20 1 1 A 33 33 ILE C C 33 176.660 178.041 -1.381 1
1 339 . 20 1 1 A 33 33 ILE CA C 33 65.220 65.239 -0.019 1
1 340 . 20 1 1 A 33 33 ILE CB C 33 37.500 37.490 0.010 1
1 344 . 20 1 1 A 33 33 ILE N N 33 118.490 120.852 -2.362 1
1 345 . 20 1 1 A 34 34 ARG H H 34 7.830 7.692 0.138 1
1 346 . 20 1 1 A 34 34 ARG HA H 34 3.380 3.941 -0.561 1
1 354 . 20 1 1 A 34 34 ARG C C 34 178.060 178.375 -0.315 1
1 355 . 20 1 1 A 34 34 ARG CA C 34 60.570 59.193 1.377 1
1 356 . 20 1 1 A 34 34 ARG CB C 34 30.070 29.900 0.170 1
1 359 . 20 1 1 A 34 34 ARG N N 34 118.260 120.514 -2.254 1
1 361 . 20 1 1 A 35 35 ILE H H 35 7.350 7.886 -0.536 1
1 362 . 20 1 1 A 35 35 ILE HA H 35 3.720 3.740 -0.020 1
1 372 . 20 1 1 A 35 35 ILE C C 35 179.090 178.277 0.813 1
1 373 . 20 1 1 A 35 35 ILE CA C 35 64.060 65.086 -1.026 1
1 374 . 20 1 1 A 35 35 ILE CB C 35 38.030 37.809 0.221 1
1 378 . 20 1 1 A 35 35 ILE N N 35 116.750 119.530 -2.780 1
1 379 . 20 1 1 A 36 36 LYS H H 36 7.880 8.158 -0.278 1
1 380 . 20 1 1 A 36 36 LYS HA H 36 4.090 4.050 0.040 1
1 389 . 20 1 1 A 36 36 LYS C C 36 178.560 178.059 0.501 1
1 390 . 20 1 1 A 36 36 LYS CA C 36 57.650 58.886 -1.236 1
1 391 . 20 1 1 A 36 36 LYS CB C 36 32.090 31.802 0.288 1
1 395 . 20 1 1 A 36 36 LYS N N 36 118.700 120.579 -1.879 1
1 396 . 20 1 1 A 37 37 LEU H H 37 7.860 7.377 0.483 1
1 397 . 20 1 1 A 37 37 LEU HA H 37 4.230 4.288 -0.058 1
1 407 . 20 1 1 A 37 37 LEU C C 37 175.880 176.814 -0.934 1
1 408 . 20 1 1 A 37 37 LEU CA C 37 54.090 56.161 -2.071 1
1 409 . 20 1 1 A 37 37 LEU CB C 37 43.310 42.774 0.536 1
1 413 . 20 1 1 A 37 37 LEU N N 37 116.380 117.738 -1.358 1
1 414 . 20 1 1 A 38 38 GLN H H 38 7.190 7.500 -0.310 1
1 415 . 20 1 1 A 38 38 GLN HA H 38 3.530 4.463 -0.933 1
1 422 . 20 1 1 A 38 38 GLN C C 38 177.480 176.280 1.200 1
1 423 . 20 1 1 A 38 38 GLN CA C 38 58.370 56.844 1.526 1
1 424 . 20 1 1 A 38 38 GLN CB C 38 28.300 28.724 -0.424 1
1 426 . 20 1 1 A 38 38 GLN N N 38 119.210 117.604 1.606 1
1 428 . 20 1 1 A 39 39 GLY H H 39 8.940 8.885 0.055 1
1 429 . 20 1 1 A 39 39 GLY HA2 H 39 3.540 3.994 -0.454 1
1 430 . 20 1 1 A 39 39 GLY HA3 H 39 4.220 3.994 0.226 1
1 431 . 20 1 1 A 39 39 GLY C C 39 174.070 174.383 -0.313 1
1 432 . 20 1 1 A 39 39 GLY CA C 39 45.280 45.072 0.208 1
1 433 . 20 1 1 A 39 39 GLY N N 39 113.490 112.178 1.312 1
1 434 . 20 1 1 A 40 40 LYS H H 40 8.350 7.650 0.700 1
1 435 . 20 1 1 A 40 40 LYS HA H 40 4.400 4.611 -0.211 1
1 444 . 20 1 1 A 40 40 LYS C C 40 175.560 175.857 -0.297 1
1 445 . 20 1 1 A 40 40 LYS CA C 40 55.660 54.648 1.012 1
1 446 . 20 1 1 A 40 40 LYS CB C 40 32.870 33.772 -0.902 1
1 450 . 20 1 1 A 40 40 LYS N N 40 122.060 119.997 2.063 1
1 451 . 20 1 1 A 41 41 THR H H 41 8.410 8.586 -0.176 1
1 452 . 20 1 1 A 41 41 THR HA H 41 5.330 4.989 0.341 1
1 457 . 20 1 1 A 41 41 THR C C 41 174.860 174.336 0.524 1
1 458 . 20 1 1 A 41 41 THR CA C 41 62.040 61.645 0.395 1
1 459 . 20 1 1 A 41 41 THR CB C 41 69.420 70.879 -1.459 1
1 461 . 20 1 1 A 41 41 THR N N 41 118.150 117.294 0.856 1
1 462 . 20 1 1 A 42 42 VAL H H 42 9.140 9.109 0.031 1
1 463 . 20 1 1 A 42 42 VAL HA H 42 4.570 5.047 -0.477 1
1 471 . 20 1 1 A 42 42 VAL C C 42 172.970 173.548 -0.578 1
1 472 . 20 1 1 A 42 42 VAL CA C 42 59.450 59.207 0.243 1
1 473 . 20 1 1 A 42 42 VAL CB C 42 35.880 35.477 0.403 1
1 476 . 20 1 1 A 42 42 VAL N N 42 122.510 119.711 2.799 1
1 477 . 20 1 1 A 43 43 ARG H H 43 8.420 8.691 -0.271 1
1 478 . 20 1 1 A 43 43 ARG HA H 43 4.750 4.969 -0.219 1
1 485 . 20 1 1 A 43 43 ARG C C 43 175.650 174.897 0.753 1
1 486 . 20 1 1 A 43 43 ARG CA C 43 53.650 54.154 -0.504 1
1 487 . 20 1 1 A 43 43 ARG CB C 43 33.870 34.005 -0.135 1
1 490 . 20 1 1 A 43 43 ARG N N 43 120.640 122.602 -1.962 1
1 491 . 20 1 1 A 44 44 THR H H 44 8.370 8.584 -0.214 1
1 492 . 20 1 1 A 44 44 THR HA H 44 3.410 3.760 -0.350 1
1 497 . 20 1 1 A 44 44 THR C C 44 175.020 175.818 -0.798 1
1 498 . 20 1 1 A 44 44 THR CA C 44 65.660 64.990 0.670 1
1 499 . 20 1 1 A 44 44 THR CB C 44 69.400 68.343 1.057 1
1 501 . 20 1 1 A 44 44 THR N N 44 118.590 119.575 -0.985 1
1 502 . 20 1 1 A 45 45 GLY H H 45 9.090 8.751 0.339 1
1 503 . 20 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 20 1 1 A 45 45 GLY HA3 H 45 4.470 4.021 0.449 1
1 505 . 20 1 1 A 45 45 GLY C C 45 174.350 173.844 0.506 1
1 506 . 20 1 1 A 45 45 GLY CA C 45 45.000 44.960 0.040 1
1 507 . 20 1 1 A 45 45 GLY N N 45 117.350 114.923 2.427 1
1 508 . 20 1 1 A 46 46 ASP H H 46 8.010 7.890 0.120 1
1 509 . 20 1 1 A 46 46 ASP HA H 46 4.470 4.622 -0.152 1
1 512 . 20 1 1 A 46 46 ASP C C 46 174.570 174.498 0.072 1
1 513 . 20 1 1 A 46 46 ASP CA C 46 55.570 55.437 0.133 1
1 514 . 20 1 1 A 46 46 ASP CB C 46 41.680 41.497 0.183 1
1 515 . 20 1 1 A 46 46 ASP N N 46 122.240 122.223 0.017 1
1 516 . 20 1 1 A 47 47 VAL H H 47 8.330 8.501 -0.171 1
1 517 . 20 1 1 A 47 47 VAL HA H 47 4.950 4.917 0.033 1
1 525 . 20 1 1 A 47 47 VAL C C 47 176.330 175.438 0.892 1
1 526 . 20 1 1 A 47 47 VAL CA C 47 61.710 60.897 0.813 1
1 527 . 20 1 1 A 47 47 VAL CB C 47 32.900 35.215 -2.315 1
1 530 . 20 1 1 A 47 47 VAL N N 47 119.860 122.093 -2.233 1
1 531 . 20 1 1 A 48 48 ILE H H 48 9.160 8.700 0.460 1
1 532 . 20 1 1 A 48 48 ILE HA H 48 4.630 5.133 -0.503 1
1 542 . 20 1 1 A 48 48 ILE C C 48 174.400 174.362 0.038 1
1 543 . 20 1 1 A 48 48 ILE CA C 48 58.990 59.225 -0.235 1
1 544 . 20 1 1 A 48 48 ILE CB C 48 41.810 42.255 -0.445 1
1 548 . 20 1 1 A 48 48 ILE N N 48 124.990 121.644 3.346 1
1 549 . 20 1 1 A 49 49 GLY H H 49 8.660 8.940 -0.280 1
1 550 . 20 1 1 A 49 49 GLY HA2 H 49 4.950 4.204 0.746 1
1 551 . 20 1 1 A 49 49 GLY HA3 H 49 3.620 4.240 -0.620 1
1 552 . 20 1 1 A 49 49 GLY C C 49 172.920 171.942 0.978 1
1 553 . 20 1 1 A 49 49 GLY CA C 49 44.580 44.380 0.200 1
1 554 . 20 1 1 A 49 49 GLY N N 49 112.060 109.654 2.406 1
1 555 . 20 1 1 A 50 50 ILE H H 50 8.810 8.801 0.009 1
1 556 . 20 1 1 A 50 50 ILE HA H 50 4.370 4.796 -0.426 1
1 566 . 20 1 1 A 50 50 ILE C C 50 174.500 174.825 -0.325 1
1 567 . 20 1 1 A 50 50 ILE CA C 50 59.550 59.693 -0.143 1
1 568 . 20 1 1 A 50 50 ILE CB C 50 41.300 42.023 -0.723 1
1 572 . 20 1 1 A 50 50 ILE N N 50 123.220 125.199 -1.979 1
1 573 . 20 1 1 A 51 51 SER H H 51 8.540 9.011 -0.471 1
1 574 . 20 1 1 A 51 51 SER HA H 51 4.830 5.122 -0.292 1
1 577 . 20 1 1 A 51 51 SER C C 51 174.130 174.009 0.121 1
1 578 . 20 1 1 A 51 51 SER CA C 51 57.770 56.693 1.077 1
1 579 . 20 1 1 A 51 51 SER CB C 51 63.040 64.522 -1.482 1
1 580 . 20 1 1 A 51 51 SER N N 51 121.430 121.199 0.231 1
1 581 . 20 1 1 A 52 52 ILE H H 52 8.930 8.778 0.152 1
1 582 . 20 1 1 A 52 52 ILE HA H 52 4.290 4.648 -0.358 1
1 592 . 20 1 1 A 52 52 ILE C C 52 175.280 176.156 -0.876 1
1 593 . 20 1 1 A 52 52 ILE CA C 52 60.250 60.390 -0.140 1
1 594 . 20 1 1 A 52 52 ILE CB C 52 39.840 40.420 -0.580 1
1 598 . 20 1 1 A 52 52 ILE N N 52 127.060 124.422 2.638 1
1 599 . 20 1 1 A 53 53 LEU H H 53 9.380 9.528 -0.148 1
1 600 . 20 1 1 A 53 53 LEU HA H 53 3.890 4.102 -0.212 1
1 610 . 20 1 1 A 53 53 LEU C C 53 177.130 176.986 0.144 1
1 611 . 20 1 1 A 53 53 LEU CA C 53 55.560 56.211 -0.651 1
1 612 . 20 1 1 A 53 53 LEU CB C 53 39.370 40.680 -1.310 1
1 616 . 20 1 1 A 53 53 LEU N N 53 126.770 130.172 -3.402 1
1 617 . 20 1 1 A 54 54 GLY H H 54 8.310 8.708 -0.398 1
1 618 . 20 1 1 A 54 54 GLY HA2 H 54 3.490 3.887 -0.397 1
1 619 . 20 1 1 A 54 54 GLY HA3 H 54 4.080 3.887 0.193 1
1 620 . 20 1 1 A 54 54 GLY C C 54 173.690 173.816 -0.126 1
1 621 . 20 1 1 A 54 54 GLY CA C 54 45.340 45.749 -0.409 1
1 622 . 20 1 1 A 54 54 GLY N N 54 103.820 104.359 -0.539 1
1 623 . 20 1 1 A 55 55 LYS H H 55 7.730 7.943 -0.213 1
1 624 . 20 1 1 A 55 55 LYS HA H 55 4.560 4.701 -0.141 1
1 633 . 20 1 1 A 55 55 LYS C C 55 174.550 175.018 -0.468 1
1 634 . 20 1 1 A 55 55 LYS CA C 55 54.140 54.576 -0.436 1
1 635 . 20 1 1 A 55 55 LYS CB C 55 34.620 34.884 -0.264 1
1 639 . 20 1 1 A 55 55 LYS N N 55 121.160 119.914 1.246 1
1 640 . 20 1 1 A 56 56 GLU H H 56 8.490 8.832 -0.342 1
1 641 . 20 1 1 A 56 56 GLU HA H 56 4.280 4.673 -0.393 1
1 646 . 20 1 1 A 56 56 GLU C C 56 175.730 175.117 0.613 1
1 647 . 20 1 1 A 56 56 GLU CA C 56 56.730 56.302 0.428 1
1 648 . 20 1 1 A 56 56 GLU CB C 56 30.070 30.724 -0.654 1
1 650 . 20 1 1 A 56 56 GLU N N 56 124.090 125.338 -1.248 1
1 651 . 20 1 1 A 57 57 VAL H H 57 8.920 8.367 0.553 1
1 652 . 20 1 1 A 57 57 VAL HA H 57 4.030 4.730 -0.700 1
1 660 . 20 1 1 A 57 57 VAL C C 57 174.610 173.358 1.252 1
1 661 . 20 1 1 A 57 57 VAL CA C 57 61.680 59.382 2.298 1
1 662 . 20 1 1 A 57 57 VAL CB C 57 33.880 34.228 -0.348 1
1 665 . 20 1 1 A 57 57 VAL N N 57 129.960 126.574 3.386 1
1 666 . 20 1 1 A 58 58 LYS H H 58 7.860 8.607 -0.747 1
1 667 . 20 1 1 A 58 58 LYS HA H 58 5.120 4.605 0.515 1
1 676 . 20 1 1 A 58 58 LYS C C 58 175.380 175.503 -0.123 1
1 677 . 20 1 1 A 58 58 LYS CA C 58 55.200 54.671 0.529 1
1 678 . 20 1 1 A 58 58 LYS CB C 58 34.670 33.787 0.883 1
1 682 . 20 1 1 A 58 58 LYS N N 58 124.790 127.151 -2.361 1
1 683 . 20 1 1 A 59 59 PHE H H 59 9.270 8.820 0.450 1
1 684 . 20 1 1 A 59 59 PHE HA H 59 4.960 5.066 -0.106 1
1 692 . 20 1 1 A 59 59 PHE C C 59 173.950 174.399 -0.449 1
1 693 . 20 1 1 A 59 59 PHE CA C 59 55.910 56.444 -0.534 1
1 694 . 20 1 1 A 59 59 PHE CB C 59 42.950 41.735 1.215 1
1 700 . 20 1 1 A 59 59 PHE N N 59 118.270 123.088 -4.818 1
1 701 . 20 1 1 A 60 60 LYS H H 60 9.170 8.925 0.245 1
1 702 . 20 1 1 A 60 60 LYS HA H 60 4.910 4.947 -0.037 1
1 711 . 20 1 1 A 60 60 LYS C C 60 176.230 175.968 0.262 1
1 712 . 20 1 1 A 60 60 LYS CA C 60 53.910 54.527 -0.617 1
1 713 . 20 1 1 A 60 60 LYS CB C 60 35.170 35.039 0.131 1
1 717 . 20 1 1 A 60 60 LYS N N 60 121.960 124.430 -2.470 1
1 718 . 20 1 1 A 61 61 VAL H H 61 9.400 8.803 0.597 1
1 719 . 20 1 1 A 61 61 VAL HA H 61 4.170 4.014 0.156 1
1 727 . 20 1 1 A 61 61 VAL C C 61 175.500 175.396 0.104 1
1 728 . 20 1 1 A 61 61 VAL CA C 61 61.980 63.526 -1.546 1
1 729 . 20 1 1 A 61 61 VAL CB C 61 29.490 31.135 -1.645 1
1 732 . 20 1 1 A 61 61 VAL N N 61 127.140 127.057 0.083 1
1 733 . 20 1 1 A 62 62 VAL H H 62 8.390 8.698 -0.308 1
1 734 . 20 1 1 A 62 62 VAL HA H 62 3.650 3.974 -0.324 1
1 742 . 20 1 1 A 62 62 VAL C C 62 176.440 176.112 0.328 1
1 743 . 20 1 1 A 62 62 VAL CA C 62 64.930 64.384 0.546 1
1 744 . 20 1 1 A 62 62 VAL CB C 62 32.130 32.431 -0.301 1
1 747 . 20 1 1 A 62 62 VAL N N 62 132.840 129.509 3.331 1
1 748 . 20 1 1 A 63 63 GLN H H 63 7.470 7.093 0.377 1
1 749 . 20 1 1 A 63 63 GLN HA H 63 4.270 4.478 -0.208 1
1 756 . 20 1 1 A 63 63 GLN C C 63 172.290 173.353 -1.063 1
1 757 . 20 1 1 A 63 63 GLN CA C 63 56.640 55.444 1.196 1
1 758 . 20 1 1 A 63 63 GLN CB C 63 32.630 31.847 0.783 1
1 760 . 20 1 1 A 63 63 GLN N N 63 114.500 117.046 -2.546 1
1 762 . 20 1 1 A 64 64 ALA H H 64 8.200 8.495 -0.295 1
1 763 . 20 1 1 A 64 64 ALA HA H 64 4.830 5.314 -0.484 1
1 767 . 20 1 1 A 64 64 ALA C C 64 174.270 175.773 -1.503 1
1 768 . 20 1 1 A 64 64 ALA CA C 64 50.800 50.077 0.723 1
1 769 . 20 1 1 A 64 64 ALA CB C 64 20.100 21.756 -1.656 1
1 770 . 20 1 1 A 64 64 ALA N N 64 131.410 128.776 2.634 1
1 771 . 20 1 1 A 65 65 TYR H H 65 8.860 8.540 0.320 1
1 772 . 20 1 1 A 65 65 TYR HA H 65 4.540 4.936 -0.396 1
1 779 . 20 1 1 A 65 65 TYR CA C 65 54.270 55.160 -0.890 1
1 780 . 20 1 1 A 65 65 TYR CB C 65 41.360 40.785 0.575 1
1 785 . 20 1 1 A 65 65 TYR N N 65 124.140 120.115 4.025 1
1 786 . 20 1 1 A 66 66 PRO HA H 66 4.120 4.737 -0.617 1
1 793 . 20 1 1 A 66 66 PRO CA C 66 63.450 62.361 1.089 1
1 794 . 20 1 1 A 66 66 PRO CB C 66 34.170 32.768 1.402 1
1 797 . 20 1 1 A 67 67 SER H H 67 7.380 8.239 -0.859 1
