data_7270_sparta save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7270 _Entry.PDB_ID 2O4E _Entry.NMR_STAR_version 3.0.9.100 save_ save_delta_chem_shifts_single _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single _Entity_delta_chem_shifts.Conformer_type "single" _Entity_delta_chem_shifts.Conformer_count 20 _Entity_delta_chem_shifts.Best_conformer 20 _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 13 13 GLY H H 13 8.350 7.939 0.411 1 1 2 . 1 1 1 A 13 13 GLY HA2 H 13 3.920 4.087 -0.167 1 1 3 . 1 1 1 A 13 13 GLY HA3 H 13 3.920 4.097 -0.177 1 1 4 . 1 1 1 A 13 13 GLY CA C 13 45.290 45.316 -0.026 1 1 5 . 1 1 1 A 13 13 GLY N N 13 110.450 109.564 0.886 1 1 6 . 1 1 1 A 14 14 LEU H H 14 8.050 8.816 -0.766 1 1 7 . 1 1 1 A 14 14 LEU N N 14 121.500 121.340 0.160 1 1 8 . 1 1 1 A 15 15 VAL H H 15 8.070 7.440 0.630 1 1 9 . 1 1 1 A 15 15 VAL N N 15 122.390 113.557 8.833 1 1 10 . 1 1 1 A 16 16 PRO HA H 16 4.360 4.396 -0.036 1 1 17 . 1 1 1 A 16 16 PRO CA C 16 62.770 63.506 -0.736 1 1 18 . 1 1 1 A 16 16 PRO CB C 16 32.020 31.821 0.199 1 1 21 . 1 1 1 A 21 21 MET H H 21 8.180 7.805 0.375 1 1 22 . 1 1 1 A 21 21 MET N N 21 121.310 116.304 5.006 1 1 23 . 1 1 1 A 22 22 ALA H H 22 8.290 8.571 -0.281 1 1 24 . 1 1 1 A 22 22 ALA N N 22 124.800 123.817 0.983 1 1 25 . 1 1 1 A 23 23 SER H H 23 8.210 8.476 -0.266 1 1 26 . 1 1 1 A 23 23 SER N N 23 114.830 115.125 -0.295 1 1 27 . 1 1 1 A 24 24 LYS H H 24 8.250 8.653 -0.403 1 1 28 . 1 1 1 A 24 24 LYS N N 24 122.980 122.909 0.071 1 1 29 . 1 1 1 A 25 25 LEU H H 25 8.140 8.595 -0.455 1 1 30 . 1 1 1 A 25 25 LEU HA H 25 4.290 4.420 -0.130 1 1 40 . 1 1 1 A 25 25 LEU C C 25 177.410 176.653 0.757 1 1 41 . 1 1 1 A 25 25 LEU CA C 25 55.430 56.732 -1.302 1 1 42 . 1 1 1 A 25 25 LEU CB C 25 42.350 42.767 -0.417 1 1 46 . 1 1 1 A 25 25 LEU N N 25 122.580 121.663 0.917 1 1 47 . 1 1 1 A 26 26 LYS H H 26 8.200 7.471 0.729 1 1 48 . 1 1 1 A 26 26 LYS HA H 26 4.260 4.420 -0.160 1 1 57 . 1 1 1 A 26 26 LYS C C 26 176.520 176.206 0.314 1 1 58 . 1 1 1 A 26 26 LYS CA C 26 56.700 56.619 0.081 1 1 59 . 1 1 1 A 26 26 LYS CB C 26 33.060 32.642 0.418 1 1 63 . 1 1 1 A 26 26 LYS N N 26 121.800 115.839 5.961 1 1 64 . 1 1 1 A 27 27 GLU H H 27 8.380 8.592 -0.212 1 1 65 . 1 1 1 A 27 27 GLU HA H 27 4.240 4.407 -0.167 1 1 70 . 1 1 1 A 27 27 GLU C C 27 176.130 176.382 -0.252 1 1 71 . 1 1 1 A 27 27 GLU CA C 27 56.700 56.349 0.351 1 1 72 . 1 1 1 A 27 27 GLU CB C 27 30.370 30.742 -0.372 1 1 74 . 1 1 1 A 27 27 GLU N N 27 121.700 122.111 -0.411 1 1 75 . 1 1 1 A 28 28 ALA H H 28 8.230 8.410 -0.180 1 1 76 . 1 1 1 A 28 28 ALA HA H 28 4.280 4.413 -0.133 1 1 80 . 1 1 1 A 28 28 ALA C C 28 177.090 176.573 0.517 1 1 81 . 1 1 1 A 28 28 ALA CA C 28 52.530 51.810 0.720 1 1 82 . 1 1 1 A 28 28 ALA CB C 28 19.360 20.073 -0.713 1 1 83 . 1 1 1 A 28 28 ALA N N 28 124.640 123.671 0.969 1 1 84 . 1 1 1 A 29 29 ALA H H 29 8.150 8.790 -0.640 1 1 85 . 1 1 1 A 29 29 ALA HA H 29 4.320 4.822 -0.502 1 1 89 . 1 1 1 A 29 29 ALA C C 29 177.120 175.934 1.186 1 1 90 . 1 1 1 A 29 29 ALA CA C 29 52.040 51.943 0.097 1 1 91 . 1 1 1 A 29 29 ALA CB C 29 19.430 18.859 0.571 1 1 92 . 1 1 1 A 29 29 ALA N N 29 123.430 119.225 4.205 1 1 93 . 1 1 1 A 30 30 GLU H H 30 8.310 8.491 -0.181 1 1 94 . 1 1 1 A 30 30 GLU HA H 30 4.220 4.814 -0.594 1 1 99 . 1 1 1 A 30 30 GLU C C 30 176.310 175.925 0.385 1 1 100 . 1 1 1 A 30 30 GLU CA C 30 56.630 55.731 0.899 1 1 101 . 1 1 1 A 30 30 GLU CB C 30 30.320 30.443 -0.123 1 1 103 . 1 1 1 A 30 30 GLU N N 30 120.630 119.984 0.646 1 1 104 . 1 1 1 A 31 31 VAL H H 31 8.630 8.986 -0.356 1 1 105 . 1 1 1 A 31 31 VAL HA H 31 4.430 5.093 -0.663 1 1 113 . 1 1 1 A 31 31 VAL C C 31 176.510 176.804 -0.294 1 1 114 . 1 1 1 A 31 31 VAL CA C 31 62.360 62.031 0.329 1 1 115 . 1 1 1 A 31 31 VAL CB C 31 32.370 33.070 -0.700 1 1 118 . 1 1 1 A 31 31 VAL N N 31 127.110 124.611 2.499 1 1 119 . 1 1 1 A 32 32 THR H H 32 7.640 8.760 -1.120 1 1 120 . 1 1 1 A 32 32 THR HA H 32 4.870 3.957 0.913 1 1 125 . 1 1 1 A 32 32 THR C C 32 172.220 174.837 -2.617 1 1 126 . 1 1 1 A 32 32 THR CA C 32 59.510 64.851 -5.341 1 1 127 . 1 1 1 A 32 32 THR CB C 32 71.630 69.922 1.708 1 1 129 . 1 1 1 A 32 32 THR N N 32 118.860 121.737 -2.877 1 1 130 . 1 1 1 A 33 33 GLY H H 33 8.350 7.946 0.404 1 1 131 . 1 1 1 A 33 33 GLY HA2 H 33 4.160 3.972 0.188 1 1 132 . 1 1 1 A 33 33 GLY HA3 H 33 4.250 3.973 0.277 1 1 133 . 1 1 1 A 33 33 GLY C C 33 172.820 173.548 -0.728 1 1 134 . 