1 798 . 20 1 1 A 67 67 SER HA H 67 4.720 4.980 -0.260 1
1 801 . 20 1 1 A 67 67 SER CA C 67 54.250 56.057 -1.807 1
1 802 . 20 1 1 A 67 67 SER CB C 67 64.530 63.744 0.786 1
1 803 . 20 1 1 A 67 67 SER N N 67 106.200 116.671 -10.471 1
1 804 . 20 1 1 A 68 68 PRO HA H 68 4.880 4.628 0.252 1
1 811 . 20 1 1 A 68 68 PRO CA C 68 62.990 62.490 0.500 1
1 812 . 20 1 1 A 68 68 PRO CB C 68 35.220 33.196 2.024 1
1 815 . 20 1 1 A 69 69 LEU H H 69 8.960 8.000 0.960 1
1 816 . 20 1 1 A 69 69 LEU HA H 69 4.430 5.075 -0.645 1
1 826 . 20 1 1 A 69 69 LEU C C 69 174.570 175.293 -0.723 1
1 827 . 20 1 1 A 69 69 LEU CA C 69 53.900 52.667 1.233 1
1 828 . 20 1 1 A 69 69 LEU CB C 69 44.210 45.897 -1.687 1
1 832 . 20 1 1 A 69 69 LEU N N 69 120.480 117.106 3.374 1
1 833 . 20 1 1 A 70 70 ARG H H 70 8.130 8.373 -0.243 1
1 834 . 20 1 1 A 70 70 ARG HA H 70 4.930 4.775 0.155 1
1 841 . 20 1 1 A 70 70 ARG C C 70 175.460 176.240 -0.780 1
1 842 . 20 1 1 A 70 70 ARG CA C 70 54.040 55.686 -1.646 1
1 843 . 20 1 1 A 70 70 ARG CB C 70 30.550 31.597 -1.047 1
1 846 . 20 1 1 A 70 70 ARG N N 70 125.180 119.661 5.519 1
1 847 . 20 1 1 A 71 71 VAL H H 71 8.450 8.204 0.246 1
1 848 . 20 1 1 A 71 71 VAL HA H 71 3.410 4.465 -1.055 1
1 856 . 20 1 1 A 71 71 VAL C C 71 175.460 175.652 -0.192 1
1 857 . 20 1 1 A 71 71 VAL CA C 71 65.210 62.054 3.156 1
1 858 . 20 1 1 A 71 71 VAL CB C 71 29.840 32.146 -2.306 1
1 861 . 20 1 1 A 71 71 VAL N N 71 128.170 122.767 5.403 1
1 862 . 20 1 1 A 72 72 GLU H H 72 8.620 8.741 -0.121 1
1 863 . 20 1 1 A 72 72 GLU HA H 72 4.870 4.719 0.151 1
1 868 . 20 1 1 A 72 72 GLU C C 72 176.960 176.314 0.646 1
1 869 . 20 1 1 A 72 72 GLU CA C 72 54.330 54.248 0.082 1
1 870 . 20 1 1 A 72 72 GLU CB C 72 33.280 32.062 1.218 1
1 872 . 20 1 1 A 72 72 GLU N N 72 127.670 126.750 0.920 1
1 873 . 20 1 1 A 73 73 ASP H H 73 8.700 8.807 -0.107 1
1 874 . 20 1 1 A 73 73 ASP HA H 73 4.150 4.286 -0.136 1
1 877 . 20 1 1 A 73 73 ASP C C 73 177.460 178.089 -0.629 1
1 878 . 20 1 1 A 73 73 ASP CA C 73 57.620 56.632 0.988 1
1 879 . 20 1 1 A 73 73 ASP CB C 73 40.360 40.606 -0.246 1
1 880 . 20 1 1 A 73 73 ASP N N 73 121.140 122.212 -1.072 1
1 881 . 20 1 1 A 74 74 ARG H H 74 7.760 7.626 0.134 1
1 882 . 20 1 1 A 74 74 ARG HA H 74 4.280 4.337 -0.057 1
1 889 . 20 1 1 A 74 74 ARG C C 74 176.510 176.751 -0.241 1
1 890 . 20 1 1 A 74 74 ARG CA C 74 55.450 56.739 -1.289 1
1 891 . 20 1 1 A 74 74 ARG CB C 74 29.990 30.795 -0.805 1
1 894 . 20 1 1 A 74 74 ARG N N 74 112.890 116.795 -3.905 1
1 895 . 20 1 1 A 75 75 THR H H 75 7.700 7.572 0.128 1
1 896 . 20 1 1 A 75 75 THR HA H 75 4.020 4.402 -0.382 1
1 901 . 20 1 1 A 75 75 THR C C 75 173.810 173.844 -0.034 1
1 902 . 20 1 1 A 75 75 THR CA C 75 64.060 63.913 0.147 1
1 903 . 20 1 1 A 75 75 THR CB C 75 69.350 69.329 0.021 1
1 905 . 20 1 1 A 75 75 THR N N 75 120.650 116.330 4.320 1
1 906 . 20 1 1 A 76 76 LYS H H 76 8.520 8.292 0.228 1
1 907 . 20 1 1 A 76 76 LYS HA H 76 4.270 4.672 -0.402 1
1 916 . 20 1 1 A 76 76 LYS C C 76 174.560 175.788 -1.228 1
1 917 . 20 1 1 A 76 76 LYS CA C 76 56.280 55.945 0.335 1
1 918 . 20 1 1 A 76 76 LYS CB C 76 33.120 33.780 -0.660 1
1 922 . 20 1 1 A 76 76 LYS N N 76 130.950 127.336 3.614 1
1 923 . 20 1 1 A 77 77 ILE H H 77 8.430 8.552 -0.122 1
1 924 . 20 1 1 A 77 77 ILE HA H 77 4.850 5.190 -0.340 1
1 934 . 20 1 1 A 77 77 ILE C C 77 174.650 175.020 -0.370 1
1 935 . 20 1 1 A 77 77 ILE CA C 77 59.820 60.066 -0.246 1
1 936 . 20 1 1 A 77 77 ILE CB C 77 38.280 40.859 -2.579 1
1 940 . 20 1 1 A 77 77 ILE N N 77 128.020 122.936 5.084 1
1 941 . 20 1 1 A 78 78 THR H H 78 8.870 8.776 0.094 1
1 942 . 20 1 1 A 78 78 THR HA H 78 4.470 5.119 -0.649 1
1 947 . 20 1 1 A 78 78 THR C C 78 172.760 173.006 -0.246 1
1 948 . 20 1 1 A 78 78 THR CA C 78 60.740 61.295 -0.555 1
1 949 . 20 1 1 A 78 78 THR CB C 78 71.320 71.961 -0.641 1
1 951 . 20 1 1 A 78 78 THR N N 78 123.870 123.827 0.043 1
1 952 . 20 1 1 A 79 79 LEU H H 79 8.820 8.947 -0.127 1
1 953 . 20 1 1 A 79 79 LEU HA H 79 5.140 4.997 0.143 1
1 963 . 20 1 1 A 79 79 LEU C C 79 176.610 176.001 0.609 1
1 964 . 20 1 1 A 79 79 LEU CA C 79 53.280 53.355 -0.075 1
1 965 . 20 1 1 A 79 79 LEU CB C 79 42.600 42.567 0.033 1
1 969 . 20 1 1 A 79 79 LEU N N 79 127.070 126.434 0.636 1
1 970 . 20 1 1 A 80 80 VAL H H 80 8.800 8.565 0.235 1
1 971 . 20 1 1 A 80 80 VAL HA H 80 4.260 4.725 -0.465 1
1 979 . 20 1 1 A 80 80 VAL CA C 80 61.350 61.425 -0.075 1
1 980 . 20 1 1 A 80 80 VAL CB C 80 32.790 33.061 -0.271 1
1 983 . 20 1 1 A 80 80 VAL N N 80 124.120 125.078 -0.958 1
1 984 . 20 1 1 A 81 81 THR H H 81 8.160 8.777 -0.617 1
1 985 . 20 1 1 A 81 81 THR HA H 81 4.410 5.261 -0.851 1
1 990 . 20 1 1 A 81 81 THR CA C 81 60.800 59.998 0.802 1
1 991 . 20 1 1 A 81 81 THR CB C 81 69.650 72.519 -2.869 1
1 993 . 20 1 1 A 81 81 THR N N 81 114.500 116.780 -2.280 1
1 1 . 21 1 1 A 9 9 GLY H H 9 8.390 8.499 -0.109 1
1 2 . 21 1 1 A 9 9 GLY HA2 H 9 3.900 4.196 -0.296 1
1 3 . 21 1 1 A 9 9 GLY HA3 H 9 3.860 4.196 -0.336 1
1 4 . 21 1 1 A 9 9 GLY CA C 9 45.150 44.506 0.644 1
1 5 . 21 1 1 A 9 9 GLY N N 9 110.000 112.665 -2.665 1
1 6 . 21 1 1 A 10 10 VAL H H 10 7.870 8.645 -0.775 1
1 7 . 21 1 1 A 10 10 VAL HA H 10 4.040 4.503 -0.463 1
1 15 . 21 1 1 A 10 10 VAL C C 10 175.880 175.277 0.603 1
1 16 . 21 1 1 A 10 10 VAL CA C 10 62.110 62.585 -0.475 1
1 17 . 21 1 1 A 10 10 VAL CB C 10 32.760 32.546 0.214 1
1 20 . 21 1 1 A 10 10 VAL N N 10 119.730 122.571 -2.841 1
1 21 . 21 1 1 A 11 11 ILE H H 11 8.230 9.166 -0.936 1
1 22 . 21 1 1 A 11 11 ILE HA H 11 4.090 4.743 -0.653 1
1 32 . 21 1 1 A 11 11 ILE C C 11 175.850 174.679 1.171 1
1 33 . 21 1 1 A 11 11 ILE CA C 11 60.800 60.195 0.605 1
1 34 . 21 1 1 A 11 11 ILE CB C 11 38.470 40.149 -1.679 1
1 38 . 21 1 1 A 11 11 ILE N N 11 125.570 128.858 -3.288 1
1 39 . 21 1 1 A 12 12 MET H H 12 8.370 8.803 -0.433 1
1 40 . 21 1 1 A 12 12 MET HA H 12 4.540 4.938 -0.398 1
1 48 . 21 1 1 A 12 12 MET C C 12 174.830 175.686 -0.856 1
1 49 . 21 1 1 A 12 12 MET CA C 12 54.790 54.227 0.563 1
1 50 . 21 1 1 A 12 12 MET CB C 12 32.640 33.566 -0.926 1
1 53 . 21 1 1 A 12 12 MET N N 12 125.930 127.688 -1.758 1
1 54 . 21 1 1 A 13 13 SER H H 13 7.990 8.896 -0.906 1
1 55 . 21 1 1 A 13 13 SER HA H 13 5.030 5.634 -0.604 1
1 58 . 21 1 1 A 13 13 SER C C 13 174.330 173.730 0.600 1
1 59 . 21 1 1 A 13 13 SER CA C 13 57.320 56.017 1.303 1
1 60 . 21 1 1 A 13 13 SER CB C 13 64.790 66.229 -1.439 1
1 61 . 21 1 1 A 13 13 SER N N 13 116.400 117.609 -1.209 1
1 62 . 21 1 1 A 14 14 GLU H H 14 9.430 8.733 0.697 1
1 63 . 21 1 1 A 14 14 GLU HA H 14 5.250 5.367 -0.117 1
1 68 . 21 1 1 A 14 14 GLU C C 14 172.980 174.698 -1.718 1
1 69 . 21 1 1 A 14 14 GLU CA C 14 55.390 55.125 0.265 1
1 70 . 21 1 1 A 14 14 GLU CB C 14 33.910 34.304 -0.394 1
1 72 . 21 1 1 A 14 14 GLU N N 14 123.670 121.056 2.614 1
1 73 . 21 1 1 A 15 15 LEU H H 15 8.930 8.961 -0.031 1
1 74 . 21 1 1 A 15 15 LEU HA H 15 4.870 5.169 -0.299 1
1 84 . 21 1 1 A 15 15 LEU C C 15 174.000 174.554 -0.554 1
1 85 . 21 1 1 A 15 15 LEU CA C 15 53.020 53.484 -0.464 1
1 86 . 21 1 1 A 15 15 LEU CB C 15 46.040 45.735 0.305 1
1 90 . 21 1 1 A 15 15 LEU N N 15 125.350 125.663 -0.313 1
1 91 . 21 1 1 A 16 16 LYS H H 16 8.840 8.850 -0.010 1
1 92 . 21 1 1 A 16 16 LYS HA H 16 5.360 4.869 0.491 1
1 101 . 21 1 1 A 16 16 LYS C C 16 175.660 175.364 0.296 1
1 102 . 21 1 1 A 16 16 LYS CA C 16 54.940 55.633 -0.693 1
1 103 . 21 1 1 A 16 16 LYS CB C 16 34.280 33.354 0.926 1
1 107 . 21 1 1 A 16 16 LYS N N 16 124.640 126.680 -2.040 1
1 108 . 21 1 1 A 17 17 LEU H H 17 8.820 9.046 -0.226 1
1 109 . 21 1 1 A 17 17 LEU HA H 17 5.430 5.234 0.196 1
1 119 . 21 1 1 A 17 17 LEU C C 17 174.630 175.304 -0.674 1
1 120 . 21 1 1 A 17 17 LEU CA C 17 52.900 53.424 -0.524 1
1 121 . 21 1 1 A 17 17 LEU CB C 17 46.910 45.309 1.601 1
1 125 . 21 1 1 A 17 17 LEU N N 17 123.460 127.037 -3.577 1
1 126 . 21 1 1 A 18 18 LYS H H 18 9.110 8.789 0.321 1
1 127 . 21 1 1 A 18 18 LYS HA H 18 5.490 5.053 0.437 1
1 136 . 21 1 1 A 18 18 LYS CA C 18 52.270 52.800 -0.530 1
1 137 . 21 1 1 A 18 18 LYS CB C 18 37.500 36.173 1.327 1
1 141 . 21 1 1 A 18 18 LYS N N 18 122.230 123.732 -1.502 1
1 142 . 21 1 1 A 19 19 PRO HA H 19 4.100 4.347 -0.247 1
1 149 . 21 1 1 A 19 19 PRO CA C 19 62.440 62.476 -0.036 1
1 150 . 21 1 1 A 19 19 PRO CB C 19 30.640 31.973 -1.333 1
1 153 . 21 1 1 A 20 20 LEU H H 20 8.490 8.231 0.259 1
1 154 . 21 1 1 A 20 20 LEU HA H 20 4.320 4.096 0.224 1
1 164 . 21 1 1 A 20 20 LEU CA C 20 57.680 58.863 -1.183 1
1 165 . 21 1 1 A 20 20 LEU CB C 20 38.760 40.468 -1.708 1
1 169 . 21 1 1 A 20 20 LEU N N 20 123.250 119.760 3.490 1
1 170 . 21 1 1 A 21 21 PRO HA H 21 4.530 4.527 0.003 1
1 177 . 21 1 1 A 21 21 PRO CA C 21 62.880 62.615 0.265 1
1 178 . 21 1 1 A 21 21 PRO CB C 21 31.420 31.921 -0.501 1
1 181 . 21 1 1 A 22 22 LYS H H 22 8.180 8.408 -0.228 1
1 182 . 21 1 1 A 22 22 LYS HA H 22 4.110 4.501 -0.391 1
1 191 . 21 1 1 A 22 22 LYS C C 22 175.680 175.355 0.325 1
1 192 . 21 1 1 A 22 22 LYS CA C 22 56.210 55.768 0.442 1
1 193 . 21 1 1 A 22 22 LYS CB C 22 30.660 32.220 -1.560 1
1 197 . 21 1 1 A 22 22 LYS N N 22 119.160 121.654 -2.494 1
1 198 . 21 1 1 A 23 23 VAL H H 23 7.530 8.529 -0.999 1
1 199 . 21 1 1 A 23 23 VAL HA H 23 4.280 4.787 -0.507 1
1 207 . 21 1 1 A 23 23 VAL C C 23 173.690 173.178 0.512 1
1 208 . 21 1 1 A 23 23 VAL CA C 23 59.830 59.587 0.243 1
1 209 . 21 1 1 A 23 23 VAL CB C 23 34.550 35.514 -0.964 1
1 212 . 21 1 1 A 23 23 VAL N N 23 121.820 122.902 -1.082 1
1 213 . 21 1 1 A 24 24 GLU H H 24 8.270 8.954 -0.684 1
1 214 . 21 1 1 A 24 24 GLU HA H 24 4.330 5.037 -0.707 1
1 219 . 21 1 1 A 24 24 GLU C C 24 175.390 175.013 0.377 1
1 220 . 21 1 1 A 24 24 GLU CA C 24 55.220 54.695 0.525 1
1 221 . 21 1 1 A 24 24 GLU CB C 24 29.970 32.116 -2.146 1
1 223 . 21 1 1 A 24 24 GLU N N 24 125.610 128.116 -2.506 1
1 224 . 21 1 1 A 25 25 LEU H H 25 8.480 8.759 -0.279 1
1 225 . 21 1 1 A 25 25 LEU HA H 25 4.520 4.466 0.054 1
1 235 . 21 1 1 A 25 25 LEU CA C 25 51.660 52.160 -0.500 1
1 236 . 21 1 1 A 25 25 LEU CB C 25 41.750 40.762 0.988 1
1 240 . 21 1 1 A 25 25 LEU N N 25 125.880 129.012 -3.132 1
1 241 . 21 1 1 A 26 26 PRO HA H 26 4.760 4.612 0.148 1
1 248 . 21 1 1 A 26 26 PRO CA C 26 61.330 61.957 -0.627 1
1 249 . 21 1 1 A 26 26 PRO CB C 26 31.060 32.581 -1.521 1
1 252 . 21 1 1 A 27 27 PRO HA H 27 4.390 4.269 0.121 1
1 259 . 21 1 1 A 27 27 PRO CA C 27 64.550 65.316 -0.766 1
1 260 . 21 1 1 A 27 27 PRO CB C 27 31.770 31.830 -0.060 1
1 263 . 21 1 1 A 28 28 ASP H H 28 8.560 8.905 -0.345 1
1 264 . 21 1 1 A 28 28 ASP HA H 28 4.620 4.424 0.196 1
1 267 . 21 1 1 A 28 28 ASP C C 28 177.100 178.773 -1.673 1
1 268 . 21 1 1 A 28 28 ASP CA C 28 53.890 56.248 -2.358 1
1 269 . 21 1 1 A 28 28 ASP CB C 28 39.120 39.568 -0.448 1
1 270 . 21 1 1 A 28 28 ASP N N 28 115.820 117.241 -1.421 1
1 271 . 21 1 1 A 29 29 PHE H H 29 7.940 7.842 0.098 1
1 272 . 21 1 1 A 29 29 PHE HA H 29 4.180 4.321 -0.141 1
1 280 . 21 1 1 A 29 29 PHE C C 29 176.740 178.312 -1.572 1
1 281 . 21 1 1 A 29 29 PHE CA C 29 61.020 60.546 0.474 1
1 282 . 21 1 1 A 29 29 PHE CB C 29 39.230 39.170 0.060 1
1 288 . 21 1 1 A 29 29 PHE N N 29 119.610 118.541 1.069 1
1 289 . 21 1 1 A 30 30 VAL H H 30 8.010 8.548 -0.538 1
1 290 . 21 1 1 A 30 30 VAL HA H 30 3.350 3.630 -0.280 1
1 298 . 21 1 1 A 30 30 VAL C C 30 176.400 177.522 -1.122 1
1 299 . 21 1 1 A 30 30 VAL CA C 30 66.510 66.691 -0.181 1
1 300 . 21 1 1 A 30 30 VAL CB C 30 31.020 31.382 -0.362 1
1 303 . 21 1 1 A 30 30 VAL N N 30 116.370 119.263 -2.893 1
1 304 . 21 1 1 A 31 31 ASP H H 31 7.420 8.035 -0.615 1
1 305 . 21 1 1 A 31 31 ASP HA H 31 4.310 4.388 -0.078 1
1 308 . 21 1 1 A 31 31 ASP C C 31 178.360 178.825 -0.465 1
1 309 . 21 1 1 A 31 31 ASP CA C 31 57.110 57.387 -0.277 1
1 310 . 21 1 1 A 31 31 ASP CB C 31 40.450 40.584 -0.134 1
1 311 . 21 1 1 A 31 31 ASP N N 31 119.190 120.916 -1.726 1
1 312 . 21 1 1 A 32 32 VAL H H 32 7.190 7.612 -0.422 1
1 313 . 21 1 1 A 32 32 VAL HA H 32 3.510 3.525 -0.015 1
1 321 . 21 1 1 A 32 32 VAL C C 32 178.100 178.534 -0.434 1
1 322 . 21 1 1 A 32 32 VAL CA C 32 65.570 66.366 -0.796 1
1 323 . 21 1 1 A 32 32 VAL CB C 32 31.410 31.308 0.102 1
1 326 . 21 1 1 A 32 32 VAL N N 32 119.830 120.067 -0.237 1
1 327 . 21 1 1 A 33 33 ILE H H 33 7.660 8.579 -0.919 1
1 328 . 21 1 1 A 33 33 ILE HA H 33 3.170 3.530 -0.360 1
1 338 . 21 1 1 A 33 33 ILE C C 33 176.660 178.157 -1.497 1
1 339 . 21 1 1 A 33 33 ILE CA C 33 65.220 65.240 -0.020 1
1 340 . 21 1 1 A 33 33 ILE CB C 33 37.500 37.734 -0.234 1
1 344 . 21 1 1 A 33 33 ILE N N 33 118.490 120.848 -2.358 1
1 345 . 21 1 1 A 34 34 ARG H H 34 7.830 7.831 -0.001 1
1 346 . 21 1 1 A 34 34 ARG HA H 34 3.380 3.902 -0.522 1
1 354 . 21 1 1 A 34 34 ARG C C 34 178.060 177.621 0.439 1
1 355 . 21 1 1 A 34 34 ARG CA C 34 60.570 58.883 1.687 1
1 356 . 21 1 1 A 34 34 ARG CB C 34 30.070 29.759 0.311 1
1 359 . 21 1 1 A 34 34 ARG N N 34 118.260 119.941 -1.681 1
1 361 . 21 1 1 A 35 35 ILE H H 35 7.350 7.790 -0.440 1
1 362 . 21 1 1 A 35 35 ILE HA H 35 3.720 3.711 0.009 1
1 372 . 21 1 1 A 35 35 ILE C C 35 179.090 178.051 1.039 1
1 373 . 21 1 1 A 35 35 ILE CA C 35 64.060 65.331 -1.271 1
1 374 . 21 1 1 A 35 35 ILE CB C 35 38.030 37.592 0.438 1
1 378 . 21 1 1 A 35 35 ILE N N 35 116.750 119.562 -2.812 1
1 379 . 21 1 1 A 36 36 LYS H H 36 7.880 7.634 0.246 1
1 380 . 21 1 1 A 36 36 LYS HA H 36 4.090 3.955 0.135 1
1 389 . 21 1 1 A 36 36 LYS C C 36 178.560 178.902 -0.342 1
1 390 . 21 1 1 A 36 36 LYS CA C 36 57.650 59.783 -2.133 1
1 391 . 21 1 1 A 36 36 LYS CB C 36 32.090 32.160 -0.070 1
1 395 . 21 1 1 A 36 36 LYS N N 36 118.700 119.738 -1.038 1
1 396 . 21 1 1 A 37 37 LEU H H 37 7.860 7.472 0.388 1
1 397 . 21 1 1 A 37 37 LEU HA H 37 4.230 4.294 -0.064 1
1 407 . 21 1 1 A 37 37 LEU C C 37 175.880 176.776 -0.896 1
1 408 . 21 1 1 A 37 37 LEU CA C 37 54.090 55.683 -1.593 1
1 409 . 21 1 1 A 37 37 LEU CB C 37 43.310 42.472 0.838 1
1 413 . 21 1 1 A 37 37 LEU N N 37 116.380 117.307 -0.927 1
1 414 . 21 1 1 A 38 38 GLN H H 38 7.190 7.627 -0.437 1
1 415 . 21 1 1 A 38 38 GLN HA H 38 3.530 4.426 -0.896 1
1 422 . 21 1 1 A 38 38 GLN C C 38 177.480 176.256 1.224 1
1 423 . 21 1 1 A 38 38 GLN CA C 38 58.370 56.665 1.705 1
1 424 . 21 1 1 A 38 38 GLN CB C 38 28.300 28.855 -0.555 1
1 426 . 21 1 1 A 38 38 GLN N N 38 119.210 117.661 1.549 1
1 428 . 21 1 1 A 39 39 GLY H H 39 8.940 8.848 0.092 1
1 429 . 21 1 1 A 39 39 GLY HA2 H 39 3.540 3.989 -0.449 1
1 430 . 21 1 1 A 39 39 GLY HA3 H 39 4.220 3.990 0.230 1
1 431 . 21 1 1 A 39 39 GLY C C 39 174.070 174.459 -0.389 1
1 432 . 21 1 1 A 39 39 GLY CA C 39 45.280 45.062 0.218 1
1 433 . 21 1 1 A 39 39 GLY N N 39 113.490 112.131 1.359 1
1 434 . 21 1 1 A 40 40 LYS H H 40 8.350 7.550 0.800 1
1 435 . 21 1 1 A 40 40 LYS HA H 40 4.400 4.598 -0.198 1
1 444 . 21 1 1 A 40 40 LYS C C 40 175.560 175.846 -0.286 1
1 445 . 21 1 1 A 40 40 LYS CA C 40 55.660 54.646 1.014 1
1 446 . 21 1 1 A 40 40 LYS CB C 40 32.870 33.742 -0.872 1
1 450 . 21 1 1 A 40 40 LYS N N 40 122.060 119.985 2.075 1
1 451 . 21 1 1 A 41 41 THR H H 41 8.410 8.534 -0.124 1
1 452 . 21 1 1 A 41 41 THR HA H 41 5.330 5.046 0.284 1
1 457 . 21 1 1 A 41 41 THR C C 41 174.860 174.338 0.522 1
1 458 . 21 1 1 A 41 41 THR CA C 41 62.040 61.675 0.365 1
1 459 . 21 1 1 A 41 41 THR CB C 41 69.420 70.878 -1.458 1
1 461 . 21 1 1 A 41 41 THR N N 41 118.150 117.196 0.954 1
1 462 . 21 1 1 A 42 42 VAL H H 42 9.140 9.096 0.044 1
1 463 . 21 1 1 A 42 42 VAL HA H 42 4.570 5.081 -0.511 1
1 471 . 21 1 1 A 42 42 VAL C C 42 172.970 174.345 -1.375 1
1 472 . 21 1 1 A 42 42 VAL CA C 42 59.450 58.941 0.509 1
1 473 . 21 1 1 A 42 42 VAL CB C 42 35.880 35.673 0.207 1
1 476 . 21 1 1 A 42 42 VAL N N 42 122.510 119.465 3.045 1
1 477 . 21 1 1 A 43 43 ARG H H 43 8.420 8.645 -0.225 1
1 478 . 21 1 1 A 43 43 ARG HA H 43 4.750 4.870 -0.120 1
1 485 . 21 1 1 A 43 43 ARG C C 43 175.650 175.796 -0.146 1
1 486 . 21 1 1 A 43 43 ARG CA C 43 53.650 53.836 -0.186 1
1 487 . 21 1 1 A 43 43 ARG CB C 43 33.870 34.112 -0.242 1
1 490 . 21 1 1 A 43 43 ARG N N 43 120.640 122.524 -1.884 1
1 491 . 21 1 1 A 44 44 THR H H 44 8.370 8.563 -0.193 1
1 492 . 21 1 1 A 44 44 THR HA H 44 3.410 3.766 -0.356 1
1 497 . 21 1 1 A 44 44 THR C C 44 175.020 175.814 -0.794 1
1 498 . 21 1 1 A 44 44 THR CA C 44 65.660 65.021 0.639 1
1 499 . 21 1 1 A 44 44 THR CB C 44 69.400 68.333 1.067 1
1 501 . 21 1 1 A 44 44 THR N N 44 118.590 117.564 1.026 1
1 502 . 21 1 1 A 45 45 GLY H H 45 9.090 8.746 0.344 1
1 503 . 21 1 1 A 45 45 GLY HA2 H 45 3.470 4.017 -0.547 1
1 504 . 21 1 1 A 45 45 GLY HA3 H 45 4.470 4.022 0.448 1
1 505 . 21 1 1 A 45 45 GLY C C 45 174.350 173.845 0.505 1
1 506 . 21 1 1 A 45 45 GLY CA C 45 45.000 44.946 0.054 1
1 507 . 21 1 1 A 45 45 GLY N N 45 117.350 114.977 2.373 1
1 508 . 21 1 1 A 46 46 ASP H H 46 8.010 7.904 0.106 1
1 509 . 21 1 1 A 46 46 ASP HA H 46 4.470 4.627 -0.157 1
1 512 . 21 1 1 A 46 46 ASP C C 46 174.570 174.390 0.180 1
1 513 . 21 1 1 A 46 46 ASP CA C 46 55.570 55.423 0.147 1
1 514 . 21 1 1 A 46 46 ASP CB C 46 41.680 41.581 0.099 1
1 515 . 21 1 1 A 46 46 ASP N N 46 122.240 122.228 0.012 1
1 516 . 21 1 1 A 47 47 VAL H H 47 8.330 8.374 -0.044 1
1 517 . 21 1 1 A 47 47 VAL HA H 47 4.950 4.931 0.019 1
1 525 . 21 1 1 A 47 47 VAL C C 47 176.330 175.610 0.720 1
1 526 . 21 1 1 A 47 47 VAL CA C 47 61.710 61.049 0.661 1
1 527 . 21 1 1 A 47 47 VAL CB C 47 32.900 35.134 -2.234 1
1 530 . 21 1 1 A 47 47 VAL N N 47 119.860 121.588 -1.728 1
1 531 . 21 1 1 A 48 48 ILE H H 48 9.160 8.727 0.433 1
1 532 . 21 1 1 A 48 48 ILE HA H 48 4.630 5.178 -0.548 1
1 542 . 21 1 1 A 48 48 ILE C C 48 174.400 174.404 -0.004 1
1 543 . 21 1 1 A 48 48 ILE CA C 48 58.990 59.307 -0.317 1
1 544 . 21 1 1 A 48 48 ILE CB C 48 41.810 42.194 -0.384 1
1 548 . 21 1 1 A 48 48 ILE N N 48 124.990 121.537 3.453 1
1 549 . 21 1 1 A 49 49 GLY H H 49 8.660 8.911 -0.251 1
1 550 . 21 1 1 A 49 49 GLY HA2 H 49 4.950 4.313 0.637 1
1 551 . 21 1 1 A 49 49 GLY HA3 H 49 3.620 4.354 -0.734 1
1 552 . 21 1 1 A 49 49 GLY C C 49 172.920 172.142 0.778 1
1 553 . 21 1 1 A 49 49 GLY CA C 49 44.580 44.460 0.120 1
1 554 . 21 1 1 A 49 49 GLY N N 49 112.060 109.315 2.745 1
1 555 . 21 1 1 A 50 50 ILE H H 50 8.810 9.031 -0.221 1
1 556 . 21 1 1 A 50 50 ILE HA H 50 4.370 4.812 -0.442 1
1 566 . 21 1 1 A 50 50 ILE C C 50 174.500 174.725 -0.225 1
1 567 . 21 1 1 A 50 50 ILE CA C 50 59.550 59.670 -0.120 1
1 568 . 21 1 1 A 50 50 ILE CB C 50 41.300 42.087 -0.787 1
1 572 . 21 1 1 A 50 50 ILE N N 50 123.220 125.261 -2.041 1
1 573 . 21 1 1 A 51 51 SER H H 51 8.540 8.817 -0.277 1
1 574 . 21 1 1 A 51 51 SER HA H 51 4.830 4.989 -0.159 1
1 577 . 21 1 1 A 51 51 SER C C 51 174.130 173.879 0.251 1
1 578 . 21 1 1 A 51 51 SER CA C 51 57.770 57.101 0.669 1
1 579 . 21 1 1 A 51 51 SER CB C 51 63.040 64.115 -1.075 1
1 580 . 21 1 1 A 51 51 SER N N 51 121.430 122.501 -1.071 1
1 581 . 21 1 1 A 52 52 ILE H H 52 8.930 8.777 0.153 1
1 582 . 21 1 1 A 52 52 ILE HA H 52 4.290 4.658 -0.368 1
1 592 . 21 1 1 A 52 52 ILE C C 52 175.280 176.379 -1.099 1
1 593 . 21 1 1 A 52 52 ILE CA C 52 60.250 60.375 -0.125 1
1 594 . 21 1 1 A 52 52 ILE CB C 52 39.840 40.396 -0.556 1
1 598 . 21 1 1 A 52 52 ILE N N 52 127.060 128.197 -1.137 1
1 599 . 21 1 1 A 53 53 LEU H H 53 9.380 9.421 -0.041 1
1 600 . 21 1 1 A 53 53 LEU HA H 53 3.890 4.007 -0.117 1
1 610 . 21 1 1 A 53 53 LEU C C 53 177.130 176.005 1.125 1
1 611 . 21 1 1 A 53 53 LEU CA C 53 55.560 55.984 -0.424 1
1 612 . 21 1 1 A 53 53 LEU CB C 53 39.370 41.096 -1.726 1
1 616 . 21 1 1 A 53 53 LEU N N 53 126.770 128.499 -1.729 1
1 617 . 21 1 1 A 54 54 GLY H H 54 8.310 8.700 -0.390 1
1 618 . 21 1 1 A 54 54 GLY HA2 H 54 3.490 3.897 -0.407 1
1 619 . 21 1 1 A 54 54 GLY HA3 H 54 4.080 3.897 0.183 1
1 620 . 21 1 1 A 54 54 GLY C C 54 173.690 173.844 -0.154 1
1 621 . 21 1 1 A 54 54 GLY CA C 54 45.340 45.695 -0.355 1
1 622 . 21 1 1 A 54 54 GLY N N 54 103.820 105.033 -1.213 1
1 623 . 21 1 1 A 55 55 LYS H H 55 7.730 7.678 0.052 1
1 624 . 21 1 1 A 55 55 LYS HA H 55 4.560 4.949 -0.389 1
1 633 . 21 1 1 A 55 55 LYS C C 55 174.550 174.800 -0.250 1
1 634 . 21 1 1 A 55 55 LYS CA C 55 54.140 55.076 -0.936 1
1 635 . 21 1 1 A 55 55 LYS CB C 55 34.620 35.912 -1.292 1
1 639 . 21 1 1 A 55 55 LYS N N 55 121.160 119.695 1.465 1
1 640 . 21 1 1 A 56 56 GLU H H 56 8.490 8.669 -0.179 1
1 641 . 21 1 1 A 56 56 GLU HA H 56 4.280 4.731 -0.451 1
1 646 . 21 1 1 A 56 56 GLU C C 56 175.730 175.181 0.549 1
1 647 . 21 1 1 A 56 56 GLU CA C 56 56.730 56.381 0.349 1
1 648 . 21 1 1 A 56 56 GLU CB C 56 30.070 30.627 -0.557 1
1 650 . 21 1 1 A 56 56 GLU N N 56 124.090 128.004 -3.914 1
1 651 . 21 1 1 A 57 57 VAL H H 57 8.920 8.586 0.334 1
1 652 . 21 1 1 A 57 57 VAL HA H 57 4.030 4.797 -0.767 1
1 660 . 21 1 1 A 57 57 VAL C C 57 174.610 173.789 0.821 1
1 661 . 21 1 1 A 57 57 VAL CA C 57 61.680 59.383 2.297 1
1 662 . 21 1 1 A 57 57 VAL CB C 57 33.880 34.537 -0.657 1
1 665 . 21 1 1 A 57 57 VAL N N 57 129.960 126.720 3.240 1
1 666 . 21 1 1 A 58 58 LYS H H 58 7.860 8.703 -0.843 1
1 667 . 21 1 1 A 58 58 LYS HA H 58 5.120 4.828 0.292 1
1 676 . 21 1 1 A 58 58 LYS C C 58 175.380 175.666 -0.286 1
1 677 . 21 1 1 A 58 58 LYS CA C 58 55.200 54.826 0.374 1
1 678 . 21 1 1 A 58 58 LYS CB C 58 34.670 34.282 0.388 1
1 682 . 21 1 1 A 58 58 LYS N N 58 124.790 127.359 -2.569 1
1 683 . 21 1 1 A 59 59 PHE H H 59 9.270 9.126 0.144 1
1 684 . 21 1 1 A 59 59 PHE HA H 59 4.960 5.144 -0.184 1
1 692 . 21 1 1 A 59 59 PHE C C 59 173.950 174.270 -0.320 1
1 693 . 21 1 1 A 59 59 PHE CA C 59 55.910 56.250 -0.340 1
1 694 . 21 1 1 A 59 59 PHE CB C 59 42.950 42.229 0.721 1
1 700 . 21 1 1 A 59 59 PHE N N 59 118.270 122.601 -4.331 1
1 701 . 21 1 1 A 60 60 LYS H H 60 9.170 8.880 0.290 1
1 702 . 21 1 1 A 60 60 LYS HA H 60 4.910 4.986 -0.076 1
1 711 . 21 1 1 A 60 60 LYS C C 60 176.230 175.976 0.254 1
1 712 . 21 1 1 A 60 60 LYS CA C 60 53.910 54.523 -0.613 1
1 713 . 21 1 1 A 60 60 LYS CB C 60 35.170 34.981 0.189 1
1 717 . 21 1 1 A 60 60 LYS N N 60 121.960 124.320 -2.360 1
1 718 . 21 1 1 A 61 61 VAL H H 61 9.400 8.800 0.600 1
1 719 . 21 1 1 A 61 61 VAL HA H 61 4.170 4.064 0.106 1
1 727 . 21 1 1 A 61 61 VAL C C 61 175.500 175.380 0.120 1
1 728 . 21 1 1 A 61 61 VAL CA C 61 61.980 63.243 -1.263 1
1 729 . 21 1 1 A 61 61 VAL CB C 61 29.490 31.225 -1.735 1
1 732 . 21 1 1 A 61 61 VAL N N 61 127.140 127.032 0.108 1
1 733 . 21 1 1 A 62 62 VAL H H 62 8.390 8.861 -0.471 1
1 734 . 21 1 1 A 62 62 VAL HA H 62 3.650 3.983 -0.333 1
1 742 . 21 1 1 A 62 62 VAL C C 62 176.440 176.137 0.303 1
1 743 . 21 1 1 A 62 62 VAL CA C 62 64.930 64.558 0.372 1
1 744 . 21 1 1 A 62 62 VAL CB C 62 32.130 32.432 -0.302 1
1 747 . 21 1 1 A 62 62 VAL N N 62 132.840 129.316 3.524 1
1 748 . 21 1 1 A 63 63 GLN H H 63 7.470 7.302 0.168 1
1 749 . 21 1 1 A 63 63 GLN HA H 63 4.270 4.694 -0.424 1
1 756 . 21 1 1 A 63 63 GLN C C 63 172.290 173.257 -0.967 1
1 757 . 21 1 1 A 63 63 GLN CA C 63 56.640 54.804 1.836 1
1 758 . 21 1 1 A 63 63 GLN CB C 63 32.630 32.700 -0.070 1
1 760 . 21 1 1 A 63 63 GLN N N 63 114.500 119.040 -4.540 1