1 1 1 A 33 33 GLY CA C 33 46.680 45.828 0.852 1 1 135 . 1 1 1 A 33 33 GLY N N 33 106.720 109.208 -2.488 1 1 136 . 1 1 1 A 34 34 SER H H 34 8.810 9.107 -0.297 1 1 137 . 1 1 1 A 34 34 SER HA H 34 5.390 5.071 0.319 1 1 140 . 1 1 1 A 34 34 SER C C 34 173.780 172.889 0.891 1 1 141 . 1 1 1 A 34 34 SER CA C 34 57.380 57.529 -0.149 1 1 142 . 1 1 1 A 34 34 SER CB C 34 65.730 67.013 -1.283 1 1 143 . 1 1 1 A 34 34 SER N N 34 112.690 119.445 -6.755 1 1 144 . 1 1 1 A 35 35 VAL H H 35 8.470 8.790 -0.320 1 1 145 . 1 1 1 A 35 35 VAL HA H 35 4.120 5.031 -0.911 1 1 153 . 1 1 1 A 35 35 VAL C C 35 174.750 174.725 0.025 1 1 154 . 1 1 1 A 35 35 VAL CA C 35 62.310 60.320 1.990 1 1 155 . 1 1 1 A 35 35 VAL CB C 35 34.550 33.415 1.135 1 1 158 . 1 1 1 A 35 35 VAL N N 35 123.150 120.854 2.296 1 1 159 . 1 1 1 A 36 36 SER H H 36 8.240 8.749 -0.509 1 1 160 . 1 1 1 A 36 36 SER HA H 36 4.690 5.352 -0.662 1 1 163 . 1 1 1 A 36 36 SER C C 36 171.860 172.570 -0.710 1 1 164 . 1 1 1 A 36 36 SER CA C 36 56.020 57.822 -1.802 1 1 165 . 1 1 1 A 36 36 SER CB C 36 66.050 63.645 2.405 1 1 166 . 1 1 1 A 36 36 SER N N 36 118.760 121.546 -2.786 1 1 167 . 1 1 1 A 37 37 LEU H H 37 8.310 9.029 -0.719 1 1 168 . 1 1 1 A 37 37 LEU HA H 37 4.870 5.075 -0.205 1 1 178 . 1 1 1 A 37 37 LEU C C 37 174.190 175.140 -0.950 1 1 179 . 1 1 1 A 37 37 LEU CA C 37 53.870 53.588 0.282 1 1 180 . 1 1 1 A 37 37 LEU CB C 37 47.000 44.806 2.194 1 1 184 . 1 1 1 A 37 37 LEU N N 37 124.790 129.358 -4.568 1 1 185 . 1 1 1 A 38 38 GLU H H 38 9.270 8.854 0.416 1 1 186 . 1 1 1 A 38 38 GLU HA H 38 4.650 5.232 -0.582 1 1 191 . 1 1 1 A 38 38 GLU C C 38 173.970 175.344 -1.374 1 1 192 . 1 1 1 A 38 38 GLU CA C 38 54.410 55.041 -0.631 1 1 193 . 1 1 1 A 38 38 GLU CB C 38 32.460 32.548 -0.088 1 1 195 . 1 1 1 A 38 38 GLU N N 38 126.550 126.961 -0.411 1 1 196 . 1 1 1 A 39 39 ALA H H 39 8.120 8.489 -0.369 1 1 197 . 1 1 1 A 39 39 ALA HA H 39 4.600 4.678 -0.078 1 1 201 . 1 1 1 A 39 39 ALA C C 39 175.930 176.911 -0.981 1 1 202 . 1 1 1 A 39 39 ALA CA C 39 51.570 51.002 0.568 1 1 203 . 1 1 1 A 39 39 ALA CB C 39 21.780 23.149 -1.369 1 1 204 . 1 1 1 A 39 39 ALA N N 39 124.410 128.169 -3.759 1 1 205 . 1 1 1 A 40 40 LEU H H 40 7.860 8.976 -1.116 1 1 206 . 1 1 1 A 40 40 LEU HA H 40 4.230 3.940 0.290 1 1 216 . 1 1 1 A 40 40 LEU C C 40 175.940 176.472 -0.532 1 1 217 . 1 1 1 A 40 40 LEU CA C 40 55.360 56.563 -1.203 1 1 218 . 1 1 1 A 40 40 LEU CB C 40 42.990 42.555 0.435 1 1 222 . 1 1 1 A 40 40 LEU N N 40 120.640 121.198 -0.558 1 1 223 . 1 1 1 A 41 41 GLU H H 41 8.210 7.869 0.341 1 1 224 . 1 1 1 A 41 41 GLU HA H 41 4.240 4.071 0.169 1 1 229 . 1 1 1 A 41 41 GLU C C 41 176.920 175.014 1.906 1 1 230 . 1 1 1 A 41 41 GLU CA C 41 58.090 57.684 0.406 1 1 231 . 1 1 1 A 41 41 GLU CB C 41 30.530 27.086 3.444 1 1 233 . 1 1 1 A 41 41 GLU N N 41 114.680 116.478 -1.798 1 1 234 . 1 1 1 A 42 42 GLU H H 42 7.490 7.796 -0.306 1 1 235 . 1 1 1 A 42 42 GLU HA H 42 5.680 4.811 0.869 1 1 240 . 1 1 1 A 42 42 GLU C C 42 173.790 174.178 -0.388 1 1 241 . 1 1 1 A 42 42 GLU CA C 42 54.360 56.247 -1.887 1 1 242 . 1 1 1 A 42 42 GLU CB C 42 33.850 33.383 0.467 1 1 244 . 1 1 1 A 42 42 GLU N N 42 116.670 118.411 -1.741 1 1 245 . 1 1 1 A 43 43 VAL H H 43 8.550 8.464 0.086 1 1 246 . 1 1 1 A 43 43 VAL HA H 43 4.550 4.642 -0.092 1 1 254 . 1 1 1 A 43 43 VAL C C 43 172.220 173.766 -1.546 1 1 255 . 1 1 1 A 43 43 VAL CA C 43 59.470 60.528 -1.058 1 1 256 . 1 1 1 A 43 43 VAL CB C 43 35.470 34.560 0.910 1 1 259 . 1 1 1 A 43 43 VAL N N 43 120.030 125.079 -5.049 1 1 260 . 1 1 1 A 44 44 GLN H H 44 8.470 8.573 -0.103 1 1 261 . 1 1 1 A 44 44 GLN HA H 44 4.890 4.661 0.229 1 1 268 . 1 1 1 A 44 44 GLN C C 44 176.130 175.864 0.266 1 1 269 . 1 1 1 A 44 44 GLN CA C 44 54.360 55.686 -1.326 1 1 270 . 1 1 1 A 44 44 GLN CB C 44 30.610 29.034 1.576 1 1 272 . 1 1 1 A 44 44 GLN N N 44 124.690 130.172 -5.482 1 1 274 . 1 1 1 A 45 45 VAL H H 45 8.130 8.263 -0.133 1 1 275 . 1 1 1 A 45 45 VAL HA H 45 3.030 4.024 -0.994 1 1 283 . 1 1 1 A 45 45 VAL C C 45 176.710 177.124 -0.414 1 1 284 . 1 1 1 A 45 45 VAL CA C 45 65.810 64.904 0.906 1 1 285 . 1 1 1 A 45 45 VAL CB C 45 31.960 31.515 0.445 1 1 288 . 1 1 1 A 45 45 VAL N N 45 120.450 127.240 -6.790 1 1 289 . 1 1 1 A 46 46 GLY H H 46 8.950 9.762 -0.812 1 1 290 . 1 1 1 A 46 46 GLY HA2 H 46 3.590 3.988 -0.398 1 1 291 . 1 1 1 A 46 46 GLY HA3 H 46 4.410 3.990 0.420 1 1 292 . 1 1 1 A 46 46 GLY C C 46 174.390 173.763 0.627 1 1 293 . 