1 762 . 21 1 1 A 64 64 ALA H H 64 8.200 8.811 -0.611 1
1 763 . 21 1 1 A 64 64 ALA HA H 64 4.830 5.399 -0.569 1
1 767 . 21 1 1 A 64 64 ALA C C 64 174.270 175.511 -1.241 1
1 768 . 21 1 1 A 64 64 ALA CA C 64 50.800 49.985 0.815 1
1 769 . 21 1 1 A 64 64 ALA CB C 64 20.100 21.556 -1.456 1
1 770 . 21 1 1 A 64 64 ALA N N 64 131.410 125.370 6.040 1
1 771 . 21 1 1 A 65 65 TYR H H 65 8.860 8.504 0.356 1
1 772 . 21 1 1 A 65 65 TYR HA H 65 4.540 4.921 -0.381 1
1 779 . 21 1 1 A 65 65 TYR CA C 65 54.270 55.163 -0.893 1
1 780 . 21 1 1 A 65 65 TYR CB C 65 41.360 40.911 0.449 1
1 785 . 21 1 1 A 65 65 TYR N N 65 124.140 120.170 3.970 1
1 786 . 21 1 1 A 66 66 PRO HA H 66 4.120 4.691 -0.571 1
1 793 . 21 1 1 A 66 66 PRO CA C 66 63.450 62.341 1.109 1
1 794 . 21 1 1 A 66 66 PRO CB C 66 34.170 32.726 1.444 1
1 797 . 21 1 1 A 67 67 SER H H 67 7.380 8.208 -0.828 1
1 798 . 21 1 1 A 67 67 SER HA H 67 4.720 4.971 -0.251 1
1 801 . 21 1 1 A 67 67 SER CA C 67 54.250 56.044 -1.794 1
1 802 . 21 1 1 A 67 67 SER CB C 67 64.530 63.804 0.726 1
1 803 . 21 1 1 A 67 67 SER N N 67 106.200 116.655 -10.455 1
1 804 . 21 1 1 A 68 68 PRO HA H 68 4.880 4.662 0.218 1
1 811 . 21 1 1 A 68 68 PRO CA C 68 62.990 62.465 0.525 1
1 812 . 21 1 1 A 68 68 PRO CB C 68 35.220 33.193 2.027 1
1 815 . 21 1 1 A 69 69 LEU H H 69 8.960 7.904 1.056 1
1 816 . 21 1 1 A 69 69 LEU HA H 69 4.430 5.114 -0.684 1
1 826 . 21 1 1 A 69 69 LEU C C 69 174.570 175.134 -0.564 1
1 827 . 21 1 1 A 69 69 LEU CA C 69 53.900 52.589 1.311 1
1 828 . 21 1 1 A 69 69 LEU CB C 69 44.210 46.119 -1.909 1
1 832 . 21 1 1 A 69 69 LEU N N 69 120.480 117.166 3.314 1
1 833 . 21 1 1 A 70 70 ARG H H 70 8.130 8.372 -0.242 1
1 834 . 21 1 1 A 70 70 ARG HA H 70 4.930 4.855 0.075 1
1 841 . 21 1 1 A 70 70 ARG C C 70 175.460 176.165 -0.705 1
1 842 . 21 1 1 A 70 70 ARG CA C 70 54.040 55.292 -1.252 1
1 843 . 21 1 1 A 70 70 ARG CB C 70 30.550 31.956 -1.406 1
1 846 . 21 1 1 A 70 70 ARG N N 70 125.180 119.655 5.525 1
1 847 . 21 1 1 A 71 71 VAL H H 71 8.450 8.192 0.258 1
1 848 . 21 1 1 A 71 71 VAL HA H 71 3.410 4.421 -1.011 1
1 856 . 21 1 1 A 71 71 VAL C C 71 175.460 175.709 -0.249 1
1 857 . 21 1 1 A 71 71 VAL CA C 71 65.210 62.074 3.136 1
1 858 . 21 1 1 A 71 71 VAL CB C 71 29.840 32.045 -2.205 1
1 861 . 21 1 1 A 71 71 VAL N N 71 128.170 122.502 5.668 1
1 862 . 21 1 1 A 72 72 GLU H H 72 8.620 8.680 -0.060 1
1 863 . 21 1 1 A 72 72 GLU HA H 72 4.870 4.714 0.156 1
1 868 . 21 1 1 A 72 72 GLU C C 72 176.960 176.443 0.517 1
1 869 . 21 1 1 A 72 72 GLU CA C 72 54.330 54.154 0.176 1
1 870 . 21 1 1 A 72 72 GLU CB C 72 33.280 32.127 1.153 1
1 872 . 21 1 1 A 72 72 GLU N N 72 127.670 126.840 0.830 1
1 873 . 21 1 1 A 73 73 ASP H H 73 8.700 8.756 -0.056 1
1 874 . 21 1 1 A 73 73 ASP HA H 73 4.150 4.301 -0.151 1
1 877 . 21 1 1 A 73 73 ASP C C 73 177.460 177.700 -0.240 1
1 878 . 21 1 1 A 73 73 ASP CA C 73 57.620 57.300 0.320 1
1 879 . 21 1 1 A 73 73 ASP CB C 73 40.360 40.413 -0.053 1
1 880 . 21 1 1 A 73 73 ASP N N 73 121.140 123.054 -1.914 1
1 881 . 21 1 1 A 74 74 ARG H H 74 7.760 8.187 -0.427 1
1 882 . 21 1 1 A 74 74 ARG HA H 74 4.280 4.272 0.008 1
1 889 . 21 1 1 A 74 74 ARG C C 74 176.510 176.389 0.121 1
1 890 . 21 1 1 A 74 74 ARG CA C 74 55.450 57.422 -1.972 1
1 891 . 21 1 1 A 74 74 ARG CB C 74 29.990 30.008 -0.018 1
1 894 . 21 1 1 A 74 74 ARG N N 74 112.890 115.861 -2.971 1
1 895 . 21 1 1 A 75 75 THR H H 75 7.700 7.620 0.080 1
1 896 . 21 1 1 A 75 75 THR HA H 75 4.020 4.416 -0.396 1
1 901 . 21 1 1 A 75 75 THR C C 75 173.810 173.890 -0.080 1
1 902 . 21 1 1 A 75 75 THR CA C 75 64.060 63.581 0.479 1
1 903 . 21 1 1 A 75 75 THR CB C 75 69.350 69.439 -0.089 1
1 905 . 21 1 1 A 75 75 THR N N 75 120.650 116.167 4.483 1
1 906 . 21 1 1 A 76 76 LYS H H 76 8.520 8.400 0.120 1
1 907 . 21 1 1 A 76 76 LYS HA H 76 4.270 4.675 -0.405 1
1 916 . 21 1 1 A 76 76 LYS C C 76 174.560 175.758 -1.198 1
1 917 . 21 1 1 A 76 76 LYS CA C 76 56.280 55.954 0.326 1
1 918 . 21 1 1 A 76 76 LYS CB C 76 33.120 33.711 -0.591 1
1 922 . 21 1 1 A 76 76 LYS N N 76 130.950 127.177 3.773 1
1 923 . 21 1 1 A 77 77 ILE H H 77 8.430 8.596 -0.166 1
1 924 . 21 1 1 A 77 77 ILE HA H 77 4.850 5.184 -0.334 1
1 934 . 21 1 1 A 77 77 ILE C C 77 174.650 174.927 -0.277 1
1 935 . 21 1 1 A 77 77 ILE CA C 77 59.820 60.093 -0.273 1
1 936 . 21 1 1 A 77 77 ILE CB C 77 38.280 40.887 -2.607 1
1 940 . 21 1 1 A 77 77 ILE N N 77 128.020 122.677 5.343 1
1 941 . 21 1 1 A 78 78 THR H H 78 8.870 8.782 0.088 1
1 942 . 21 1 1 A 78 78 THR HA H 78 4.470 5.110 -0.640 1
1 947 . 21 1 1 A 78 78 THR C C 78 172.760 173.492 -0.732 1
1 948 . 21 1 1 A 78 78 THR CA C 78 60.740 61.346 -0.606 1
1 949 . 21 1 1 A 78 78 THR CB C 78 71.320 71.458 -0.138 1
1 951 . 21 1 1 A 78 78 THR N N 78 123.870 124.112 -0.242 1
1 952 . 21 1 1 A 79 79 LEU H H 79 8.820 8.967 -0.147 1
1 953 . 21 1 1 A 79 79 LEU HA H 79 5.140 5.074 0.066 1
1 963 . 21 1 1 A 79 79 LEU C C 79 176.610 175.786 0.824 1
1 964 . 21 1 1 A 79 79 LEU CA C 79 53.280 53.373 -0.093 1
1 965 . 21 1 1 A 79 79 LEU CB C 79 42.600 42.792 -0.192 1
1 969 . 21 1 1 A 79 79 LEU N N 79 127.070 126.582 0.488 1
1 970 . 21 1 1 A 80 80 VAL H H 80 8.800 9.038 -0.238 1
1 971 . 21 1 1 A 80 80 VAL HA H 80 4.260 4.562 -0.302 1
1 979 . 21 1 1 A 80 80 VAL CA C 80 61.350 61.634 -0.284 1
1 980 . 21 1 1 A 80 80 VAL CB C 80 32.790 32.667 0.123 1
1 983 . 21 1 1 A 80 80 VAL N N 80 124.120 126.290 -2.170 1
1 984 . 21 1 1 A 81 81 THR H H 81 8.160 8.887 -0.727 1
1 985 . 21 1 1 A 81 81 THR HA H 81 4.410 4.786 -0.376 1
1 990 . 21 1 1 A 81 81 THR CA C 81 60.800 60.642 0.158 1
1 991 . 21 1 1 A 81 81 THR CB C 81 69.650 69.046 0.604 1
1 993 . 21 1 1 A 81 81 THR N N 81 114.500 115.641 -1.141 1
1 1 . 22 1 1 A 9 9 GLY H H 9 8.390 8.358 0.032 1
1 2 . 22 1 1 A 9 9 GLY HA2 H 9 3.900 4.059 -0.159 1
1 3 . 22 1 1 A 9 9 GLY HA3 H 9 3.860 4.060 -0.200 1
1 4 . 22 1 1 A 9 9 GLY CA C 9 45.150 44.446 0.704 1
1 5 . 22 1 1 A 9 9 GLY N N 9 110.000 108.414 1.586 1
1 6 . 22 1 1 A 10 10 VAL H H 10 7.870 8.474 -0.604 1
1 7 . 22 1 1 A 10 10 VAL HA H 10 4.040 4.724 -0.684 1
1 15 . 22 1 1 A 10 10 VAL C C 10 175.880 174.538 1.342 1
1 16 . 22 1 1 A 10 10 VAL CA C 10 62.110 60.714 1.396 1
1 17 . 22 1 1 A 10 10 VAL CB C 10 32.760 35.906 -3.146 1
1 20 . 22 1 1 A 10 10 VAL N N 10 119.730 119.728 0.002 1
1 21 . 22 1 1 A 11 11 ILE H H 11 8.230 8.763 -0.533 1
1 22 . 22 1 1 A 11 11 ILE HA H 11 4.090 5.059 -0.969 1
1 32 . 22 1 1 A 11 11 ILE C C 11 175.850 174.923 0.927 1
1 33 . 22 1 1 A 11 11 ILE CA C 11 60.800 59.877 0.923 1
1 34 . 22 1 1 A 11 11 ILE CB C 11 38.470 40.999 -2.529 1
1 38 . 22 1 1 A 11 11 ILE N N 11 125.570 126.442 -0.872 1
1 39 . 22 1 1 A 12 12 MET H H 12 8.370 9.040 -0.670 1
1 40 . 22 1 1 A 12 12 MET HA H 12 4.540 5.385 -0.845 1
1 48 . 22 1 1 A 12 12 MET C C 12 174.830 175.259 -0.429 1
1 49 . 22 1 1 A 12 12 MET CA C 12 54.790 53.701 1.089 1
1 50 . 22 1 1 A 12 12 MET CB C 12 32.640 35.211 -2.571 1
1 53 . 22 1 1 A 12 12 MET N N 12 125.930 123.597 2.333 1
1 54 . 22 1 1 A 13 13 SER H H 13 7.990 8.963 -0.973 1
1 55 . 22 1 1 A 13 13 SER HA H 13 5.030 5.365 -0.335 1
1 58 . 22 1 1 A 13 13 SER C C 13 174.330 173.356 0.974 1
1 59 . 22 1 1 A 13 13 SER CA C 13 57.320 56.177 1.143 1
1 60 . 22 1 1 A 13 13 SER CB C 13 64.790 66.464 -1.674 1
1 61 . 22 1 1 A 13 13 SER N N 13 116.400 116.718 -0.318 1
1 62 . 22 1 1 A 14 14 GLU H H 14 9.430 8.737 0.693 1
1 63 . 22 1 1 A 14 14 GLU HA H 14 5.250 5.339 -0.089 1
1 68 . 22 1 1 A 14 14 GLU C C 14 172.980 174.868 -1.888 1
1 69 . 22 1 1 A 14 14 GLU CA C 14 55.390 55.212 0.178 1
1 70 . 22 1 1 A 14 14 GLU CB C 14 33.910 34.642 -0.732 1
1 72 . 22 1 1 A 14 14 GLU N N 14 123.670 119.814 3.856 1
1 73 . 22 1 1 A 15 15 LEU H H 15 8.930 8.725 0.205 1
1 74 . 22 1 1 A 15 15 LEU HA H 15 4.870 5.075 -0.205 1
1 84 . 22 1 1 A 15 15 LEU C C 15 174.000 174.283 -0.283 1
1 85 . 22 1 1 A 15 15 LEU CA C 15 53.020 53.990 -0.970 1
1 86 . 22 1 1 A 15 15 LEU CB C 15 46.040 46.099 -0.059 1
1 90 . 22 1 1 A 15 15 LEU N N 15 125.350 125.154 0.196 1
1 91 . 22 1 1 A 16 16 LYS H H 16 8.840 8.772 0.068 1
1 92 . 22 1 1 A 16 16 LYS HA H 16 5.360 4.893 0.467 1
1 101 . 22 1 1 A 16 16 LYS C C 16 175.660 175.346 0.314 1
1 102 . 22 1 1 A 16 16 LYS CA C 16 54.940 55.672 -0.732 1
1 103 . 22 1 1 A 16 16 LYS CB C 16 34.280 33.485 0.795 1
1 107 . 22 1 1 A 16 16 LYS N N 16 124.640 126.852 -2.212 1
1 108 . 22 1 1 A 17 17 LEU H H 17 8.820 9.006 -0.186 1
1 109 . 22 1 1 A 17 17 LEU HA H 17 5.430 5.210 0.220 1
1 119 . 22 1 1 A 17 17 LEU C C 17 174.630 175.339 -0.709 1
1 120 . 22 1 1 A 17 17 LEU CA C 17 52.900 53.411 -0.511 1
1 121 . 22 1 1 A 17 17 LEU CB C 17 46.910 45.327 1.583 1
1 125 . 22 1 1 A 17 17 LEU N N 17 123.460 127.120 -3.660 1
1 126 . 22 1 1 A 18 18 LYS H H 18 9.110 8.834 0.276 1
1 127 . 22 1 1 A 18 18 LYS HA H 18 5.490 5.052 0.438 1
1 136 . 22 1 1 A 18 18 LYS CA C 18 52.270 52.801 -0.531 1
1 137 . 22 1 1 A 18 18 LYS CB C 18 37.500 36.141 1.359 1
1 141 . 22 1 1 A 18 18 LYS N N 18 122.230 123.733 -1.503 1
1 142 . 22 1 1 A 19 19 PRO HA H 19 4.100 4.379 -0.279 1
1 149 . 22 1 1 A 19 19 PRO CA C 19 62.440 62.268 0.172 1
1 150 . 22 1 1 A 19 19 PRO CB C 19 30.640 32.258 -1.618 1
1 153 . 22 1 1 A 20 20 LEU H H 20 8.490 8.366 0.124 1
1 154 . 22 1 1 A 20 20 LEU HA H 20 4.320 4.231 0.089 1
1 164 . 22 1 1 A 20 20 LEU CA C 20 57.680 58.712 -1.032 1
1 165 . 22 1 1 A 20 20 LEU CB C 20 38.760 40.876 -2.116 1
1 169 . 22 1 1 A 20 20 LEU N N 20 123.250 119.580 3.670 1
1 170 . 22 1 1 A 21 21 PRO HA H 21 4.530 4.546 -0.016 1
1 177 . 22 1 1 A 21 21 PRO CA C 21 62.880 62.378 0.502 1
1 178 . 22 1 1 A 21 21 PRO CB C 21 31.420 32.213 -0.793 1
1 181 . 22 1 1 A 22 22 LYS H H 22 8.180 8.447 -0.267 1
1 182 . 22 1 1 A 22 22 LYS HA H 22 4.110 4.459 -0.349 1
1 191 . 22 1 1 A 22 22 LYS C C 22 175.680 175.448 0.232 1
1 192 . 22 1 1 A 22 22 LYS CA C 22 56.210 55.737 0.473 1
1 193 . 22 1 1 A 22 22 LYS CB C 22 30.660 32.405 -1.745 1
1 197 . 22 1 1 A 22 22 LYS N N 22 119.160 121.942 -2.782 1
1 198 . 22 1 1 A 23 23 VAL H H 23 7.530 8.526 -0.996 1
1 199 . 22 1 1 A 23 23 VAL HA H 23 4.280 4.766 -0.486 1
1 207 . 22 1 1 A 23 23 VAL C C 23 173.690 173.109 0.581 1
1 208 . 22 1 1 A 23 23 VAL CA C 23 59.830 59.574 0.256 1
1 209 . 22 1 1 A 23 23 VAL CB C 23 34.550 35.573 -1.023 1
1 212 . 22 1 1 A 23 23 VAL N N 23 121.820 122.897 -1.077 1
1 213 . 22 1 1 A 24 24 GLU H H 24 8.270 9.008 -0.738 1
1 214 . 22 1 1 A 24 24 GLU HA H 24 4.330 4.947 -0.617 1
1 219 . 22 1 1 A 24 24 GLU C C 24 175.390 174.769 0.621 1
1 220 . 22 1 1 A 24 24 GLU CA C 24 55.220 54.631 0.589 1
1 221 . 22 1 1 A 24 24 GLU CB C 24 29.970 32.289 -2.319 1
1 223 . 22 1 1 A 24 24 GLU N N 24 125.610 128.169 -2.559 1
1 224 . 22 1 1 A 25 25 LEU H H 25 8.480 8.740 -0.260 1
1 225 . 22 1 1 A 25 25 LEU HA H 25 4.520 4.441 0.079 1
1 235 . 22 1 1 A 25 25 LEU CA C 25 51.660 51.078 0.582 1
1 236 . 22 1 1 A 25 25 LEU CB C 25 41.750 41.658 0.092 1
1 240 . 22 1 1 A 25 25 LEU N N 25 125.880 128.618 -2.738 1
1 241 . 22 1 1 A 26 26 PRO HA H 26 4.760 4.665 0.095 1
1 248 . 22 1 1 A 26 26 PRO CA C 26 61.330 61.961 -0.631 1
1 249 . 22 1 1 A 26 26 PRO CB C 26 31.060 32.879 -1.819 1
1 252 . 22 1 1 A 27 27 PRO HA H 27 4.390 4.420 -0.030 1
1 259 . 22 1 1 A 27 27 PRO CA C 27 64.550 64.851 -0.301 1
1 260 . 22 1 1 A 27 27 PRO CB C 27 31.770 31.741 0.029 1
1 263 . 22 1 1 A 28 28 ASP H H 28 8.560 8.766 -0.206 1
1 264 . 22 1 1 A 28 28 ASP HA H 28 4.620 4.397 0.223 1
1 267 . 22 1 1 A 28 28 ASP C C 28 177.100 178.702 -1.602 1
1 268 . 22 1 1 A 28 28 ASP CA C 28 53.890 56.519 -2.629 1