1 1 1 A 46 46 GLY CA C 46 44.730 45.020 -0.290 1 1 294 . 1 1 1 A 46 46 GLY N N 46 116.490 115.235 1.255 1 1 295 . 1 1 1 A 47 47 GLU H H 47 8.260 7.645 0.615 1 1 296 . 1 1 1 A 47 47 GLU HA H 47 4.460 4.735 -0.275 1 1 301 . 1 1 1 A 47 47 GLU C C 47 174.780 175.592 -0.812 1 1 302 . 1 1 1 A 47 47 GLU CA C 47 54.830 54.779 0.051 1 1 303 . 1 1 1 A 47 47 GLU CB C 47 31.140 32.437 -1.297 1 1 305 . 1 1 1 A 47 47 GLU N N 47 120.520 121.489 -0.969 1 1 306 . 1 1 1 A 48 48 ASN H H 48 8.440 8.775 -0.335 1 1 307 . 1 1 1 A 48 48 ASN HA H 48 5.380 5.802 -0.422 1 1 312 . 1 1 1 A 48 48 ASN C C 48 174.770 174.363 0.407 1 1 313 . 1 1 1 A 48 48 ASN CA C 48 51.570 51.293 0.277 1 1 314 . 1 1 1 A 48 48 ASN CB C 48 39.010 41.918 -2.908 1 1 315 . 1 1 1 A 48 48 ASN N N 48 117.180 119.848 -2.668 1 1 317 . 1 1 1 A 49 49 LEU H H 49 9.810 7.962 1.848 1 1 318 . 1 1 1 A 49 49 LEU HA H 49 4.510 5.175 -0.665 1 1 328 . 1 1 1 A 49 49 LEU C C 49 174.560 176.068 -1.508 1 1 329 . 1 1 1 A 49 49 LEU CA C 49 53.460 53.212 0.248 1 1 330 . 1 1 1 A 49 49 LEU CB C 49 45.520 45.221 0.299 1 1 333 . 1 1 1 A 49 49 LEU N N 49 125.620 120.070 5.550 1 1 334 . 1 1 1 A 50 50 GLU H H 50 8.750 8.758 -0.008 1 1 335 . 1 1 1 A 50 50 GLU HA H 50 4.360 4.823 -0.463 1 1 340 . 1 1 1 A 50 50 GLU C C 50 175.340 174.853 0.487 1 1 341 . 1 1 1 A 50 50 GLU CA C 50 55.550 55.656 -0.106 1 1 342 . 1 1 1 A 50 50 GLU CB C 50 29.890 31.696 -1.806 1 1 344 . 1 1 1 A 50 50 GLU N N 50 125.420 122.619 2.801 1 1 345 . 1 1 1 A 51 51 VAL H H 51 9.230 8.735 0.495 1 1 346 . 1 1 1 A 51 51 VAL HA H 51 4.190 4.807 -0.617 1 1 354 . 1 1 1 A 51 51 VAL C C 51 175.310 174.561 0.749 1 1 355 . 1 1 1 A 51 51 VAL CA C 51 62.520 60.985 1.535 1 1 356 . 1 1 1 A 51 51 VAL CB C 51 31.470 32.879 -1.409 1 1 359 . 1 1 1 A 51 51 VAL N N 51 129.810 122.962 6.848 1 1 360 . 1 1 1 A 52 52 GLY H H 52 9.410 8.382 1.028 1 1 361 . 1 1 1 A 52 52 GLY HA2 H 52 3.460 3.866 -0.406 1 1 362 . 1 1 1 A 52 52 GLY HA3 H 52 4.680 3.887 0.793 1 1 363 . 1 1 1 A 52 52 GLY C C 52 173.000 173.208 -0.208 1 1 364 . 1 1 1 A 52 52 GLY CA C 52 46.470 47.281 -0.811 1 1 365 . 1 1 1 A 52 52 GLY N N 52 116.600 112.961 3.639 1 1 366 . 1 1 1 A 53 53 VAL H H 53 9.130 8.736 0.394 1 1 367 . 1 1 1 A 53 53 VAL HA H 53 4.840 4.932 -0.092 1 1 375 . 1 1 1 A 53 53 VAL C C 53 175.470 175.208 0.262 1 1 376 . 1 1 1 A 53 53 VAL CA C 53 61.350 61.467 -0.117 1 1 377 . 1 1 1 A 53 53 VAL CB C 53 34.300 31.655 2.645 1 1 380 . 1 1 1 A 53 53 VAL N N 53 129.050 123.561 5.489 1 1 381 . 1 1 1 A 54 54 GLY H H 54 8.420 8.718 -0.298 1 1 382 . 1 1 1 A 54 54 GLY HA2 H 54 3.850 3.629 0.221 1 1 383 . 1 1 1 A 54 54 GLY HA3 H 54 3.850 3.867 -0.017 1 1 384 . 1 1 1 A 54 54 GLY C C 54 173.310 172.878 0.432 1 1 385 . 1 1 1 A 54 54 GLY CA C 54 45.180 44.312 0.868 1 1 386 . 1 1 1 A 54 54 GLY N N 54 116.890 115.276 1.614 1 1 387 . 1 1 1 A 55 55 ILE H H 55 10.190 8.265 1.925 1 1 388 . 1 1 1 A 55 55 ILE HA H 55 4.010 5.014 -1.004 1 1 398 . 1 1 1 A 55 55 ILE C C 55 174.380 174.993 -0.613 1 1 399 . 1 1 1 A 55 55 ILE CA C 55 61.350 59.705 1.645 1 1 400 . 1 1 1 A 55 55 ILE CB C 55 40.840 40.971 -0.131 1 1 404 . 1 1 1 A 55 55 ILE N N 55 129.330 121.657 7.673 1 1 405 . 1 1 1 A 56 56 ASP H H 56 8.810 9.553 -0.743 1 1 406 . 1 1 1 A 56 56 ASP HA H 56 4.440 5.262 -0.822 1 1 409 . 1 1 1 A 56 56 ASP C C 56 175.530 176.204 -0.674 1 1 410 . 1 1 1 A 56 56 ASP CA C 56 56.460 55.575 0.885 1 1 411 . 1 1 1 A 56 56 ASP CB C 56 42.720 43.289 -0.569 1 1 412 . 1 1 1 A 56 56 ASP N N 56 128.310 126.827 1.483 1 1 413 . 1 1 1 A 57 57 GLU H H 57 7.270 7.483 -0.213 1 1 414 . 1 1 1 A 57 57 GLU HA H 57 4.290 4.833 -0.543 1 1 419 . 1 1 1 A 57 57 GLU C C 57 173.370 174.422 -1.052 1 1 420 . 1 1 1 A 57 57 GLU CA C 57 54.840 55.484 -0.644 1 1 421 . 1 1 1 A 57 57 GLU CB C 57 33.190 33.486 -0.296 1 1 423 . 1 1 1 A 57 57 GLU N N 57 112.810 116.709 -3.899 1 1 424 . 1 1 1 A 58 58 LEU H H 58 8.370 8.574 -0.204 1 1 425 . 1 1 1 A 58 58 LEU HA H 58 4.830 4.685 0.145 1 1 434 . 1 1 1 A 58 58 LEU C C 58 174.180 174.582 -0.402 1 1 435 . 1 1 1 A 58 58 LEU CA C 58 55.320 54.772 0.548 1 1 436 . 1 1 1 A 58 58 LEU CB C 58 44.300 43.073 1.227 1 1 439 . 1 1 1 A 58 58 LEU N N 58 123.130 125.117 -1.987 1 1 440 . 1 1 1 A 59 59 VAL H H 59 9.120 8.847 0.273 1 1 441 . 1 1 1 A 59 59 VAL HA H 59 4.240 4.553 -0.313 1 1 449 . 1 1 1 A 59 59 VAL C C 59 174.960 175.564 -0.604 1 1 450 . 1 1 1 A 59 59 VAL CA C 59 61.760 59.732 2.028 1 1 451 . 1 1 1 A 59 59 VAL CB C 59 33.760 33.614 0.146 1 1 454 . 1 1 1 A 59 59 VAL N N 59 127.930 126.130 1.800 1 1 455 . 1 1 1 A 60 60 ASN H H 60 8.770 8.685 0.085 1 1 456 . 1 1 1 A 60 60 ASN HA H 60 4.250 4.362 -0.112 1 1 461 . 1 1 1 A 60 60 ASN C C 60 172.810 173.905 -1.095 1 1 462 . 1 1 1 A 60 60 ASN CA C 60 54.830 54.548 0.282 1 1 463 . 1 1 1 A 60 60 ASN CB C 60 36.030 37.011 -0.981 1 1 464 . 1 1 1 A 60 60 ASN N N 60 115.500 123.071 -7.571 1 1 466 . 1 1 1 A 61 61 ALA H H 61 7.330 7.296 0.034 1 1 467 . 1 1 1 A 61 61 ALA HA H 61 4.520 4.539 -0.019 1 1 471 . 1 1 1 A 61 61 ALA C C 61 174.580 174.949 -0.369 1 1 472 . 1 1 1 A 61 61 ALA CA C 61 51.560 50.967 0.593 1 1 473 . 1 1 1 A 61 61 ALA CB C 61 22.870 22.363 0.507 1 1 474 . 1 1 1 A 61 61 ALA N N 61 115.640 118.602 -2.962 1 1 475 . 1 1 1 A 62 62 GLU H H 62 7.900 9.646 -1.746 1 1 476 . 1 1 1 A 62 62 GLU HA H 62 4.310 4.614 -0.304 1 1 481 . 1 1 1 A 62 62 GLU C C 62 173.790 175.182 -1.392 1 1 482 . 1 1 1 A 62 62 GLU CA C 62 55.080 55.023 0.057 1 1 483 . 1 1 1 A 62 62 GLU CB C 62 32.610 30.026 2.584 1 1 485 . 1 1 1 A 62 62 GLU N N 62 117.400 123.158 -5.758 1 1 486 . 1 1 1 A 63 63 ALA H H 63 8.910 8.768 0.142 1 1 487 . 1 1 1 A 63 63 ALA HA H 63 4.690 4.483 0.207 1 1 491 . 1 1 1 A 63 63 ALA C C 63 175.720 176.989 -1.269 1 1 492 . 1 1 1 A 63 63 ALA CA C 63 50.600 53.323 -2.723 1 1 493 . 1 1 1 A 63 63 ALA CB C 63 20.660 19.300 1.360 1 1 494 . 1 1 1 A 63 63 ALA N N 63 122.480 129.597 -7.117 1 1 495 . 1 1 1 A 64 64 PHE H H 64 9.220 8.932 0.288 1 1 496 . 1 1 1 A 64 64 PHE HA H 64 4.320 4.742 -0.422 1 1 501 . 1 1 1 A 64 64 PHE C C 64 174.380 175.961 -1.581 1 1 502 . 1 1 1 A 64 64 PHE CA C 64 59.770 58.896 0.874 1 1 503 . 1 1 1 A 64 64 PHE CB C 64 40.830 41.424 -0.594 1 1 504 . 1 1 1 A 64 64 PHE N N 64 120.870 122.456 -1.586 1 1 505 . 1 1 1 A 65 65 ALA H H 65 8.150 7.974 0.176 1 1 506 . 1 1 1 A 65 65 ALA HA H 65 5.280 4.857 0.423 1 1 510 . 1 1 1 A 65 65 ALA C C 65 175.950 175.583 0.367 1 1 511 . 1 1 1 A 65 65 ALA CA C 65 51.120 50.983 0.137 1 1 512 . 1 1 1 A 65 65 ALA CB C 65 22.850 21.721 1.129 1 1 513 . 1 1 1 A 65 65 ALA N N 65 122.350 120.278 2.072 1 1 514 . 1 1 1 A 66 66 TYR H H 66 9.260 9.282 -0.022 1 1 515 . 1 1 1 A 66 66 TYR HA H 66 5.710 4.945 0.765 1 1 520 . 1 1 1 A 66 66 TYR C C 66 175.690 174.576 1.114 1 1 521 . 1 1 1 A 66 66 TYR CA C 66 54.390 58.498 -4.108 1 1 522 . 1 1 1 A 66 66 TYR CB C 66 41.560 39.945 1.615 1 1 523 . 1 1 1 A 66 66 TYR N N 66 124.350 126.672 -2.322 1 1 524 . 1 1 1 A 67 67 ASP H H 67 9.070 8.601 0.469 1 1 525 . 1 1 1 A 67 67 ASP HA H 67 5.630 5.466 0.164 1 1 528 . 1 1 1 A 67 67 ASP C C 67 174.300 174.422 -0.122 1 1 529 . 1 1 1 A 67 67 ASP CA C 67 51.590 53.263 -1.673 1 1 530 . 1 1 1 A 67 67 ASP CB C 67 44.380 43.529 0.851 1 1 531 . 1 1 1 A 67 67 ASP N N 67 130.490 126.126 4.364 1 1 532 . 1 1 1 A 68 68 PHE H H 68 8.670 8.316 0.354 1 1 533 . 1 1 1 A 68 68 PHE HA H 68 4.890 5.443 -0.553 1 1 538 . 1 1 1 A 68 68 PHE C C 68 172.220 173.437 -1.217 1 1 539 . 1 1 1 A 68 68 PHE CA C 68 57.360 55.160 2.200 1 1 540 . 1 1 1 A 68 68 PHE CB C 68 40.360 41.895 -1.535 1 1 541 . 1 1 1 A 68 68 PHE N N 68 118.200 119.759 -1.559 1 1 542 . 1 1 1 A 69 69 THR H H 69 8.390 8.524 -0.134 1 1 543 . 1 1 1 A 69 69 THR HA H 69 5.170 5.299 -0.129 1 1 548 . 1 1 1 A 69 69 THR C C 69 172.620 173.689 -1.069 1 1 549 . 1 1 1 A 69 69 THR CA C 69 61.370 61.490 -0.120 1 1 550 . 1 1 1 A 69 69 THR CB C 69 64.880 70.860 -5.980 1 1 552 . 1 1 1 A 69 69 THR N N 69 115.810 114.292 1.518 1 1 553 . 1 1 1 A 70 70 LEU H H 70 9.560 9.068 0.492 1 1 554 . 1 1 1 A 70 70 LEU HA H 70 5.270 4.636 0.634 1 1 564 . 1 1 1 A 70 70 LEU C C 70 173.800 175.313 -1.513 1 1 565 . 1 1 1 A 70 70 LEU CA C 70 53.460 55.663 -2.203 1 1 566 . 1 1 1 A 70 70 LEU CB C 70 45.040 43.077 1.963 1 1 570 . 1 1 1 A 70 70 LEU N N 70 129.220 130.316 -1.096 1 1 571 . 1 1 1 A 71 71 ASN H H 71 9.590 8.634 0.956 1 1 572 . 1 1 1 A 71 71 ASN HA H 71 5.880 5.842 0.038 1 1 577 . 1 1 1 A 71 71 ASN C C 71 177.970 174.220 3.750 1 1 578 . 1 1 1 A 71 71 ASN CA C 71 52.060 52.064 -0.004 1 1 579 . 1 1 1 A 71 71 ASN CB C 71 41.020 41.069 -0.049 1 1 580 . 1 1 1 A 71 71 ASN N N 71 125.970 123.576 2.394 1 1 582 . 1 1 1 A 72 72 TYR H H 72 8.740 8.821 -0.081 1 1 583 . 1 1 1 A 72 72 TYR HA H 72 5.110 5.275 -0.165 1 1 588 . 1 1 1 A 72 72 TYR C C 72 177.720 173.781 3.939 1 1 589 . 1 1 1 A 72 72 TYR CA C 72 55.310 55.203 0.107 1 1 590 . 