1 269 . 22 1 1 A 28 28 ASP CB C 28 39.120 39.604 -0.484 1
1 270 . 22 1 1 A 28 28 ASP N N 28 115.820 117.825 -2.005 1
1 271 . 22 1 1 A 29 29 PHE H H 29 7.940 7.902 0.038 1
1 272 . 22 1 1 A 29 29 PHE HA H 29 4.180 4.335 -0.155 1
1 280 . 22 1 1 A 29 29 PHE C C 29 176.740 178.177 -1.437 1
1 281 . 22 1 1 A 29 29 PHE CA C 29 61.020 61.066 -0.046 1
1 282 . 22 1 1 A 29 29 PHE CB C 29 39.230 38.575 0.655 1
1 288 . 22 1 1 A 29 29 PHE N N 29 119.610 118.199 1.411 1
1 289 . 22 1 1 A 30 30 VAL H H 30 8.010 8.470 -0.460 1
1 290 . 22 1 1 A 30 30 VAL HA H 30 3.350 3.771 -0.421 1
1 298 . 22 1 1 A 30 30 VAL C C 30 176.400 177.158 -0.758 1
1 299 . 22 1 1 A 30 30 VAL CA C 30 66.510 64.821 1.689 1
1 300 . 22 1 1 A 30 30 VAL CB C 30 31.020 31.046 -0.026 1
1 303 . 22 1 1 A 30 30 VAL N N 30 116.370 119.631 -3.261 1
1 304 . 22 1 1 A 31 31 ASP H H 31 7.420 7.990 -0.570 1
1 305 . 22 1 1 A 31 31 ASP HA H 31 4.310 4.360 -0.050 1
1 308 . 22 1 1 A 31 31 ASP C C 31 178.360 178.919 -0.559 1
1 309 . 22 1 1 A 31 31 ASP CA C 31 57.110 57.127 -0.017 1
1 310 . 22 1 1 A 31 31 ASP CB C 31 40.450 40.838 -0.388 1
1 311 . 22 1 1 A 31 31 ASP N N 31 119.190 121.677 -2.487 1
1 312 . 22 1 1 A 32 32 VAL H H 32 7.190 7.373 -0.183 1
1 313 . 22 1 1 A 32 32 VAL HA H 32 3.510 3.550 -0.040 1
1 321 . 22 1 1 A 32 32 VAL C C 32 178.100 178.482 -0.382 1
1 322 . 22 1 1 A 32 32 VAL CA C 32 65.570 66.397 -0.827 1
1 323 . 22 1 1 A 32 32 VAL CB C 32 31.410 31.299 0.111 1
1 326 . 22 1 1 A 32 32 VAL N N 32 119.830 120.274 -0.444 1
1 327 . 22 1 1 A 33 33 ILE H H 33 7.660 8.523 -0.863 1
1 328 . 22 1 1 A 33 33 ILE HA H 33 3.170 3.567 -0.397 1
1 338 . 22 1 1 A 33 33 ILE C C 33 176.660 178.045 -1.385 1
1 339 . 22 1 1 A 33 33 ILE CA C 33 65.220 65.175 0.045 1
1 340 . 22 1 1 A 33 33 ILE CB C 33 37.500 37.644 -0.144 1
1 344 . 22 1 1 A 33 33 ILE N N 33 118.490 120.798 -2.308 1
1 345 . 22 1 1 A 34 34 ARG H H 34 7.830 7.732 0.098 1
1 346 . 22 1 1 A 34 34 ARG HA H 34 3.380 3.933 -0.553 1
1 354 . 22 1 1 A 34 34 ARG C C 34 178.060 178.446 -0.386 1
1 355 . 22 1 1 A 34 34 ARG CA C 34 60.570 59.263 1.307 1
1 356 . 22 1 1 A 34 34 ARG CB C 34 30.070 29.944 0.126 1
1 359 . 22 1 1 A 34 34 ARG N N 34 118.260 120.076 -1.816 1
1 361 . 22 1 1 A 35 35 ILE H H 35 7.350 7.905 -0.555 1
1 362 . 22 1 1 A 35 35 ILE HA H 35 3.720 3.740 -0.020 1
1 372 . 22 1 1 A 35 35 ILE C C 35 179.090 178.254 0.836 1
1 373 . 22 1 1 A 35 35 ILE CA C 35 64.060 65.052 -0.992 1
1 374 . 22 1 1 A 35 35 ILE CB C 35 38.030 37.850 0.180 1
1 378 . 22 1 1 A 35 35 ILE N N 35 116.750 119.697 -2.947 1
1 379 . 22 1 1 A 36 36 LYS H H 36 7.880 8.209 -0.329 1
1 380 . 22 1 1 A 36 36 LYS HA H 36 4.090 4.039 0.051 1
1 389 . 22 1 1 A 36 36 LYS C C 36 178.560 178.095 0.465 1
1 390 . 22 1 1 A 36 36 LYS CA C 36 57.650 58.849 -1.199 1
1 391 . 22 1 1 A 36 36 LYS CB C 36 32.090 31.780 0.310 1
1 395 . 22 1 1 A 36 36 LYS N N 36 118.700 120.565 -1.865 1
1 396 . 22 1 1 A 37 37 LEU H H 37 7.860 7.333 0.527 1
1 397 . 22 1 1 A 37 37 LEU HA H 37 4.230 4.288 -0.058 1
1 407 . 22 1 1 A 37 37 LEU C C 37 175.880 176.793 -0.913 1
1 408 . 22 1 1 A 37 37 LEU CA C 37 54.090 56.056 -1.966 1
1 409 . 22 1 1 A 37 37 LEU CB C 37 43.310 42.726 0.584 1
1 413 . 22 1 1 A 37 37 LEU N N 37 116.380 117.630 -1.250 1
1 414 . 22 1 1 A 38 38 GLN H H 38 7.190 7.538 -0.348 1
1 415 . 22 1 1 A 38 38 GLN HA H 38 3.530 4.507 -0.977 1
1 422 . 22 1 1 A 38 38 GLN C C 38 177.480 176.275 1.205 1
1 423 . 22 1 1 A 38 38 GLN CA C 38 58.370 56.836 1.534 1
1 424 . 22 1 1 A 38 38 GLN CB C 38 28.300 28.715 -0.415 1
1 426 . 22 1 1 A 38 38 GLN N N 38 119.210 117.590 1.620 1
1 428 . 22 1 1 A 39 39 GLY H H 39 8.940 8.867 0.073 1
1 429 . 22 1 1 A 39 39 GLY HA2 H 39 3.540 3.989 -0.449 1
1 430 . 22 1 1 A 39 39 GLY HA3 H 39 4.220 3.990 0.230 1
1 431 . 22 1 1 A 39 39 GLY C C 39 174.070 174.389 -0.319 1
1 432 . 22 1 1 A 39 39 GLY CA C 39 45.280 45.065 0.215 1
1 433 . 22 1 1 A 39 39 GLY N N 39 113.490 112.172 1.318 1
1 434 . 22 1 1 A 40 40 LYS H H 40 8.350 7.644 0.706 1
1 435 . 22 1 1 A 40 40 LYS HA H 40 4.400 4.617 -0.217 1
1 444 . 22 1 1 A 40 40 LYS C C 40 175.560 175.808 -0.248 1
1 445 . 22 1 1 A 40 40 LYS CA C 40 55.660 54.623 1.037 1
1 446 . 22 1 1 A 40 40 LYS CB C 40 32.870 33.759 -0.889 1
1 450 . 22 1 1 A 40 40 LYS N N 40 122.060 119.995 2.065 1
1 451 . 22 1 1 A 41 41 THR H H 41 8.410 8.534 -0.124 1
1 452 . 22 1 1 A 41 41 THR HA H 41 5.330 5.048 0.282 1
1 457 . 22 1 1 A 41 41 THR C C 41 174.860 174.210 0.650 1
1 458 . 22 1 1 A 41 41 THR CA C 41 62.040 61.629 0.411 1
1 459 . 22 1 1 A 41 41 THR CB C 41 69.420 70.921 -1.501 1
1 461 . 22 1 1 A 41 41 THR N N 41 118.150 117.473 0.677 1
1 462 . 22 1 1 A 42 42 VAL H H 42 9.140 9.106 0.034 1
1 463 . 22 1 1 A 42 42 VAL HA H 42 4.570 5.006 -0.436 1
1 471 . 22 1 1 A 42 42 VAL C C 42 172.970 173.652 -0.682 1
1 472 . 22 1 1 A 42 42 VAL CA C 42 59.450 59.236 0.214 1
1 473 . 22 1 1 A 42 42 VAL CB C 42 35.880 35.550 0.330 1
1 476 . 22 1 1 A 42 42 VAL N N 42 122.510 120.069 2.441 1
1 477 . 22 1 1 A 43 43 ARG H H 43 8.420 8.762 -0.342 1
1 478 . 22 1 1 A 43 43 ARG HA H 43 4.750 4.960 -0.210 1
1 485 . 22 1 1 A 43 43 ARG C C 43 175.650 174.909 0.741 1
1 486 . 22 1 1 A 43 43 ARG CA C 43 53.650 54.109 -0.459 1
1 487 . 22 1 1 A 43 43 ARG CB C 43 33.870 33.855 0.015 1
1 490 . 22 1 1 A 43 43 ARG N N 43 120.640 122.764 -2.124 1
1 491 . 22 1 1 A 44 44 THR H H 44 8.370 8.564 -0.194 1
1 492 . 22 1 1 A 44 44 THR HA H 44 3.410 3.756 -0.346 1
1 497 . 22 1 1 A 44 44 THR C C 44 175.020 175.813 -0.793 1
1 498 . 22 1 1 A 44 44 THR CA C 44 65.660 64.988 0.672 1
1 499 . 22 1 1 A 44 44 THR CB C 44 69.400 68.334 1.066 1
1 501 . 22 1 1 A 44 44 THR N N 44 118.590 119.401 -0.811 1
1 502 . 22 1 1 A 45 45 GLY H H 45 9.090 8.715 0.375 1
1 503 . 22 1 1 A 45 45 GLY HA2 H 45 3.470 4.015 -0.545 1
1 504 . 22 1 1 A 45 45 GLY HA3 H 45 4.470 4.018 0.452 1
1 505 . 22 1 1 A 45 45 GLY C C 45 174.350 173.843 0.507 1
1 506 . 22 1 1 A 45 45 GLY CA C 45 45.000 44.957 0.043 1
1 507 . 22 1 1 A 45 45 GLY N N 45 117.350 114.926 2.424 1
1 508 . 22 1 1 A 46 46 ASP H H 46 8.010 7.887 0.123 1
1 509 . 22 1 1 A 46 46 ASP HA H 46 4.470 4.624 -0.154 1
1 512 . 22 1 1 A 46 46 ASP C C 46 174.570 174.522 0.048 1
1 513 . 22 1 1 A 46 46 ASP CA C 46 55.570 55.410 0.160 1
1 514 . 22 1 1 A 46 46 ASP CB C 46 41.680 41.468 0.212 1
1 515 . 22 1 1 A 46 46 ASP N N 46 122.240 122.203 0.037 1
1 516 . 22 1 1 A 47 47 VAL H H 47 8.330 8.434 -0.104 1
1 517 . 22 1 1 A 47 47 VAL HA H 47 4.950 4.950 0.000 1
1 525 . 22 1 1 A 47 47 VAL C C 47 176.330 175.554 0.776 1
1 526 . 22 1 1 A 47 47 VAL CA C 47 61.710 60.938 0.772 1
1 527 . 22 1 1 A 47 47 VAL CB C 47 32.900 35.174 -2.274 1
1 530 . 22 1 1 A 47 47 VAL N N 47 119.860 121.817 -1.957 1
1 531 . 22 1 1 A 48 48 ILE H H 48 9.160 8.663 0.497 1
1 532 . 22 1 1 A 48 48 ILE HA H 48 4.630 5.199 -0.569 1
1 542 . 22 1 1 A 48 48 ILE C C 48 174.400 174.400 0.000 1
1 543 . 22 1 1 A 48 48 ILE CA C 48 58.990 59.283 -0.293 1
1 544 . 22 1 1 A 48 48 ILE CB C 48 41.810 42.156 -0.346 1
1 548 . 22 1 1 A 48 48 ILE N N 48 124.990 121.577 3.413 1
1 549 . 22 1 1 A 49 49 GLY H H 49 8.660 8.906 -0.246 1
1 550 . 22 1 1 A 49 49 GLY HA2 H 49 4.950 4.311 0.639 1
1 551 . 22 1 1 A 49 49 GLY HA3 H 49 3.620 4.354 -0.734 1
1 552 . 22 1 1 A 49 49 GLY C C 49 172.920 171.992 0.928 1
1 553 . 22 1 1 A 49 49 GLY CA C 49 44.580 44.365 0.215 1
1 554 . 22 1 1 A 49 49 GLY N N 49 112.060 109.310 2.750 1
1 555 . 22 1 1 A 50 50 ILE H H 50 8.810 9.025 -0.215 1
1 556 . 22 1 1 A 50 50 ILE HA H 50 4.370 4.848 -0.478 1
1 566 . 22 1 1 A 50 50 ILE C C 50 174.500 174.864 -0.364 1
1 567 . 22 1 1 A 50 50 ILE CA C 50 59.550 59.774 -0.224 1
1 568 . 22 1 1 A 50 50 ILE CB C 50 41.300 42.003 -0.703 1
1 572 . 22 1 1 A 50 50 ILE N N 50 123.220 124.857 -1.637 1
1 573 . 22 1 1 A 51 51 SER H H 51 8.540 9.063 -0.523 1
1 574 . 22 1 1 A 51 51 SER HA H 51 4.830 5.148 -0.318 1
1 577 . 22 1 1 A 51 51 SER C C 51 174.130 173.979 0.151 1
1 578 . 22 1 1 A 51 51 SER CA C 51 57.770 56.664 1.106 1
1 579 . 22 1 1 A 51 51 SER CB C 51 63.040 64.491 -1.451 1
1 580 . 22 1 1 A 51 51 SER N N 51 121.430 121.292 0.138 1
1 581 . 22 1 1 A 52 52 ILE H H 52 8.930 8.729 0.201 1
1 582 . 22 1 1 A 52 52 ILE HA H 52 4.290 4.612 -0.322 1
1 592 . 22 1 1 A 52 52 ILE C C 52 175.280 176.129 -0.849 1
1 593 . 22 1 1 A 52 52 ILE CA C 52 60.250 60.361 -0.111 1
1 594 . 22 1 1 A 52 52 ILE CB C 52 39.840 40.432 -0.592 1
1 598 . 22 1 1 A 52 52 ILE N N 52 127.060 124.992 2.068 1
1 599 . 22 1 1 A 53 53 LEU H H 53 9.380 9.509 -0.129 1
1 600 . 22 1 1 A 53 53 LEU HA H 53 3.890 4.096 -0.206 1
1 610 . 22 1 1 A 53 53 LEU C C 53 177.130 176.990 0.140 1
1 611 . 22 1 1 A 53 53 LEU CA C 53 55.560 56.206 -0.646 1
1 612 . 22 1 1 A 53 53 LEU CB C 53 39.370 40.680 -1.310 1
1 616 . 22 1 1 A 53 53 LEU N N 53 126.770 130.146 -3.376 1
1 617 . 22 1 1 A 54 54 GLY H H 54 8.310 8.712 -0.402 1
1 618 . 22 1 1 A 54 54 GLY HA2 H 54 3.490 3.899 -0.409 1
1 619 . 22 1 1 A 54 54 GLY HA3 H 54 4.080 3.901 0.179 1
1 620 . 22 1 1 A 54 54 GLY C C 54 173.690 173.970 -0.280 1
1 621 . 22 1 1 A 54 54 GLY CA C 54 45.340 45.788 -0.448 1
1 622 . 22 1 1 A 54 54 GLY N N 54 103.820 104.385 -0.565 1
1 623 . 22 1 1 A 55 55 LYS H H 55 7.730 7.839 -0.109 1
1 624 . 22 1 1 A 55 55 LYS HA H 55 4.560 4.794 -0.234 1
1 633 . 22 1 1 A 55 55 LYS C C 55 174.550 175.323 -0.773 1
1 634 . 22 1 1 A 55 55 LYS CA C 55 54.140 55.019 -0.879 1
1 635 . 22 1 1 A 55 55 LYS CB C 55 34.620 35.340 -0.720 1
1 639 . 22 1 1 A 55 55 LYS N N 55 121.160 120.451 0.709 1
1 640 . 22 1 1 A 56 56 GLU H H 56 8.490 8.837 -0.347 1
1 641 . 22 1 1 A 56 56 GLU HA H 56 4.280 4.692 -0.412 1
1 646 . 22 1 1 A 56 56 GLU C C 56 175.730 175.226 0.504 1
1 647 . 22 1 1 A 56 56 GLU CA C 56 56.730 56.321 0.409 1
1 648 . 22 1 1 A 56 56 GLU CB C 56 30.070 30.652 -0.582 1
1 650 . 22 1 1 A 56 56 GLU N N 56 124.090 128.447 -4.357 1
1 651 . 22 1 1 A 57 57 VAL H H 57 8.920 8.477 0.443 1
1 652 . 22 1 1 A 57 57 VAL HA H 57 4.030 4.785 -0.755 1
1 660 . 22 1 1 A 57 57 VAL C C 57 174.610 173.823 0.787 1
1 661 . 22 1 1 A 57 57 VAL CA C 57 61.680 59.537 2.143 1
1 662 . 22 1 1 A 57 57 VAL CB C 57 33.880 34.479 -0.599 1
1 665 . 22 1 1 A 57 57 VAL N N 57 129.960 126.717 3.243 1
1 666 . 22 1 1 A 58 58 LYS H H 58 7.860 8.673 -0.813 1
1 667 . 22 1 1 A 58 58 LYS HA H 58 5.120 4.796 0.324 1
1 676 . 22 1 1 A 58 58 LYS C C 58 175.380 175.853 -0.473 1
1 677 . 22 1 1 A 58 58 LYS CA C 58 55.200 54.816 0.384 1
1 678 . 22 1 1 A 58 58 LYS CB C 58 34.670 34.015 0.655 1
1 682 . 22 1 1 A 58 58 LYS N N 58 124.790 127.324 -2.534 1
1 683 . 22 1 1 A 59 59 PHE H H 59 9.270 9.126 0.144 1
1 684 . 22 1 1 A 59 59 PHE HA H 59 4.960 5.104 -0.144 1
1 692 . 22 1 1 A 59 59 PHE C C 59 173.950 174.367 -0.417 1
1 693 . 22 1 1 A 59 59 PHE CA C 59 55.910 56.242 -0.332 1
1 694 . 22 1 1 A 59 59 PHE CB C 59 42.950 42.145 0.805 1
1 700 . 22 1 1 A 59 59 PHE N N 59 118.270 122.846 -4.576 1
1 701 . 22 1 1 A 60 60 LYS H H 60 9.170 8.969 0.201 1
1 702 . 22 1 1 A 60 60 LYS HA H 60 4.910 4.968 -0.058 1
1 711 . 22 1 1 A 60 60 LYS C C 60 176.230 175.845 0.385 1
1 712 . 22 1 1 A 60 60 LYS CA C 60 53.910 54.605 -0.695 1
1 713 . 22 1 1 A 60 60 LYS CB C 60 35.170 34.775 0.395 1
1 717 . 22 1 1 A 60 60 LYS N N 60 121.960 124.379 -2.419 1
1 718 . 22 1 1 A 61 61 VAL H H 61 9.400 8.730 0.670 1
1 719 . 22 1 1 A 61 61 VAL HA H 61 4.170 4.040 0.130 1
1 727 . 22 1 1 A 61 61 VAL C C 61 175.500 175.410 0.090 1
1 728 . 22 1 1 A 61 61 VAL CA C 61 61.980 63.307 -1.327 1