1 1 1 A 72 72 TYR CB C 72 41.510 41.345 0.165 1 1 591 . 1 1 1 A 72 72 TYR N N 72 119.640 120.559 -0.919 1 1 592 . 1 1 1 A 73 73 ASP H H 73 9.780 9.063 0.717 1 1 593 . 1 1 1 A 73 73 ASP HA H 73 4.680 4.841 -0.161 1 1 596 . 1 1 1 A 73 73 ASP C C 73 177.290 177.058 0.232 1 1 597 . 1 1 1 A 73 73 ASP CA C 73 53.650 53.987 -0.337 1 1 598 . 1 1 1 A 73 73 ASP CB C 73 40.900 42.346 -1.446 1 1 599 . 1 1 1 A 73 73 ASP N N 73 119.290 119.852 -0.562 1 1 600 . 1 1 1 A 74 74 GLU H H 74 9.430 8.684 0.746 1 1 601 . 1 1 1 A 74 74 GLU HA H 74 4.740 4.294 0.446 1 1 606 . 1 1 1 A 74 74 GLU C C 74 176.320 178.372 -2.052 1 1 607 . 1 1 1 A 74 74 GLU CA C 74 57.410 58.994 -1.584 1 1 608 . 1 1 1 A 74 74 GLU CB C 74 29.490 29.425 0.065 1 1 610 . 1 1 1 A 74 74 GLU N N 74 130.930 123.292 7.638 1 1 611 . 1 1 1 A 75 75 ASN H H 75 8.680 8.856 -0.176 1 1 612 . 1 1 1 A 75 75 ASN HA H 75 4.600 4.524 0.076 1 1 617 . 1 1 1 A 75 75 ASN C C 75 175.340 176.789 -1.449 1 1 618 . 1 1 1 A 75 75 ASN CA C 75 54.620 55.763 -1.143 1 1 619 . 1 1 1 A 75 75 ASN CB C 75 38.770 37.093 1.677 1 1 620 . 1 1 1 A 75 75 ASN N N 75 115.040 118.082 -3.042 1 1 622 . 1 1 1 A 76 76 ALA H H 76 7.740 7.740 0.000 1 1 623 . 1 1 1 A 76 76 ALA HA H 76 4.310 4.437 -0.127 1 1 627 . 1 1 1 A 76 76 ALA C C 76 175.550 176.657 -1.107 1 1 628 . 1 1 1 A 76 76 ALA CA C 76 53.260 53.554 -0.294 1 1 629 . 1 1 1 A 76 76 ALA CB C 76 21.450 20.470 0.980 1 1 630 . 1 1 1 A 76 76 ALA N N 76 122.200 120.479 1.721 1 1 631 . 1 1 1 A 77 77 PHE H H 77 8.070 8.137 -0.067 1 1 632 . 1 1 1 A 77 77 PHE HA H 77 5.650 5.237 0.413 1 1 637 . 1 1 1 A 77 77 PHE C C 77 174.570 175.479 -0.909 1 1 638 . 1 1 1 A 77 77 PHE CA C 77 56.360 57.488 -1.128 1 1 639 . 1 1 1 A 77 77 PHE CB C 77 46.080 41.060 5.020 1 1 640 . 1 1 1 A 77 77 PHE N N 77 114.160 113.768 0.392 1 1 641 . 1 1 1 A 78 78 GLU H H 78 8.800 8.764 0.036 1 1 642 . 1 1 1 A 78 78 GLU HA H 78 4.900 5.056 -0.156 1 1 647 . 1 1 1 A 78 78 GLU C C 78 175.950 174.914 1.036 1 1 648 . 1 1 1 A 78 78 GLU CA C 78 53.670 55.866 -2.196 1 1 649 . 1 1 1 A 78 78 GLU CB C 78 33.600 33.075 0.525 1 1 651 . 1 1 1 A 78 78 GLU N N 78 117.590 120.320 -2.730 1 1 652 . 1 1 1 A 79 79 TYR H H 79 8.770 9.154 -0.384 1 1 653 . 1 1 1 A 79 79 TYR HA H 79 4.250 4.082 0.168 1 1 658 . 1 1 1 A 79 79 TYR C C 79 174.580 174.916 -0.336 1 1 659 . 1 1 1 A 79 79 TYR CA C 79 59.250 59.555 -0.305 1 1 660 . 1 1 1 A 79 79 TYR CB C 79 38.310 39.205 -0.895 1 1 661 . 1 1 1 A 79 79 TYR N N 79 126.560 128.295 -1.735 1 1 662 . 1 1 1 A 80 80 VAL H H 80 8.220 8.441 -0.221 1 1 663 . 1 1 1 A 80 80 VAL HA H 80 3.690 3.845 -0.155 1 1 671 . 1 1 1 A 80 80 VAL C C 80 174.780 174.741 0.039 1 1 672 . 1 1 1 A 80 80 VAL CA C 80 64.400 62.936 1.464 1 1 673 . 1 1 1 A 80 80 VAL CB C 80 33.510 32.938 0.572 1 1 676 . 1 1 1 A 80 80 VAL N N 80 129.460 125.187 4.273 1 1 677 . 1 1 1 A 81 81 GLU H H 81 6.920 7.505 -0.585 1 1 678 . 1 1 1 A 81 81 GLU HA H 81 4.260 4.656 -0.396 1 1 683 . 1 1 1 A 81 81 GLU C C 81 171.840 175.707 -3.867 1 1 684 . 1 1 1 A 81 81 GLU CA C 81 55.310 55.047 0.263 1 1 685 . 1 1 1 A 81 81 GLU CB C 81 30.520 33.442 -2.922 1 1 687 . 1 1 1 A 81 81 GLU N N 81 112.430 117.133 -4.703 1 1 688 . 1 1 1 A 82 82 ALA H H 82 8.310 8.633 -0.323 1 1 689 . 1 1 1 A 82 82 ALA HA H 82 5.650 4.967 0.683 1 1 693 . 1 1 1 A 82 82 ALA C C 82 176.110 177.100 -0.990 1 1 694 . 1 1 1 A 82 82 ALA CA C 82 50.620 51.994 -1.374 1 1 695 . 1 1 1 A 82 82 ALA CB C 82 21.770 20.066 1.704 1 1 696 . 1 1 1 A 82 82 ALA N N 82 121.240 125.838 -4.598 1 1 697 . 1 1 1 A 83 83 ILE H H 83 9.150 9.323 -0.173 1 1 698 . 1 1 1 A 83 83 ILE HA H 83 4.600 5.036 -0.436 1 1 708 . 1 1 1 A 83 83 ILE C C 83 174.810 174.684 0.126 1 1 709 . 1 1 1 A 83 83 ILE CA C 83 60.060 59.014 1.046 1 1 710 . 1 1 1 A 83 83 ILE CB C 83 42.440 42.814 -0.374 1 1 714 . 1 1 1 A 83 83 ILE N N 83 119.720 118.461 1.259 1 1 715 . 1 1 1 A 84 84 SER H H 84 8.350 8.666 -0.316 1 1 716 . 1 1 1 A 84 84 SER HA H 84 4.660 4.910 -0.250 1 1 719 . 1 1 1 A 84 84 SER C C 84 177.550 172.214 5.336 1 1 720 . 1 1 1 A 84 84 SER CA C 84 57.330 56.001 1.329 1 1 721 . 1 1 1 A 84 84 SER CB C 84 66.490 65.077 1.413 1 1 722 . 1 1 1 A 84 84 SER N N 84 116.740 117.226 -0.486 1 1 723 . 1 1 1 A 85 85 ASP H H 85 8.740 8.653 0.087 1 1 724 . 1 1 1 A 85 85 ASP HA H 85 4.820 4.716 0.104 1 1 727 . 1 1 1 A 85 85 ASP C C 85 176.090 176.075 0.015 1 1 728 . 1 1 1 A 85 85 ASP CA C 85 53.480 52.910 0.570 1 1 729 . 1 1 1 A 85 85 ASP CB C 85 42.480 42.635 -0.155 1 1 730 . 1 1 1 A 85 85 ASP N N 85 120.960 122.002 -1.042 1 1 731 . 1 1 1 A 86 86 ASP H H 86 8.380 8.845 -0.465 1 1 732 . 1 1 1 A 86 86 ASP HA H 86 4.450 4.902 -0.452 1 1 735 . 1 1 1 A 86 86 ASP C C 86 177.100 176.733 0.367 1 1 736 . 1 1 1 A 86 86 ASP CA C 86 56.240 54.127 2.113 1 1 737 . 1 1 1 A 86 86 ASP CB C 86 41.100 41.251 -0.151 1 1 738 . 1 1 1 A 86 86 ASP N N 86 117.710 121.274 -3.564 1 1 739 . 1 1 1 A 87 87 GLY H H 87 8.690 7.620 1.070 1 1 740 . 1 1 1 A 87 87 GLY HA2 H 87 3.870 4.086 -0.216 1 1 741 . 1 1 1 A 87 87 GLY HA3 H 87 4.090 4.091 -0.001 1 1 742 . 1 1 1 A 87 87 GLY C C 87 173.800 174.162 -0.362 1 1 743 . 1 1 1 A 87 87 GLY CA C 87 45.770 45.643 0.127 1 1 744 . 1 1 1 A 87 87 GLY N N 87 108.540 107.532 1.008 1 1 745 . 1 1 1 A 88 88 VAL H H 88 7.910 7.675 0.235 1 1 746 . 1 1 1 A 88 88 VAL HA H 88 4.780 4.146 0.634 1 1 754 . 1 1 1 A 88 88 VAL C C 88 173.970 175.577 -1.607 1 1 755 . 1 1 1 A 88 88 VAL CA C 88 60.900 62.670 -1.770 1 1 756 . 1 1 1 A 88 88 VAL CB C 88 35.460 32.778 2.682 1 1 759 . 1 1 1 A 88 88 VAL N N 88 119.790 120.561 -0.771 1 1 760 . 1 1 1 A 89 89 PHE H H 89 9.210 9.639 -0.429 1 1 761 . 1 1 1 A 89 89 PHE HA H 89 4.930 5.081 -0.151 1 1 766 . 1 1 1 A 89 89 PHE C C 89 173.970 174.209 -0.239 1 1 767 . 1 1 1 A 89 89 PHE CA C 89 56.450 56.539 -0.089 1 1 768 . 1 1 1 A 89 89 PHE CB C 89 41.120 40.747 0.373 1 1 769 . 1 1 1 A 89 89 PHE N N 89 126.780 127.741 -0.961 1 1 770 . 1 1 1 A 90 90 VAL H H 90 7.880 8.842 -0.962 1 1 771 . 1 1 1 A 90 90 VAL HA H 90 4.860 5.085 -0.225 1 1 779 . 1 1 1 A 90 90 VAL C C 90 173.190 175.038 -1.848 1 1 780 . 1 1 1 A 90 90 VAL CA C 90 59.750 61.148 -1.398 1 1 781 . 1 1 1 A 90 90 VAL CB C 90 34.770 33.941 0.829 1 1 784 . 1 1 1 A 90 90 VAL N N 90 124.990 126.834 -1.844 1 1 785 . 1 1 1 A 91 91 ASN H H 91 8.670 8.824 -0.154 1 1 786 . 1 1 1 A 91 91 ASN HA H 91 4.730 5.378 -0.648 1 1 791 . 1 1 1 A 91 91 ASN C C 91 173.200 174.222 -1.022 1 1 792 . 1 1 1 A 91 91 ASN CA C 91 51.970 51.800 0.170 1 1 793 . 1 1 1 A 91 91 ASN CB C 91 41.340 42.041 -0.701 1 1 794 . 1 1 1 A 91 91 ASN N N 91 124.860 124.598 0.262 1 1 796 . 1 1 1 A 92 92 ALA H H 92 8.840 9.088 -0.248 1 1 797 . 1 1 1 A 92 92 ALA HA H 92 5.290 5.512 -0.222 1 1 801 . 1 1 1 A 92 92 ALA C C 92 176.330 176.162 0.168 1 1 802 . 1 1 1 A 92 92 ALA CA C 92 50.170 50.781 -0.611 1 1 803 . 1 1 1 A 92 92 ALA CB C 92 23.610 21.457 2.153 1 1 804 . 1 1 1 A 92 92 ALA N N 92 128.510 127.783 0.727 1 1 805 . 1 1 1 A 93 93 LYS H H 93 8.670 9.641 -0.971 1 1 806 . 1 1 1 A 93 93 LYS HA H 93 4.460 4.849 -0.389 1 1 815 . 1 1 1 A 93 93 LYS C C 93 174.170 175.119 -0.949 1 1 816 . 1 1 1 A 93 93 LYS CA C 93 55.010 54.689 0.321 1 1 817 . 1 1 1 A 93 93 LYS CB C 93 36.430 35.600 0.830 1 1 821 . 1 1 1 A 93 93 LYS N N 93 121.300 122.202 -0.902 1 1 822 . 1 1 1 A 94 94 LYS H H 94 8.960 8.624 0.336 1 1 823 . 1 1 1 A 94 94 LYS HA H 94 4.460 4.129 0.331 1 1 832 . 1 1 1 A 94 94 LYS C C 94 176.330 176.928 -0.598 1 1 833 . 1 1 1 A 94 94 LYS CA C 94 56.720 56.626 0.094 1 1 834 . 1 1 1 A 94 94 LYS CB C 94 31.930 32.692 -0.762 1 1 837 . 1 1 1 A 94 94 LYS N N 94 127.060 127.305 -0.245 1 1 838 . 1 1 1 A 95 95 ILE H H 95 8.290 8.683 -0.393 1 1 839 . 1 1 1 A 95 95 ILE HA H 95 4.120 4.153 -0.033 1 1 849 . 1 1 1 A 95 95 ILE C C 95 175.740 175.099 0.641 1 1 850 . 1 1 1 A 95 95 ILE CA C 95 62.760 62.633 0.127 1 1 851 . 1 1 1 A 95 95 ILE CB C 95 38.890 39.182 -0.292 1 1 855 . 1 1 1 A 95 95 ILE N N 95 126.530 128.129 -1.599 1 1 856 . 1 1 1 A 96 96 GLU H H 96 8.030 7.344 0.686 1 1 857 . 1 1 1 A 96 96 GLU HA H 96 4.450 4.667 -0.217 1 1 862 . 1 1 1 A 96 96 GLU C C 96 174.380 174.643 -0.263 1 1 863 . 1 1 1 A 96 96 GLU CA C 96 54.320 55.021 -0.701 1 1 864 . 1 1 1 A 96 96 GLU CB C 96 32.770 33.621 -0.851 1 1 866 . 1 1 1 A 96 96 GLU N N 96 117.080 118.903 -1.823 1 1 867 . 1 1 1 A 97 97 ASP H H 97 8.730 8.770 -0.040 1 1 868 . 1 1 1 A 97 97 ASP HA H 97 4.360 4.474 -0.114 1 1 871 . 1 1 1 A 97 97 ASP C C 97 177.100 177.340 -0.240 1 1 872 . 1 1 1 A 97 97 ASP CA C 97 57.160 55.651 1.509 1 1 873 . 1 1 1 A 97 97 ASP CB C 97 39.920 40.400 -0.480 1 1 874 . 1 1 1 A 97 97 ASP N N 97 120.570 120.507 0.063 1 1 875 . 1 1 1 A 98 98 GLY H H 98 8.760 8.470 0.290 1 1 876 . 1 1 1 A 98 98 GLY HA2 H 98 2.120 1.422 0.698 1 1 877 . 1 1 1 A 98 98 GLY HA3 H 98 3.910 3.363 0.547 1 1 878 . 1 1 1 A 98 98 GLY C C 98 174.000 172.920 1.080 1 1 879 . 1 1 1 A 98 98 GLY CA C 98 45.720 45.186 0.534 1 1 880 . 