1 729 . 22 1 1 A 61 61 VAL CB C 61 29.490 31.160 -1.670 1
1 732 . 22 1 1 A 61 61 VAL N N 61 127.140 127.133 0.007 1
1 733 . 22 1 1 A 62 62 VAL H H 62 8.390 8.624 -0.234 1
1 734 . 22 1 1 A 62 62 VAL HA H 62 3.650 3.972 -0.322 1
1 742 . 22 1 1 A 62 62 VAL C C 62 176.440 176.068 0.372 1
1 743 . 22 1 1 A 62 62 VAL CA C 62 64.930 64.435 0.495 1
1 744 . 22 1 1 A 62 62 VAL CB C 62 32.130 32.422 -0.292 1
1 747 . 22 1 1 A 62 62 VAL N N 62 132.840 129.624 3.216 1
1 748 . 22 1 1 A 63 63 GLN H H 63 7.470 7.125 0.345 1
1 749 . 22 1 1 A 63 63 GLN HA H 63 4.270 4.603 -0.333 1
1 756 . 22 1 1 A 63 63 GLN C C 63 172.290 173.348 -1.058 1
1 757 . 22 1 1 A 63 63 GLN CA C 63 56.640 55.439 1.201 1
1 758 . 22 1 1 A 63 63 GLN CB C 63 32.630 31.735 0.895 1
1 760 . 22 1 1 A 63 63 GLN N N 63 114.500 116.947 -2.447 1
1 762 . 22 1 1 A 64 64 ALA H H 64 8.200 8.628 -0.428 1
1 763 . 22 1 1 A 64 64 ALA HA H 64 4.830 5.302 -0.472 1
1 767 . 22 1 1 A 64 64 ALA C C 64 174.270 175.712 -1.442 1
1 768 . 22 1 1 A 64 64 ALA CA C 64 50.800 49.988 0.812 1
1 769 . 22 1 1 A 64 64 ALA CB C 64 20.100 21.543 -1.443 1
1 770 . 22 1 1 A 64 64 ALA N N 64 131.410 128.681 2.729 1
1 771 . 22 1 1 A 65 65 TYR H H 65 8.860 8.539 0.321 1
1 772 . 22 1 1 A 65 65 TYR HA H 65 4.540 4.923 -0.383 1
1 779 . 22 1 1 A 65 65 TYR CA C 65 54.270 55.171 -0.901 1
1 780 . 22 1 1 A 65 65 TYR CB C 65 41.360 40.922 0.438 1
1 785 . 22 1 1 A 65 65 TYR N N 65 124.140 119.806 4.334 1
1 786 . 22 1 1 A 66 66 PRO HA H 66 4.120 4.747 -0.627 1
1 793 . 22 1 1 A 66 66 PRO CA C 66 63.450 62.362 1.088 1
1 794 . 22 1 1 A 66 66 PRO CB C 66 34.170 32.734 1.436 1
1 797 . 22 1 1 A 67 67 SER H H 67 7.380 8.246 -0.866 1
1 798 . 22 1 1 A 67 67 SER HA H 67 4.720 4.981 -0.261 1
1 801 . 22 1 1 A 67 67 SER CA C 67 54.250 56.058 -1.808 1
1 802 . 22 1 1 A 67 67 SER CB C 67 64.530 63.759 0.771 1
1 803 . 22 1 1 A 67 67 SER N N 67 106.200 116.678 -10.478 1
1 804 . 22 1 1 A 68 68 PRO HA H 68 4.880 4.652 0.228 1
1 811 . 22 1 1 A 68 68 PRO CA C 68 62.990 62.506 0.484 1
1 812 . 22 1 1 A 68 68 PRO CB C 68 35.220 33.172 2.048 1
1 815 . 22 1 1 A 69 69 LEU H H 69 8.960 8.007 0.953 1
1 816 . 22 1 1 A 69 69 LEU HA H 69 4.430 5.117 -0.687 1
1 826 . 22 1 1 A 69 69 LEU C C 69 174.570 175.239 -0.669 1
1 827 . 22 1 1 A 69 69 LEU CA C 69 53.900 52.585 1.315 1
1 828 . 22 1 1 A 69 69 LEU CB C 69 44.210 46.126 -1.916 1
1 832 . 22 1 1 A 69 69 LEU N N 69 120.480 117.093 3.387 1
1 833 . 22 1 1 A 70 70 ARG H H 70 8.130 8.379 -0.249 1
1 834 . 22 1 1 A 70 70 ARG HA H 70 4.930 4.684 0.246 1
1 841 . 22 1 1 A 70 70 ARG C C 70 175.460 176.290 -0.830 1
1 842 . 22 1 1 A 70 70 ARG CA C 70 54.040 55.670 -1.630 1
1 843 . 22 1 1 A 70 70 ARG CB C 70 30.550 31.783 -1.233 1
1 846 . 22 1 1 A 70 70 ARG N N 70 125.180 119.642 5.538 1
1 847 . 22 1 1 A 71 71 VAL H H 71 8.450 8.238 0.212 1
1 848 . 22 1 1 A 71 71 VAL HA H 71 3.410 4.456 -1.046 1
1 856 . 22 1 1 A 71 71 VAL C C 71 175.460 175.702 -0.242 1
1 857 . 22 1 1 A 71 71 VAL CA C 71 65.210 62.200 3.010 1
1 858 . 22 1 1 A 71 71 VAL CB C 71 29.840 31.716 -1.876 1
1 861 . 22 1 1 A 71 71 VAL N N 71 128.170 122.954 5.216 1
1 862 . 22 1 1 A 72 72 GLU H H 72 8.620 8.676 -0.056 1
1 863 . 22 1 1 A 72 72 GLU HA H 72 4.870 4.732 0.138 1
1 868 . 22 1 1 A 72 72 GLU C C 72 176.960 176.305 0.655 1
1 869 . 22 1 1 A 72 72 GLU CA C 72 54.330 54.144 0.186 1
1 870 . 22 1 1 A 72 72 GLU CB C 72 33.280 32.192 1.088 1
1 872 . 22 1 1 A 72 72 GLU N N 72 127.670 126.962 0.708 1
1 873 . 22 1 1 A 73 73 ASP H H 73 8.700 8.800 -0.100 1
1 874 . 22 1 1 A 73 73 ASP HA H 73 4.150 4.281 -0.131 1
1 877 . 22 1 1 A 73 73 ASP C C 73 177.460 178.093 -0.633 1
1 878 . 22 1 1 A 73 73 ASP CA C 73 57.620 56.661 0.959 1
1 879 . 22 1 1 A 73 73 ASP CB C 73 40.360 40.561 -0.201 1
1 880 . 22 1 1 A 73 73 ASP N N 73 121.140 122.166 -1.026 1
1 881 . 22 1 1 A 74 74 ARG H H 74 7.760 7.628 0.132 1
1 882 . 22 1 1 A 74 74 ARG HA H 74 4.280 4.336 -0.056 1
1 889 . 22 1 1 A 74 74 ARG C C 74 176.510 176.730 -0.220 1
1 890 . 22 1 1 A 74 74 ARG CA C 74 55.450 56.775 -1.325 1
1 891 . 22 1 1 A 74 74 ARG CB C 74 29.990 30.796 -0.806 1
1 894 . 22 1 1 A 74 74 ARG N N 74 112.890 116.804 -3.914 1
1 895 . 22 1 1 A 75 75 THR H H 75 7.700 7.573 0.127 1
1 896 . 22 1 1 A 75 75 THR HA H 75 4.020 4.382 -0.362 1
1 901 . 22 1 1 A 75 75 THR C C 75 173.810 173.818 -0.008 1
1 902 . 22 1 1 A 75 75 THR CA C 75 64.060 63.892 0.168 1
1 903 . 22 1 1 A 75 75 THR CB C 75 69.350 69.303 0.047 1
1 905 . 22 1 1 A 75 75 THR N N 75 120.650 116.289 4.361 1
1 906 . 22 1 1 A 76 76 LYS H H 76 8.520 8.293 0.227 1
1 907 . 22 1 1 A 76 76 LYS HA H 76 4.270 4.682 -0.412 1
1 916 . 22 1 1 A 76 76 LYS C C 76 174.560 175.840 -1.280 1
1 917 . 22 1 1 A 76 76 LYS CA C 76 56.280 55.669 0.611 1
1 918 . 22 1 1 A 76 76 LYS CB C 76 33.120 33.730 -0.610 1
1 922 . 22 1 1 A 76 76 LYS N N 76 130.950 127.306 3.644 1
1 923 . 22 1 1 A 77 77 ILE H H 77 8.430 8.857 -0.427 1
1 924 . 22 1 1 A 77 77 ILE HA H 77 4.850 4.857 -0.007 1
1 934 . 22 1 1 A 77 77 ILE C C 77 174.650 174.893 -0.243 1
1 935 . 22 1 1 A 77 77 ILE CA C 77 59.820 60.159 -0.339 1
1 936 . 22 1 1 A 77 77 ILE CB C 77 38.280 40.169 -1.889 1
1 940 . 22 1 1 A 77 77 ILE N N 77 128.020 123.292 4.728 1
1 941 . 22 1 1 A 78 78 THR H H 78 8.870 8.960 -0.090 1
1 942 . 22 1 1 A 78 78 THR HA H 78 4.470 5.095 -0.625 1
1 947 . 22 1 1 A 78 78 THR C C 78 172.760 173.460 -0.700 1
1 948 . 22 1 1 A 78 78 THR CA C 78 60.740 61.497 -0.757 1
1 949 . 22 1 1 A 78 78 THR CB C 78 71.320 71.185 0.135 1
1 951 . 22 1 1 A 78 78 THR N N 78 123.870 124.522 -0.652 1
1 952 . 22 1 1 A 79 79 LEU H H 79 8.820 8.971 -0.151 1
1 953 . 22 1 1 A 79 79 LEU HA H 79 5.140 5.067 0.073 1
1 963 . 22 1 1 A 79 79 LEU C C 79 176.610 175.929 0.681 1
1 964 . 22 1 1 A 79 79 LEU CA C 79 53.280 53.365 -0.085 1
1 965 . 22 1 1 A 79 79 LEU CB C 79 42.600 42.727 -0.127 1
1 969 . 22 1 1 A 79 79 LEU N N 79 127.070 126.565 0.505 1
1 970 . 22 1 1 A 80 80 VAL H H 80 8.800 8.615 0.185 1
1 971 . 22 1 1 A 80 80 VAL HA H 80 4.260 4.786 -0.526 1
1 979 . 22 1 1 A 80 80 VAL CA C 80 61.350 61.515 -0.165 1
1 980 . 22 1 1 A 80 80 VAL CB C 80 32.790 32.906 -0.116 1
1 983 . 22 1 1 A 80 80 VAL N N 80 124.120 125.400 -1.280 1
1 984 . 22 1 1 A 81 81 THR H H 81 8.160 8.894 -0.734 1
1 985 . 22 1 1 A 81 81 THR HA H 81 4.410 5.288 -0.878 1
1 990 . 22 1 1 A 81 81 THR CA C 81 60.800 59.954 0.846 1
1 991 . 22 1 1 A 81 81 THR CB C 81 69.650 72.723 -3.073 1
1 993 . 22 1 1 A 81 81 THR N N 81 114.500 116.601 -2.101 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 59 0.712 1
2 1 1 1 "RMS(OBS, PRED)" CA 73 0.985 1
3 1 1 1 "RMS(OBS, PRED)" CB 68 1.157 1
4 1 1 1 "RMS(OBS, PRED)" H 67 0.438 1
5 1 1 1 "RMS(OBS, PRED)" HA 78 0.416 1
6 1 1 1 "RMS(OBS, PRED)" N 67 2.946 1
7 1 2 1 "RMS(OBS, PRED)" C 59 0.734 1
8 1 2 1 "RMS(OBS, PRED)" CA 73 0.954 1
9 1 2 1 "RMS(OBS, PRED)" CB 68 1.091 1
10 1 2 1 "RMS(OBS, PRED)" H 67 0.434 1
11 1 2 1 "RMS(OBS, PRED)" HA 78 0.401 1
12 1 2 1 "RMS(OBS, PRED)" N 67 2.855 1
13 1 3 1 "RMS(OBS, PRED)" C 59 0.776 1
14 1 3 1 "RMS(OBS, PRED)" CA 73 1.013 1
15 1 3 1 "RMS(OBS, PRED)" CB 68 1.113 1
16 1 3 1 "RMS(OBS, PRED)" H 67 0.411 1
17 1 3 1 "RMS(OBS, PRED)" HA 78 0.390 1
18 1 3 1 "RMS(OBS, PRED)" N 67 2.892 1
19 1 4 1 "RMS(OBS, PRED)" C 59 0.756 1
20 1 4 1 "RMS(OBS, PRED)" CA 73 0.971 1
21 1 4 1 "RMS(OBS, PRED)" CB 68 1.163 1
22 1 4 1 "RMS(OBS, PRED)" H 67 0.416 1
23 1 4 1 "RMS(OBS, PRED)" HA 78 0.402 1
24 1 4 1 "RMS(OBS, PRED)" N 67 2.888 1
25 1 5 1 "RMS(OBS, PRED)" C 59 0.777 1
26 1 5 1 "RMS(OBS, PRED)" CA 73 0.988 1
27 1 5 1 "RMS(OBS, PRED)" CB 68 1.201 1
28 1 5 1 "RMS(OBS, PRED)" H 67 0.429 1
29 1 5 1 "RMS(OBS, PRED)" HA 78 0.408 1
30 1 5 1 "RMS(OBS, PRED)" N 67 2.919 1
31 1 6 1 "RMS(OBS, PRED)" C 59 0.783 1
32 1 6 1 "RMS(OBS, PRED)" CA 73 0.974 1
33 1 6 1 "RMS(OBS, PRED)" CB 68 1.045 1
34 1 6 1 "RMS(OBS, PRED)" H 67 0.436 1
35 1 6 1 "RMS(OBS, PRED)" HA 78 0.387 1
36 1 6 1 "RMS(OBS, PRED)" N 67 2.870 1
37 1 7 1 "RMS(OBS, PRED)" C 59 0.750 1
38 1 7 1 "RMS(OBS, PRED)" CA 73 1.007 1
39 1 7 1 "RMS(OBS, PRED)" CB 68 1.173 1
40 1 7 1 "RMS(OBS, PRED)" H 67 0.409 1
41 1 7 1 "RMS(OBS, PRED)" HA 78 0.421 1
42 1 7 1 "RMS(OBS, PRED)" N 67 3.028 1
43 1 8 1 "RMS(OBS, PRED)" C 59 0.744 1
44 1 8 1 "RMS(OBS, PRED)" CA 73 0.994 1
45 1 8 1 "RMS(OBS, PRED)" CB 68 1.130 1
46 1 8 1 "RMS(OBS, PRED)" H 67 0.431 1
47 1 8 1 "RMS(OBS, PRED)" HA 78 0.399 1
48 1 8 1 "RMS(OBS, PRED)" N 67 2.880 1
49 1 9 1 "RMS(OBS, PRED)" C 59 0.747 1
50 1 9 1 "RMS(OBS, PRED)" CA 73 0.982 1
51 1 9 1 "RMS(OBS, PRED)" CB 68 1.058 1
52 1 9 1 "RMS(OBS, PRED)" H 67 0.434 1
53 1 9 1 "RMS(OBS, PRED)" HA 78 0.376 1
54 1 9 1 "RMS(OBS, PRED)" N 67 2.851 1
55 1 10 1 "RMS(OBS, PRED)" C 59 0.768 1
56 1 10 1 "RMS(OBS, PRED)" CA 73 0.975 1
57 1 10 1 "RMS(OBS, PRED)" CB 68 1.137 1
58 1 10 1 "RMS(OBS, PRED)" H 67 0.419 1
59 1 10 1 "RMS(OBS, PRED)" HA 78 0.412 1
60 1 10 1 "RMS(OBS, PRED)" N 67 2.962 1
61 1 11 1 "RMS(OBS, PRED)" C 59 0.765 1
62 1 11 1 "RMS(OBS, PRED)" CA 73 0.962 1
63 1 11 1 "RMS(OBS, PRED)" CB 68 1.083 1
64 1 11 1 "RMS(OBS, PRED)" H 67 0.417 1
65 1 11 1 "RMS(OBS, PRED)" HA 78 0.380 1
66 1 11 1 "RMS(OBS, PRED)" N 67 2.845 1
67 1 12 1 "RMS(OBS, PRED)" C 59 0.746 1
68 1 12 1 "RMS(OBS, PRED)" CA 73 0.948 1
69 1 12 1 "RMS(OBS, PRED)" CB 68 1.083 1
70 1 12 1 "RMS(OBS, PRED)" H 67 0.396 1
71 1 12 1 "RMS(OBS, PRED)" HA 78 0.385 1
72 1 12 1 "RMS(OBS, PRED)" N 67 2.803 1
73 1 13 1 "RMS(OBS, PRED)" C 59 0.749 1
74 1 13 1 "RMS(OBS, PRED)" CA 73 0.954 1
75 1 13 1 "RMS(OBS, PRED)" CB 68 1.123 1
76 1 13 1 "RMS(OBS, PRED)" H 67 0.410 1
77 1 13 1 "RMS(OBS, PRED)" HA 78 0.405 1
78 1 13 1 "RMS(OBS, PRED)" N 67 2.959 1
79 1 14 1 "RMS(OBS, PRED)" C 59 0.788 1
80 1 14 1 "RMS(OBS, PRED)" CA 73 1.001 1
81 1 14 1 "RMS(OBS, PRED)" CB 68 1.192 1
82 1 14 1 "RMS(OBS, PRED)" H 67 0.410 1
83 1 14 1 "RMS(OBS, PRED)" HA 78 0.408 1
84 1 14 1 "RMS(OBS, PRED)" N 67 2.873 1
85 1 15 1 "RMS(OBS, PRED)" C 59 0.752 1
86 1 15 1 "RMS(OBS, PRED)" CA 73 0.968 1
87 1 15 1 "RMS(OBS, PRED)" CB 68 1.177 1
88 1 15 1 "RMS(OBS, PRED)" H 67 0.434 1
89 1 15 1 "RMS(OBS, PRED)" HA 78 0.390 1
90 1 15 1 "RMS(OBS, PRED)" N 67 2.831 1
91 1 16 1 "RMS(OBS, PRED)" C 59 0.740 1
92 1 16 1 "RMS(OBS, PRED)" CA 73 0.982 1
93 1 16 1 "RMS(OBS, PRED)" CB 68 1.191 1
94 1 16 1 "RMS(OBS, PRED)" H 67 0.452 1
95 1 16 1 "RMS(OBS, PRED)" HA 78 0.428 1
96 1 16 1 "RMS(OBS, PRED)" N 67 2.836 1
97 1 17 1 "RMS(OBS, PRED)" C 59 0.762 1
98 1 17 1 "RMS(OBS, PRED)" CA 73 1.005 1
99 1 17 1 "RMS(OBS, PRED)" CB 68 1.101 1
100 1 17 1 "RMS(OBS, PRED)" H 67 0.406 1
101 1 17 1 "RMS(OBS, PRED)" HA 78 0.394 1
102 1 17 1 "RMS(OBS, PRED)" N 67 2.954 1
103 1 18 1 "RMS(OBS, PRED)" C 59 0.792 1
104 1 18 1 "RMS(OBS, PRED)" CA 73 0.988 1
105 1 18 1 "RMS(OBS, PRED)" CB 68 1.166 1
106 1 18 1 "RMS(OBS, PRED)" H 67 0.407 1
107 1 18 1 "RMS(OBS, PRED)" HA 78 0.415 1
108 1 18 1 "RMS(OBS, PRED)" N 67 3.038 1
109 1 19 1 "RMS(OBS, PRED)" C 59 0.754 1
110 1 19 1 "RMS(OBS, PRED)" CA 73 0.972 1
111 1 19 1 "RMS(OBS, PRED)" CB 68 1.167 1
112 1 19 1 "RMS(OBS, PRED)" H 67 0.427 1
113 1 19 1 "RMS(OBS, PRED)" HA 78 0.393 1
114 1 19 1 "RMS(OBS, PRED)" N 67 2.972 1
115 1 20 1 "RMS(OBS, PRED)" C 59 0.762 1
116 1 20 1 "RMS(OBS, PRED)" CA 73 0.987 1
117 1 20 1 "RMS(OBS, PRED)" CB 68 1.290 1
118 1 20 1 "RMS(OBS, PRED)" H 67 0.413 1
119 1 20 1 "RMS(OBS, PRED)" HA 78 0.428 1
120 1 20 1 "RMS(OBS, PRED)" N 67 2.886 1
121 1 21 1 "RMS(OBS, PRED)" C 59 0.776 1
122 1 21 1 "RMS(OBS, PRED)" CA 73 0.972 1
123 1 21 1 "RMS(OBS, PRED)" CB 68 1.080 1
124 1 21 1 "RMS(OBS, PRED)" H 67 0.452 1
125 1 21 1 "RMS(OBS, PRED)" HA 78 0.399 1
126 1 21 1 "RMS(OBS, PRED)" N 67 3.008 1
127 1 22 1 "RMS(OBS, PRED)" C 59 0.774 1
128 1 22 1 "RMS(OBS, PRED)" CA 73 0.986 1
129 1 22 1 "RMS(OBS, PRED)" CB 68 1.263 1
130 1 22 1 "RMS(OBS, PRED)" H 67 0.441 1
131 1 22 1 "RMS(OBS, PRED)" HA 78 0.424 1
132 1 22 1 "RMS(OBS, PRED)" N 67 2.905 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 9 9 GLY H H 9 8.390 8.355 0.035 2
1 2 . 1 1 A 9 9 GLY HA2 H 9 3.900 4.077 -0.177 2
1 3 . 1 1 A 9 9 GLY HA3 H 9 3.860 4.078 -0.218 2
1 4 . 1 1 A 9 9 GLY CA C 9 45.150 45.124 0.026 2
1 5 . 1 1 A 9 9 GLY N N 9 110.000 110.132 -0.132 2
1 6 . 1 1 A 10 10 VAL H H 10 7.870 8.336 -0.466 2
1 7 . 1 1 A 10 10 VAL HA H 10 4.040 4.452 -0.412 2
1 15 . 1 1 A 10 10 VAL C C 10 175.880 175.138 0.742 2
1 16 . 1 1 A 10 10 VAL CA C 10 62.110 61.885 0.225 2
1 17 . 1 1 A 10 10 VAL CB C 10 32.760 33.318 -0.558 2
1 20 . 1 1 A 10 10 VAL N N 10 119.730 120.717 -0.987 2
1 21 . 1 1 A 11 11 ILE H H 11 8.230 8.873 -0.643 2
1 22 . 1 1 A 11 11 ILE HA H 11 4.090 4.728 -0.638 2
1 32 . 1 1 A 11 11 ILE C C 11 175.850 174.999 0.851 2
1 33 . 1 1 A 11 11 ILE CA C 11 60.800 59.952 0.849 2
1 34 . 1 1 A 11 11 ILE CB C 11 38.470 39.899 -1.429 2
1 38 . 1 1 A 11 11 ILE N N 11 125.570 127.542 -1.972 2
1 39 . 1 1 A 12 12 MET H H 12 8.370 8.860 -0.490 2
1 40 . 1 1 A 12 12 MET HA H 12 4.540 5.054 -0.514 2
1 48 . 1 1 A 12 12 MET C C 12 174.830 175.630 -0.800 2
1 49 . 1 1 A 12 12 MET CA C 12 54.790 54.067 0.723 2
1 50 . 1 1 A 12 12 MET CB C 12 32.640 34.071 -1.431 2
1 53 . 1 1 A 12 12 MET N N 12 125.930 126.158 -0.228 2
1 54 . 1 1 A 13 13 SER H H 13 7.990 8.790 -0.800 2
1 55 . 1 1 A 13 13 SER HA H 13 5.030 5.376 -0.346 2
1 58 . 1 1 A 13 13 SER C C 13 174.330 173.545 0.785 2
1 59 . 1 1 A 13 13 SER CA C 13 57.320 56.187 1.133 2
1 60 . 1 1 A 13 13 SER CB C 13 64.790 65.985 -1.195 2
1 61 . 1 1 A 13 13 SER N N 13 116.400 117.919 -1.519 2
1 62 . 1 1 A 14 14 GLU H H 14 9.430 8.692 0.738 2
1 63 . 1 1 A 14 14 GLU HA H 14 5.250 5.253 -0.003 2
1 68 . 1 1 A 14 14 GLU C C 14 172.980 174.371 -1.391 2
1 69 . 1 1 A 14 14 GLU CA C 14 55.390 55.233 0.157 2
1 70 . 1 1 A 14 14 GLU CB C 14 33.910 34.332 -0.422 2
1 72 . 1 1 A 14 14 GLU N N 14 123.670 121.005 2.665 2
1 73 . 1 1 A 15 15 LEU H H 15 8.930 8.910 0.020 2
1 74 . 1 1 A 15 15 LEU HA H 15 4.870 5.132 -0.262 2
1 84 . 1 1 A 15 15 LEU C C 15 174.000 174.519 -0.519 2
1 85 . 1 1 A 15 15 LEU CA C 15 53.020 53.698 -0.678 2
1 86 . 1 1 A 15 15 LEU CB C 15 46.040 45.832 0.208 2
1 90 . 1 1 A 15 15 LEU N N 15 125.350 125.916 -0.566 2
1 91 . 1 1 A 16 16 LYS H H 16 8.840 8.755 0.085 2
1 92 . 1 1 A 16 16 LYS HA H 16 5.360 4.926 0.434 2
1 101 . 1 1 A 16 16 LYS C C 16 175.660 175.539 0.121 2
1 102 . 1 1 A 16 16 LYS CA C 16 54.940 55.419 -0.479 2
1 103 . 1 1 A 16 16 LYS CB C 16 34.280 33.998 0.282 2
1 107 . 1 1 A 16 16 LYS N N 16 124.640 126.759 -2.119 2
1 108 . 1 1 A 17 17 LEU H H 17 8.820 8.986 -0.166 2
1 109 . 1 1 A 17 17 LEU HA H 17 5.430 5.207 0.223 2
1 119 . 1 1 A 17 17 LEU C C 17 174.630 175.536 -0.906 2
1 120 . 1 1 A 17 17 LEU CA C 17 52.900 53.475 -0.575 2
1 121 . 1 1 A 17 17 LEU CB C 17 46.910 45.485 1.425 2
1 125 . 1 1 A 17 17 LEU N N 17 123.460 126.450 -2.990 2
1 126 . 1 1 A 18 18 LYS H H 18 9.110 8.688 0.422 2
1 127 . 1 1 A 18 18 LYS HA H 18 5.490 5.012 0.478 2
1 136 . 1 1 A 18 18 LYS CA C 18 52.270 52.887 -0.617 2
1 137 . 1 1 A 18 18 LYS CB C 18 37.500 36.171 1.329 2
1 141 . 1 1 A 18 18 LYS N N 18 122.230 123.563 -1.333 2
1 142 . 1 1 A 19 19 PRO HA H 19 4.100 4.541 -0.441 2
1 149 . 1 1 A 19 19 PRO CA C 19 62.440 62.561 -0.121 2
1 150 . 1 1 A 19 19 PRO CB C 19 30.640 32.235 -1.595 2
1 153 . 1 1 A 20 20 LEU H H 20 8.490 8.434 0.056 2
1 154 . 1 1 A 20 20 LEU HA H 20 4.320 4.225 0.095 2
1 164 . 1 1 A 20 20 LEU CA C 20 57.680 58.687 -1.007 2
1 165 . 1 1 A 20 20 LEU CB C 20 38.760 40.993 -2.233 2
1 169 . 1 1 A 20 20 LEU N N 20 123.250 119.645 3.605 2
1 170 . 1 1 A 21 21 PRO HA H 21 4.530 4.530 0.000 2
1 177 . 1 1 A 21 21 PRO CA C 21 62.880 62.454 0.426 2
1 178 . 1 1 A 21 21 PRO CB C 21 31.420 32.252 -0.831 2
1 181 . 1 1 A 22 22 LYS H H 22 8.180 8.389 -0.209 2
1 182 . 1 1 A 22 22 LYS HA H 22 4.110 4.471 -0.361 2
1 191 . 1 1 A 22 22 LYS C C 22 175.680 175.385 0.295 2
1 192 . 1 1 A 22 22 LYS CA C 22 56.210 55.771 0.439 2
1 193 . 1 1 A 22 22 LYS CB C 22 30.660 32.092 -1.432 2
1 197 . 1 1 A 22 22 LYS N N 22 119.160 121.673 -2.513 2
1 198 . 1 1 A 23 23 VAL H H 23 7.530 8.215 -0.685 2
1 199 . 1 1 A 23 23 VAL HA H 23 4.280 4.771 -0.491 2
1 207 . 1 1 A 23 23 VAL C C 23 173.690 173.222 0.468 2
1 208 . 1 1 A 23 23 VAL CA C 23 59.830 59.577 0.253 2
1 209 . 1 1 A 23 23 VAL CB C 23 34.550 35.544 -0.994 2
1 212 . 1 1 A 23 23 VAL N N 23 121.820 123.803 -1.983 2
1 213 . 1 1 A 24 24 GLU H H 24 8.270 8.921 -0.652 2
1 214 . 1 1 A 24 24 GLU HA H 24 4.330 4.929 -0.599 2
1 219 . 1 1 A 24 24 GLU C C 24 175.390 175.137 0.253 2
1 220 . 1 1 A 24 24 GLU CA C 24 55.220 54.891 0.329 2
1 221 . 1 1 A 24 24 GLU CB C 24 29.970 31.954 -1.984 2
1 223 . 1 1 A 24 24 GLU N N 24 125.610 127.407 -1.797 2
1 224 . 1 1 A 25 25 LEU H H 25 8.480 8.750 -0.270 2
1 225 . 1 1 A 25 25 LEU HA H 25 4.520 4.434 0.086 2
1 235 . 1 1 A 25 25 LEU CA C 25 51.660 51.483 0.177 2
1 236 . 1 1 A 25 25 LEU CB C 25 41.750 41.209 0.541 2
1 240 . 1 1 A 25 25 LEU N N 25 125.880 127.162 -1.282 2
1 241 . 1 1 A 26 26 PRO HA H 26 4.760 4.633 0.127 2
1 248 . 1 1 A 26 26 PRO CA C 26 61.330 61.913 -0.583 2
1 249 . 1 1 A 26 26 PRO CB C 26 31.060 32.800 -1.740 2
1 252 . 1 1 A 27 27 PRO HA H 27 4.390 4.398 -0.008 2
1 259 . 1 1 A 27 27 PRO CA C 27 64.550 64.890 -0.340 2
1 260 . 1 1 A 27 27 PRO CB C 27 31.770 31.748 0.022 2
1 263 . 1 1 A 28 28 ASP H H 28 8.560 8.806 -0.246 2
1 264 . 1 1 A 28 28 ASP HA H 28 4.620 4.417 0.203 2
1 267 . 1 1 A 28 28 ASP C C 28 177.100 178.765 -1.665 2
1 268 . 1 1 A 28 28 ASP CA C 28 53.890 56.385 -2.495 2
1 269 . 1 1 A 28 28 ASP CB C 28 39.120 39.591 -0.471 2
1 270 . 1 1 A 28 28 ASP N N 28 115.820 117.787 -1.967 2
1 271 . 1 1 A 29 29 PHE H H 29 7.940 7.941 -0.001 2
1 272 . 1 1 A 29 29 PHE HA H 29 4.180 4.324 -0.144 2
1 280 . 1 1 A 29 29 PHE C C 29 176.740 178.248 -1.508 2
1 281 . 1 1 A 29 29 PHE CA C 29 61.020 60.988 0.032 2
1 282 . 1 1 A 29 29 PHE CB C 29 39.230 38.777 0.453 2
1 288 . 1 1 A 29 29 PHE N N 29 119.610 118.281 1.329 2
1 289 . 1 1 A 30 30 VAL H H 30 8.010 8.452 -0.442 2
1 290 . 1 1 A 30 30 VAL HA H 30 3.350 3.752 -0.402 2
1 298 . 1 1 A 30 30 VAL C C 30 176.400 177.211 -0.811 2
1 299 . 1 1 A 30 30 VAL CA C 30 66.510 64.987 1.523 2
1 300 . 1 1 A 30 30 VAL CB C 30 31.020 31.086 -0.066 2
1 303 . 1 1 A 30 30 VAL N N 30 116.370 119.491 -3.121 2
1 304 . 1 1 A 31 31 ASP H H 31 7.420 8.022 -0.602 2
1 305 . 1 1 A 31 31 ASP HA H 31 4.310 4.367 -0.057 2
1 308 . 1 1 A 31 31 ASP C C 31 178.360 178.826 -0.466 2
1 309 . 1 1 A 31 31 ASP CA C 31 57.110 57.203 -0.093 2
1 310 . 1 1 A 31 31 ASP CB C 31 40.450 40.911 -0.461 2
1 311 . 1 1 A 31 31 ASP N N 31 119.190 121.538 -2.348 2
1 312 . 1 1 A 32 32 VAL H H 32 7.190 7.456 -0.266 2
1 313 . 1 1 A 32 32 VAL HA H 32 3.510 3.549 -0.039 2
1 321 . 1 1 A 32 32 VAL C C 32 178.100 178.530 -0.430 2
1 322 . 1 1 A 32 32 VAL CA C 32 65.570 66.377 -0.807 2
1 323 . 1 1 A 32 32 VAL CB C 32 31.410 31.302 0.108 2
1 326 . 1 1 A 32 32 VAL N N 32 119.830 119.949 -0.119 2
1 327 . 1 1 A 33 33 ILE H H 33 7.660 8.465 -0.805 2
1 328 . 1 1 A 33 33 ILE HA H 33 3.170 3.542 -0.372 2
1 338 . 1 1 A 33 33 ILE C C 33 176.660 178.126 -1.466 2
1 339 . 1 1 A 33 33 ILE CA C 33 65.220 65.223 -0.003 2
1 340 . 1 1 A 33 33 ILE CB C 33 37.500 37.705 -0.205 2
1 344 . 1 1 A 33 33 ILE N N 33 118.490 120.857 -2.367 2
1 345 . 1 1 A 34 34 ARG H H 34 7.830 7.735 0.095 2
1 346 . 1 1 A 34 34 ARG HA H 34 3.380 3.910 -0.530 2
1 354 . 1 1 A 34 34 ARG C C 34 178.060 177.672 0.388 2
1 355 . 1 1 A 34 34 ARG CA C 34 60.570 58.978 1.592 2
1 356 . 1 1 A 34 34 ARG CB C 34 30.070 29.780 0.290 2
1 359 . 1 1 A 34 34 ARG N N 34 118.260 120.018 -1.758 2
1 361 . 1 1 A 35 35 ILE H H 35 7.350 7.855 -0.505 2
1 362 . 1 1 A 35 35 ILE HA H 35 3.720 3.711 0.009 2
1 372 . 1 1 A 35 35 ILE C C 35 179.090 178.080 1.010 2
1 373 . 1 1 A 35 35 ILE CA C 35 64.060 65.331 -1.271 2
1 374 . 1 1 A 35 35 ILE CB C 35 38.030 37.530 0.500 2
1 378 . 1 1 A 35 35 ILE N N 35 116.750 119.475 -2.725 2
1 379 . 1 1 A 36 36 LYS H H 36 7.880 7.699 0.181 2
1 380 . 1 1 A 36 36 LYS HA H 36 4.090 3.968 0.122 2
1 389 . 1 1 A 36 36 LYS C C 36 178.560 178.844 -0.284 2
1 390 . 1 1 A 36 36 LYS CA C 36 57.650 59.696 -2.046 2
1 391 . 1 1 A 36 36 LYS CB C 36 32.090 32.172 -0.082 2
1 395 . 1 1 A 36 36 LYS N N 36 118.700 119.845 -1.145 2
1 396 . 1 1 A 37 37 LEU H H 37 7.860 7.424 0.436 2
1 397 . 1 1 A 37 37 LEU HA H 37 4.230 4.294 -0.064 2
1 407 . 1 1 A 37 37 LEU C C 37 175.880 176.774 -0.894 2
1 408 . 1 1 A 37 37 LEU CA C 37 54.090 55.716 -1.626 2
1 409 . 1 1 A 37 37 LEU CB C 37 43.310 42.540 0.770 2
1 413 . 1 1 A 37 37 LEU N N 37 116.380 117.473 -1.093 2
1 414 . 1 1 A 38 38 GLN H H 38 7.190 7.539 -0.349 2
1 415 . 1 1 A 38 38 GLN HA H 38 3.530 4.429 -0.899 2
1 422 . 1 1 A 38 38 GLN C C 38 177.480 176.264 1.216 2
1 423 . 1 1 A 38 38 GLN CA C 38 58.370 56.747 1.623 2
1 424 . 1 1 A 38 38 GLN CB C 38 28.300 28.733 -0.433 2
1 426 . 1 1 A 38 38 GLN N N 38 119.210 117.676 1.534 2
1 428 . 1 1 A 39 39 GLY H H 39 8.940 8.844 0.096 2
1 429 . 1 1 A 39 39 GLY HA2 H 39 3.540 3.990 -0.450 2
1 430 . 1 1 A 39 39 GLY HA3 H 39 4.220 3.991 0.229 2
1 431 . 1 1 A 39 39 GLY C C 39 174.070 174.420 -0.350 2
1 432 . 1 1 A 39 39 GLY CA C 39 45.280 45.051 0.229 2
1 433 . 1 1 A 39 39 GLY N N 39 113.490 112.232 1.258 2
1 434 . 1 1 A 40 40 LYS H H 40 8.350 7.610 0.740 2
1 435 . 1 1 A 40 40 LYS HA H 40 4.400 4.601 -0.201 2
1 444 . 1 1 A 40 40 LYS C C 40 175.560 175.790 -0.230 2
1 445 . 1 1 A 40 40 LYS CA C 40 55.660 54.678 0.982 2
1 446 . 1 1 A 40 40 LYS CB C 40 32.870 33.746 -0.876 2
1 450 . 1 1 A 40 40 LYS N N 40 122.060 119.981 2.079 2
1 451 . 1 1 A 41 41 THR H H 41 8.410 8.565 -0.155 2
1 452 . 1 1 A 41 41 THR HA H 41 5.330 5.000 0.330 2
1 457 . 1 1 A 41 41 THR C C 41 174.860 174.379 0.481 2
1 458 . 1 1 A 41 41 THR CA C 41 62.040 61.671 0.369 2
1 459 . 1 1 A 41 41 THR CB C 41 69.420 70.895 -1.475 2
1 461 . 1 1 A 41 41 THR N N 41 118.150 117.344 0.806 2
1 462 . 1 1 A 42 42 VAL H H 42 9.140 9.097 0.043 2
1 463 . 1 1 A 42 42 VAL HA H 42 4.570 5.036 -0.466 2
1 471 . 1 1 A 42 42 VAL C C 42 172.970 173.950 -0.980 2
1 472 . 1 1 A 42 42 VAL CA C 42 59.450 59.184 0.266 2
1 473 . 1 1 A 42 42 VAL CB C 42 35.880 35.497 0.383 2
1 476 . 1 1 A 42 42 VAL N N 42 122.510 120.160 2.350 2
1 477 . 1 1 A 43 43 ARG H H 43 8.420 8.706 -0.286 2
1 478 . 1 1 A 43 43 ARG HA H 43 4.750 4.918 -0.168 2
1 485 . 1 1 A 43 43 ARG C C 43 175.650 175.362 0.288 2
1 486 . 1 1 A 43 43 ARG CA C 43 53.650 53.963 -0.313 2
1 487 . 1 1 A 43 43 ARG CB C 43 33.870 33.994 -0.124 2
1 490 . 1 1 A 43 43 ARG N N 43 120.640 122.822 -2.181 2
1 491 . 1 1 A 44 44 THR H H 44 8.370 8.568 -0.198 2
1 492 . 1 1 A 44 44 THR HA H 44 3.410 3.763 -0.353 2
1 497 . 1 1 A 44 44 THR C C 44 175.020 175.812 -0.792 2
1 498 . 1 1 A 44 44 THR CA C 44 65.660 65.026 0.634 2
1 499 . 1 1 A 44 44 THR CB C 44 69.400 68.334 1.066 2
1 501 . 1 1 A 44 44 THR N N 44 118.590 118.498 0.092 2
1 502 . 1 1 A 45 45 GLY H H 45 9.090 8.757 0.333 2
1 503 . 1 1 A 45 45 GLY HA2 H 45 3.470 4.016 -0.546 2
1 504 . 1 1 A 45 45 GLY HA3 H 45 4.470 4.020 0.450 2