1 1 1 A 98 98 GLY N N 98 112.090 111.542 0.548 1 1 881 . 1 1 1 A 99 99 LYS H H 99 7.890 7.206 0.684 1 1 882 . 1 1 1 A 99 99 LYS HA H 99 5.330 5.119 0.211 1 1 891 . 1 1 1 A 99 99 LYS C C 99 174.750 174.356 0.394 1 1 892 . 1 1 1 A 99 99 LYS CA C 99 55.990 54.828 1.162 1 1 893 . 1 1 1 A 99 99 LYS CB C 99 37.840 35.464 2.376 1 1 897 . 1 1 1 A 99 99 LYS N N 99 118.050 114.825 3.225 1 1 898 . 1 1 1 A 100 100 VAL H H 100 8.980 8.453 0.527 1 1 899 . 1 1 1 A 100 100 VAL HA H 100 4.510 4.763 -0.253 1 1 907 . 1 1 1 A 100 100 VAL C C 100 174.760 173.750 1.010 1 1 908 . 1 1 1 A 100 100 VAL CA C 100 60.130 59.046 1.084 1 1 909 . 1 1 1 A 100 100 VAL CB C 100 35.240 35.807 -0.567 1 1 912 . 1 1 1 A 100 100 VAL N N 100 123.850 119.751 4.099 1 1 913 . 1 1 1 A 101 101 ARG H H 101 8.810 8.297 0.513 1 1 914 . 1 1 1 A 101 101 ARG HA H 101 4.850 4.976 -0.126 1 1 921 . 1 1 1 A 101 101 ARG C C 101 174.770 174.454 0.316 1 1 922 . 1 1 1 A 101 101 ARG CA C 101 54.580 54.788 -0.208 1 1 923 . 1 1 1 A 101 101 ARG CB C 101 32.400 31.648 0.752 1 1 926 . 1 1 1 A 101 101 ARG N N 101 129.210 123.062 6.148 1 1 927 . 1 1 1 A 102 102 VAL H H 102 9.100 8.313 0.787 1 1 928 . 1 1 1 A 102 102 VAL HA H 102 4.120 5.020 -0.900 1 1 936 . 1 1 1 A 102 102 VAL C C 102 171.640 173.535 -1.895 1 1 937 . 1 1 1 A 102 102 VAL CA C 102 61.350 59.188 2.162 1 1 938 . 1 1 1 A 102 102 VAL CB C 102 32.530 35.129 -2.599 1 1 941 . 1 1 1 A 102 102 VAL N N 102 130.470 123.161 7.309 1 1 942 . 1 1 1 A 103 103 LEU H H 103 8.110 9.546 -1.436 1 1 943 . 1 1 1 A 103 103 LEU HA H 103 5.120 5.060 0.060 1 1 953 . 1 1 1 A 103 103 LEU C C 103 176.410 175.521 0.889 1 1 954 . 1 1 1 A 103 103 LEU CA C 103 53.380 53.452 -0.072 1 1 955 . 1 1 1 A 103 103 LEU CB C 103 43.680 43.141 0.539 1 1 959 . 1 1 1 A 103 103 LEU N N 103 125.560 128.295 -2.735 1 1 960 . 1 1 1 A 104 104 VAL H H 104 9.580 9.491 0.089 1 1 961 . 1 1 1 A 104 104 VAL HA H 104 5.260 5.050 0.210 1 1 969 . 1 1 1 A 104 104 VAL C C 104 176.030 174.850 1.180 1 1 970 . 1 1 1 A 104 104 VAL CA C 104 60.220 61.281 -1.061 1 1 971 . 1 1 1 A 104 104 VAL CB C 104 34.310 33.568 0.742 1 1 974 . 1 1 1 A 104 104 VAL N N 104 125.790 127.029 -1.239 1 1 975 . 1 1 1 A 105 105 SER H H 105 9.340 8.606 0.734 1 1 976 . 1 1 1 A 105 105 SER HA H 105 5.300 5.103 0.197 1 1 979 . 1 1 1 A 105 105 SER C C 105 173.600 172.964 0.636 1 1 980 . 1 1 1 A 105 105 SER CA C 105 57.450 57.451 -0.001 1 1 981 . 1 1 1 A 105 105 SER CB C 105 65.600 66.866 -1.266 1 1 982 . 1 1 1 A 105 105 SER N N 105 119.220 119.882 -0.662 1 1 983 . 1 1 1 A 106 106 SER H H 106 8.350 9.075 -0.725 1 1 984 . 1 1 1 A 106 106 SER HA H 106 4.720 4.582 0.138 1 1 987 . 1 1 1 A 106 106 SER C C 106 176.930 174.399 2.531 1 1 988 . 1 1 1 A 106 106 SER CA C 106 58.170 58.805 -0.635 1 1 989 . 1 1 1 A 106 106 SER CB C 106 64.170 63.232 0.938 1 1 990 . 1 1 1 A 106 106 SER N N 106 114.800 120.283 -5.483 1 1 991 . 1 1 1 A 107 107 LEU H H 107 8.770 8.361 0.409 1 1 992 . 1 1 1 A 107 107 LEU HA H 107 4.710 4.614 0.096 1 1 1001 . 1 1 1 A 107 107 LEU C C 107 178.280 177.398 0.882 1 1 1002 . 1 1 1 A 107 107 LEU CA C 107 55.280 54.318 0.962 1 1 1003 . 1 1 1 A 107 107 LEU CB C 107 43.410 41.199 2.211 1 1 1007 . 1 1 1 A 107 107 LEU N N 107 127.210 127.900 -0.690 1 1 1008 . 1 1 1 A 108 108 THR H H 108 8.210 7.770 0.440 1 1 1009 . 1 1 1 A 108 108 THR HA H 108 4.400 4.592 -0.192 1 1 1015 . 1 1 1 A 108 108 THR C C 108 176.130 175.509 0.621 1 1 1016 . 1 1 1 A 108 108 THR CA C 108 62.050 62.227 -0.177 1 1 1017 . 1 1 1 A 108 108 THR CB C 108 70.910 71.135 -0.225 1 1 1019 . 1 1 1 A 108 108 THR N N 108 108.810 112.097 -3.287 1 1 1020 . 1 1 1 A 109 109 GLY H H 109 8.250 7.944 0.306 1 1 1021 . 1 1 1 A 109 109 GLY HA2 H 109 3.780 4.060 -0.280 1 1 1022 . 1 1 1 A 109 109 GLY HA3 H 109 4.290 4.072 0.218 1 1 1023 . 1 1 1 A 109 109 GLY C C 109 173.180 174.183 -1.003 1 1 1024 . 1 1 1 A 109 109 GLY CA C 109 45.340 45.280 0.060 1 1 1025 . 1 1 1 A 109 109 GLY N N 109 110.160 110.679 -0.519 1 1 1026 . 1 1 1 A 110 110 GLU H H 110 7.960 7.445 0.515 1 1 1027 . 1 1 1 A 110 110 GLU HA H 110 4.760 4.878 -0.118 1 1 1032 . 1 1 1 A 110 110 GLU CA C 110 53.450 53.869 -0.419 1 1 1033 . 1 1 1 A 110 110 GLU CB C 110 30.020 31.279 -1.259 1 1 1035 . 1 1 1 A 110 110 GLU N N 110 119.720 117.359 2.361 1 1 1036 . 1 1 1 A 111 111 PRO HA H 111 3.250 4.201 -0.951 1 1 1043 . 1 1 1 A 111 111 PRO C C 111 176.710 176.676 0.034 1 1 1044 . 