1 505 . 1 1 A 45 45 GLY C C 45 174.350 173.847 0.503 2
1 506 . 1 1 A 45 45 GLY CA C 45 45.000 44.946 0.054 2
1 507 . 1 1 A 45 45 GLY N N 45 117.350 114.979 2.371 2
1 508 . 1 1 A 46 46 ASP H H 46 8.010 7.893 0.117 2
1 509 . 1 1 A 46 46 ASP HA H 46 4.470 4.624 -0.154 2
1 512 . 1 1 A 46 46 ASP C C 46 174.570 174.445 0.125 2
1 513 . 1 1 A 46 46 ASP CA C 46 55.570 55.428 0.142 2
1 514 . 1 1 A 46 46 ASP CB C 46 41.680 41.525 0.155 2
1 515 . 1 1 A 46 46 ASP N N 46 122.240 122.230 0.010 2
1 516 . 1 1 A 47 47 VAL H H 47 8.330 8.432 -0.102 2
1 517 . 1 1 A 47 47 VAL HA H 47 4.950 4.919 0.031 2
1 525 . 1 1 A 47 47 VAL C C 47 176.330 175.501 0.829 2
1 526 . 1 1 A 47 47 VAL CA C 47 61.710 60.905 0.805 2
1 527 . 1 1 A 47 47 VAL CB C 47 32.900 35.122 -2.222 2
1 530 . 1 1 A 47 47 VAL N N 47 119.860 121.795 -1.935 2
1 531 . 1 1 A 48 48 ILE H H 48 9.160 8.699 0.461 2
1 532 . 1 1 A 48 48 ILE HA H 48 4.630 5.158 -0.528 2
1 542 . 1 1 A 48 48 ILE C C 48 174.400 174.407 -0.007 2
1 543 . 1 1 A 48 48 ILE CA C 48 58.990 59.296 -0.306 2
1 544 . 1 1 A 48 48 ILE CB C 48 41.810 42.194 -0.384 2
1 548 . 1 1 A 48 48 ILE N N 48 124.990 121.565 3.425 2
1 549 . 1 1 A 49 49 GLY H H 49 8.660 8.941 -0.281 2
1 550 . 1 1 A 49 49 GLY HA2 H 49 4.950 4.280 0.669 2
1 551 . 1 1 A 49 49 GLY HA3 H 49 3.620 4.321 -0.701 2
1 552 . 1 1 A 49 49 GLY C C 49 172.920 171.963 0.957 2
1 553 . 1 1 A 49 49 GLY CA C 49 44.580 44.399 0.181 2
1 554 . 1 1 A 49 49 GLY N N 49 112.060 109.477 2.583 2
1 555 . 1 1 A 50 50 ILE H H 50 8.810 9.004 -0.194 2
1 556 . 1 1 A 50 50 ILE HA H 50 4.370 4.804 -0.434 2
1 566 . 1 1 A 50 50 ILE C C 50 174.500 174.744 -0.244 2
1 567 . 1 1 A 50 50 ILE CA C 50 59.550 59.840 -0.290 2
1 568 . 1 1 A 50 50 ILE CB C 50 41.300 41.675 -0.375 2
1 572 . 1 1 A 50 50 ILE N N 50 123.220 125.232 -2.012 2
1 573 . 1 1 A 51 51 SER H H 51 8.540 8.900 -0.360 2
1 574 . 1 1 A 51 51 SER HA H 51 4.830 5.043 -0.213 2
1 577 . 1 1 A 51 51 SER C C 51 174.130 173.897 0.233 2
1 578 . 1 1 A 51 51 SER CA C 51 57.770 57.003 0.767 2
1 579 . 1 1 A 51 51 SER CB C 51 63.040 64.239 -1.199 2
1 580 . 1 1 A 51 51 SER N N 51 121.430 122.211 -0.781 2
1 581 . 1 1 A 52 52 ILE H H 52 8.930 8.731 0.199 2
1 582 . 1 1 A 52 52 ILE HA H 52 4.290 4.603 -0.313 2
1 592 . 1 1 A 52 52 ILE C C 52 175.280 176.078 -0.798 2
1 593 . 1 1 A 52 52 ILE CA C 52 60.250 60.262 -0.012 2
1 594 . 1 1 A 52 52 ILE CB C 52 39.840 40.475 -0.635 2
1 598 . 1 1 A 52 52 ILE N N 52 127.060 126.805 0.255 2
1 599 . 1 1 A 53 53 LEU H H 53 9.380 9.462 -0.082 2
1 600 . 1 1 A 53 53 LEU HA H 53 3.890 4.078 -0.188 2
1 610 . 1 1 A 53 53 LEU C C 53 177.130 176.898 0.232 2
1 611 . 1 1 A 53 53 LEU CA C 53 55.560 56.178 -0.618 2
1 612 . 1 1 A 53 53 LEU CB C 53 39.370 40.700 -1.330 2
1 616 . 1 1 A 53 53 LEU N N 53 126.770 129.664 -2.894 2
1 617 . 1 1 A 54 54 GLY H H 54 8.310 8.702 -0.392 2
1 618 . 1 1 A 54 54 GLY HA2 H 54 3.490 3.898 -0.408 2
1 619 . 1 1 A 54 54 GLY HA3 H 54 4.080 3.899 0.181 2
1 620 . 1 1 A 54 54 GLY C C 54 173.690 173.866 -0.176 2
1 621 . 1 1 A 54 54 GLY CA C 54 45.340 45.738 -0.398 2
1 622 . 1 1 A 54 54 GLY N N 54 103.820 104.440 -0.620 2
1 623 . 1 1 A 55 55 LYS H H 55 7.730 7.861 -0.131 2
1 624 . 1 1 A 55 55 LYS HA H 55 4.560 4.803 -0.243 2
1 633 . 1 1 A 55 55 LYS C C 55 174.550 175.057 -0.507 2
1 634 . 1 1 A 55 55 LYS CA C 55 54.140 54.727 -0.587 2
1 635 . 1 1 A 55 55 LYS CB C 55 34.620 35.451 -0.831 2
1 639 . 1 1 A 55 55 LYS N N 55 121.160 120.101 1.059 2
1 640 . 1 1 A 56 56 GLU H H 56 8.490 8.807 -0.317 2
1 641 . 1 1 A 56 56 GLU HA H 56 4.280 4.684 -0.405 2
1 646 . 1 1 A 56 56 GLU C C 56 175.730 175.195 0.535 2
1 647 . 1 1 A 56 56 GLU CA C 56 56.730 56.319 0.411 2
1 648 . 1 1 A 56 56 GLU CB C 56 30.070 30.690 -0.620 2
1 650 . 1 1 A 56 56 GLU N N 56 124.090 126.631 -2.541 2
1 651 . 1 1 A 57 57 VAL H H 57 8.920 8.430 0.490 2
1 652 . 1 1 A 57 57 VAL HA H 57 4.030 4.789 -0.759 2
1 660 . 1 1 A 57 57 VAL C C 57 174.610 173.645 0.965 2
1 661 . 1 1 A 57 57 VAL CA C 57 61.680 59.515 2.165 2
1 662 . 1 1 A 57 57 VAL CB C 57 33.880 34.462 -0.581 2
1 665 . 1 1 A 57 57 VAL N N 57 129.960 126.527 3.433 2
1 666 . 1 1 A 58 58 LYS H H 58 7.860 8.679 -0.819 2
1 667 . 1 1 A 58 58 LYS HA H 58 5.120 4.763 0.357 2
1 676 . 1 1 A 58 58 LYS C C 58 175.380 175.706 -0.326 2
1 677 . 1 1 A 58 58 LYS CA C 58 55.200 54.770 0.430 2
1 678 . 1 1 A 58 58 LYS CB C 58 34.670 34.139 0.531 2
1 682 . 1 1 A 58 58 LYS N N 58 124.790 127.303 -2.513 2
1 683 . 1 1 A 59 59 PHE H H 59 9.270 9.052 0.218 2
1 684 . 1 1 A 59 59 PHE HA H 59 4.960 5.116 -0.156 2
1 692 . 1 1 A 59 59 PHE C C 59 173.950 174.328 -0.378 2
1 693 . 1 1 A 59 59 PHE CA C 59 55.910 56.295 -0.385 2
1 694 . 1 1 A 59 59 PHE CB C 59 42.950 42.114 0.836 2
1 700 . 1 1 A 59 59 PHE N N 59 118.270 122.689 -4.419 2
1 701 . 1 1 A 60 60 LYS H H 60 9.170 8.905 0.265 2
1 702 . 1 1 A 60 60 LYS HA H 60 4.910 4.970 -0.060 2
1 711 . 1 1 A 60 60 LYS C C 60 176.230 175.906 0.323 2
1 712 . 1 1 A 60 60 LYS CA C 60 53.910 54.572 -0.662 2
1 713 . 1 1 A 60 60 LYS CB C 60 35.170 34.966 0.204 2
1 717 . 1 1 A 60 60 LYS N N 60 121.960 124.277 -2.317 2
1 718 . 1 1 A 61 61 VAL H H 61 9.400 8.810 0.590 2
1 719 . 1 1 A 61 61 VAL HA H 61 4.170 4.049 0.121 2
1 727 . 1 1 A 61 61 VAL C C 61 175.500 175.351 0.149 2
1 728 . 1 1 A 61 61 VAL CA C 61 61.980 63.335 -1.355 2
1 729 . 1 1 A 61 61 VAL CB C 61 29.490 31.175 -1.685 2
1 732 . 1 1 A 61 61 VAL N N 61 127.140 127.040 0.100 2
1 733 . 1 1 A 62 62 VAL H H 62 8.390 8.700 -0.310 2
1 734 . 1 1 A 62 62 VAL HA H 62 3.650 3.972 -0.322 2
1 742 . 1 1 A 62 62 VAL C C 62 176.440 176.054 0.386 2
1 743 . 1 1 A 62 62 VAL CA C 62 64.930 64.438 0.492 2
1 744 . 1 1 A 62 62 VAL CB C 62 32.130 32.437 -0.307 2
1 747 . 1 1 A 62 62 VAL N N 62 132.840 129.352 3.488 2
1 748 . 1 1 A 63 63 GLN H H 63 7.470 7.160 0.310 2
1 749 . 1 1 A 63 63 GLN HA H 63 4.270 4.589 -0.319 2
1 756 . 1 1 A 63 63 GLN C C 63 172.290 173.341 -1.051 2
1 757 . 1 1 A 63 63 GLN CA C 63 56.640 55.319 1.321 2
1 758 . 1 1 A 63 63 GLN CB C 63 32.630 32.168 0.462 2
1 760 . 1 1 A 63 63 GLN N N 63 114.500 117.351 -2.851 2
1 762 . 1 1 A 64 64 ALA H H 64 8.200 8.599 -0.399 2
1 763 . 1 1 A 64 64 ALA HA H 64 4.830 5.335 -0.505 2
1 767 . 1 1 A 64 64 ALA C C 64 174.270 175.625 -1.355 2
1 768 . 1 1 A 64 64 ALA CA C 64 50.800 49.990 0.810 2
1 769 . 1 1 A 64 64 ALA CB C 64 20.100 21.665 -1.565 2
1 770 . 1 1 A 64 64 ALA N N 64 131.410 127.903 3.506 2
1 771 . 1 1 A 65 65 TYR H H 65 8.860 8.527 0.333 2
1 772 . 1 1 A 65 65 TYR HA H 65 4.540 4.962 -0.421 2
1 779 . 1 1 A 65 65 TYR CA C 65 54.270 55.095 -0.825 2
1 780 . 1 1 A 65 65 TYR CB C 65 41.360 40.584 0.776 2
1 785 . 1 1 A 65 65 TYR N N 65 124.140 120.046 4.094 2
1 786 . 1 1 A 66 66 PRO HA H 66 4.120 4.732 -0.612 2
1 793 . 1 1 A 66 66 PRO CA C 66 63.450 62.354 1.096 2
1 794 . 1 1 A 66 66 PRO CB C 66 34.170 32.776 1.394 2
1 797 . 1 1 A 67 67 SER H H 67 7.380 8.233 -0.853 2
1 798 . 1 1 A 67 67 SER HA H 67 4.720 4.987 -0.267 2
1 801 . 1 1 A 67 67 SER CA C 67 54.250 56.033 -1.783 2
1 802 . 1 1 A 67 67 SER CB C 67 64.530 63.830 0.700 2
1 803 . 1 1 A 67 67 SER N N 67 106.200 116.717 -10.517 2
1 804 . 1 1 A 68 68 PRO HA H 68 4.880 4.657 0.223 2
1 811 . 1 1 A 68 68 PRO CA C 68 62.990 62.479 0.511 2
1 812 . 1 1 A 68 68 PRO CB C 68 35.220 33.211 2.009 2
1 815 . 1 1 A 69 69 LEU H H 69 8.960 7.967 0.993 2
1 816 . 1 1 A 69 69 LEU HA H 69 4.430 5.105 -0.675 2
1 826 . 1 1 A 69 69 LEU C C 69 174.570 175.263 -0.693 2
1 827 . 1 1 A 69 69 LEU CA C 69 53.900 52.627 1.273 2
1 828 . 1 1 A 69 69 LEU CB C 69 44.210 46.054 -1.844 2
1 832 . 1 1 A 69 69 LEU N N 69 120.480 117.055 3.425 2
1 833 . 1 1 A 70 70 ARG H H 70 8.130 8.375 -0.245 2
1 834 . 1 1 A 70 70 ARG HA H 70 4.930 4.783 0.147 2
1 841 . 1 1 A 70 70 ARG C C 70 175.460 176.197 -0.737 2
1 842 . 1 1 A 70 70 ARG CA C 70 54.040 55.537 -1.497 2
1 843 . 1 1 A 70 70 ARG CB C 70 30.550 31.822 -1.272 2
1 846 . 1 1 A 70 70 ARG N N 70 125.180 119.683 5.497 2
1 847 . 1 1 A 71 71 VAL H H 71 8.450 8.230 0.220 2
1 848 . 1 1 A 71 71 VAL HA H 71 3.410 4.441 -1.031 2
1 856 . 1 1 A 71 71 VAL C C 71 175.460 175.579 -0.119 2
1 857 . 1 1 A 71 71 VAL CA C 71 65.210 62.213 2.997 2
1 858 . 1 1 A 71 71 VAL CB C 71 29.840 31.748 -1.908 2
1 861 . 1 1 A 71 71 VAL N N 71 128.170 122.627 5.543 2
1 862 . 1 1 A 72 72 GLU H H 72 8.620 8.552 0.068 2
1 863 . 1 1 A 72 72 GLU HA H 72 4.870 4.788 0.082 2
1 868 . 1 1 A 72 72 GLU C C 72 176.960 176.300 0.660 2
1 869 . 1 1 A 72 72 GLU CA C 72 54.330 54.331 -0.001 2
1 870 . 1 1 A 72 72 GLU CB C 72 33.280 32.748 0.532 2
1 872 . 1 1 A 72 72 GLU N N 72 127.670 126.895 0.775 2
1 873 . 1 1 A 73 73 ASP H H 73 8.700 8.879 -0.179 2
1 874 . 1 1 A 73 73 ASP HA H 73 4.150 4.292 -0.142 2
1 877 . 1 1 A 73 73 ASP C C 73 177.460 177.890 -0.430 2
1 878 . 1 1 A 73 73 ASP CA C 73 57.620 56.934 0.686 2
1 879 . 1 1 A 73 73 ASP CB C 73 40.360 40.400 -0.040 2
1 880 . 1 1 A 73 73 ASP N N 73 121.140 124.169 -3.029 2
1 881 . 1 1 A 74 74 ARG H H 74 7.760 7.803 -0.043 2
1 882 . 1 1 A 74 74 ARG HA H 74 4.280 4.329 -0.049 2
1 889 . 1 1 A 74 74 ARG C C 74 176.510 176.692 -0.182 2
1 890 . 1 1 A 74 74 ARG CA C 74 55.450 57.008 -1.559 2
1 891 . 1 1 A 74 74 ARG CB C 74 29.990 30.621 -0.631 2
1 894 . 1 1 A 74 74 ARG N N 74 112.890 116.485 -3.595 2
1 895 . 1 1 A 75 75 THR H H 75 7.700 7.491 0.209 2
1 896 . 1 1 A 75 75 THR HA H 75 4.020 4.319 -0.299 2
1 901 . 1 1 A 75 75 THR C C 75 173.810 173.921 -0.111 2
1 902 . 1 1 A 75 75 THR CA C 75 64.060 63.792 0.268 2
1 903 . 1 1 A 75 75 THR CB C 75 69.350 69.559 -0.209 2
1 905 . 1 1 A 75 75 THR N N 75 120.650 116.464 4.186 2
1 906 . 1 1 A 76 76 LYS H H 76 8.520 8.263 0.257 2
1 907 . 1 1 A 76 76 LYS HA H 76 4.270 4.674 -0.404 2
1 916 . 1 1 A 76 76 LYS C C 76 174.560 175.804 -1.244 2
1 917 . 1 1 A 76 76 LYS CA C 76 56.280 55.955 0.325 2
1 918 . 1 1 A 76 76 LYS CB C 76 33.120 33.681 -0.561 2
1 922 . 1 1 A 76 76 LYS N N 76 130.950 127.135 3.815 2
1 923 . 1 1 A 77 77 ILE H H 77 8.430 8.659 -0.229 2
1 924 . 1 1 A 77 77 ILE HA H 77 4.850 5.178 -0.328 2
1 934 . 1 1 A 77 77 ILE C C 77 174.650 174.988 -0.338 2
1 935 . 1 1 A 77 77 ILE CA C 77 59.820 60.087 -0.267 2
1 936 . 1 1 A 77 77 ILE CB C 77 38.280 40.827 -2.547 2
1 940 . 1 1 A 77 77 ILE N N 77 128.020 123.160 4.860 2
1 941 . 1 1 A 78 78 THR H H 78 8.870 8.793 0.077 2
1 942 . 1 1 A 78 78 THR HA H 78 4.470 5.108 -0.638 2
1 947 . 1 1 A 78 78 THR C C 78 172.760 173.292 -0.532 2
1 948 . 1 1 A 78 78 THR CA C 78 60.740 61.356 -0.617 2
1 949 . 1 1 A 78 78 THR CB C 78 71.320 71.650 -0.331 2
1 951 . 1 1 A 78 78 THR N N 78 123.870 123.965 -0.095 2
1 952 . 1 1 A 79 79 LEU H H 79 8.820 8.950 -0.130 2
1 953 . 1 1 A 79 79 LEU HA H 79 5.140 5.065 0.075 2
1 963 . 1 1 A 79 79 LEU C C 79 176.610 175.919 0.691 2
1 964 . 1 1 A 79 79 LEU CA C 79 53.280 53.351 -0.071 2
1 965 . 1 1 A 79 79 LEU CB C 79 42.600 42.837 -0.237 2
1 969 . 1 1 A 79 79 LEU N N 79 127.070 126.523 0.547 2
1 970 . 1 1 A 80 80 VAL H H 80 8.800 8.694 0.106 2
1 971 . 1 1 A 80 80 VAL HA H 80 4.260 4.654 -0.394 2
1 979 . 1 1 A 80 80 VAL CA C 80 61.350 61.637 -0.287 2
1 980 . 1 1 A 80 80 VAL CB C 80 32.790 32.796 -0.006 2
1 983 . 1 1 A 80 80 VAL N N 80 124.120 125.396 -1.276 2
1 984 . 1 1 A 81 81 THR H H 81 8.160 8.761 -0.601 2
1 985 . 1 1 A 81 81 THR HA H 81 4.410 5.082 -0.671 2
1 990 . 1 1 A 81 81 THR CA C 81 60.800 60.442 0.358 2
1 991 . 1 1 A 81 81 THR CB C 81 69.650 71.710 -2.060 2
1 993 . 1 1 A 81 81 THR N N 81 114.500 116.589 -2.089 2
stop_
save_