1 1 1 A 111 111 PRO CA C 111 62.240 62.023 0.217 1 1 1045 . 1 1 1 A 111 111 PRO CB C 111 31.990 31.509 0.481 1 1 1048 . 1 1 1 A 112 112 LEU H H 112 8.840 8.170 0.670 1 1 1049 . 1 1 1 A 112 112 LEU HA H 112 4.290 4.305 -0.015 1 1 1059 . 1 1 1 A 112 112 LEU CA C 112 52.220 53.203 -0.983 1 1 1060 . 1 1 1 A 112 112 LEU CB C 112 41.090 42.180 -1.090 1 1 1063 . 1 1 1 A 112 112 LEU N N 112 122.420 120.147 2.273 1 1 1064 . 1 1 1 A 113 113 PRO HA H 113 4.380 4.728 -0.348 1 1 1071 . 1 1 1 A 113 113 PRO C C 113 176.100 176.382 -0.282 1 1 1072 . 1 1 1 A 113 113 PRO CA C 113 61.930 62.164 -0.234 1 1 1073 . 1 1 1 A 113 113 PRO CB C 113 32.470 32.495 -0.025 1 1 1076 . 1 1 1 A 114 114 ALA H H 114 8.070 8.197 -0.127 1 1 1077 . 1 1 1 A 114 114 ALA HA H 114 4.550 4.504 0.046 1 1 1081 . 1 1 1 A 114 114 ALA C C 114 177.490 177.049 0.441 1 1 1082 . 1 1 1 A 114 114 ALA CA C 114 51.340 51.526 -0.186 1 1 1083 . 1 1 1 A 114 114 ALA CB C 114 19.940 20.633 -0.693 1 1 1084 . 1 1 1 A 114 114 ALA N N 114 121.460 123.148 -1.688 1 1 1085 . 1 1 1 A 115 115 LYS H H 115 9.000 8.808 0.192 1 1 1086 . 1 1 1 A 115 115 LYS HA H 115 3.930 3.794 0.136 1 1 1095 . 1 1 1 A 115 115 LYS C C 115 175.740 175.061 0.679 1 1 1096 . 1 1 1 A 115 115 LYS CA C 115 57.580 57.442 0.138 1 1 1097 . 1 1 1 A 115 115 LYS CB C 115 29.510 30.303 -0.793 1 1 1101 . 1 1 1 A 115 115 LYS N N 115 112.560 115.470 -2.910 1 1 1102 . 1 1 1 A 116 116 GLU H H 116 7.620 7.671 -0.051 1 1 1103 . 1 1 1 A 116 116 GLU HA H 116 4.550 4.565 -0.015 1 1 1108 . 1 1 1 A 116 116 GLU C C 116 176.110 174.368 1.742 1 1 1109 . 1 1 1 A 116 116 GLU CA C 116 54.570 55.452 -0.882 1 1 1110 . 1 1 1 A 116 116 GLU CB C 116 33.680 33.279 0.401 1 1 1112 . 1 1 1 A 116 116 GLU N N 116 115.710 117.725 -2.015 1 1 1113 . 1 1 1 A 117 117 VAL H H 117 8.770 8.762 0.008 1 1 1114 . 1 1 1 A 117 117 VAL HA H 117 3.200 3.942 -0.742 1 1 1122 . 1 1 1 A 117 117 VAL C C 117 175.740 175.803 -0.063 1 1 1123 . 1 1 1 A 117 117 VAL CA C 117 65.340 63.531 1.809 1 1 1124 . 1 1 1 A 117 117 VAL CB C 117 31.290 30.926 0.364 1 1 1127 . 1 1 1 A 117 117 VAL N N 117 124.450 126.124 -1.674 1 1 1128 . 1 1 1 A 118 118 LEU H H 118 8.550 8.862 -0.312 1 1 1129 . 1 1 1 A 118 118 LEU HA H 118 4.540 4.332 0.208 1 1 1139 . 1 1 1 A 118 118 LEU C C 118 176.210 176.402 -0.192 1 1 1140 . 1 1 1 A 118 118 LEU CA C 118 55.510 55.947 -0.437 1 1 1141 . 1 1 1 A 118 118 LEU CB C 118 44.600 42.930 1.670 1 1 1145 . 1 1 1 A 118 118 LEU N N 118 128.440 130.420 -1.980 1 1 1146 . 1 1 1 A 119 119 ALA H H 119 7.970 7.377 0.593 1 1 1147 . 1 1 1 A 119 119 ALA HA H 119 4.740 4.779 -0.039 1 1 1151 . 1 1 1 A 119 119 ALA C C 119 174.570 175.341 -0.771 1 1 1152 . 1 1 1 A 119 119 ALA CA C 119 50.770 51.772 -1.002 1 1 1153 . 1 1 1 A 119 119 ALA CB C 119 22.450 22.518 -0.068 1 1 1154 . 1 1 1 A 119 119 ALA N N 119 118.100 118.469 -0.369 1 1 1155 . 1 1 1 A 120 120 LYS H H 120 8.760 8.771 -0.011 1 1 1156 . 1 1 1 A 120 120 LYS HA H 120 5.240 5.696 -0.456 1 1 1165 . 1 1 1 A 120 120 LYS C C 120 175.340 174.307 1.033 1 1 1166 . 1 1 1 A 120 120 LYS CA C 120 54.220 54.994 -0.774 1 1 1167 . 1 1 1 A 120 120 LYS CB C 120 34.340 36.235 -1.895 1 1 1171 . 1 1 1 A 120 120 LYS N N 120 120.010 116.864 3.146 1 1 1172 . 1 1 1 A 121 121 VAL H H 121 9.410 9.174 0.236 1 1 1173 . 1 1 1 A 121 121 VAL HA H 121 4.230 4.660 -0.430 1 1 1181 . 1 1 1 A 121 121 VAL C C 121 173.980 175.061 -1.081 1 1 1182 . 1 1 1 A 121 121 VAL CA C 121 62.370 61.551 0.819 1 1 1183 . 1 1 1 A 121 121 VAL CB C 121 32.410 32.537 -0.127 1 1 1186 . 1 1 1 A 121 121 VAL N N 121 124.960 124.158 0.802 1 1 1187 . 1 1 1 A 122 122 VAL H H 122 9.280 8.105 1.175 1 1 1188 . 1 1 1 A 122 122 VAL HA H 122 4.360 4.695 -0.335 1 1 1196 . 1 1 1 A 122 122 VAL C C 122 174.190 175.914 -1.724 1 1 1197 . 1 1 1 A 122 122 VAL CA C 122 62.760 61.757 1.003 1 1 1198 . 1 1 1 A 122 122 VAL CB C 122 32.020 32.044 -0.024 1 1 1201 . 1 1 1 A 122 122 VAL N N 122 128.990 125.607 3.383 1 1 1202 . 1 1 1 A 123 123 LEU H H 123 8.610 8.677 -0.067 1 1 1203 . 1 1 1 A 123 123 LEU HA H 123 4.900 4.337 0.563 1 1 1213 . 1 1 1 A 123 123 LEU C C 123 174.950 176.461 -1.511 1 1 1214 . 1 1 1 A 123 123 LEU CA C 123 52.050 53.947 -1.897 1 1 1215 . 1 1 1 A 123 123 LEU CB C 123 45.210 41.891 3.319 1 1 1219 . 1 1 1 A 123 123 LEU N N 123 127.200 128.069 -0.869 1 1 1220 . 1 1 1 A 124 124 ARG H H 124 9.540 8.877 0.663 1 1 1221 . 1 1 1 A 124 124 ARG HA H 124 4.900 4.916 -0.016 1 1 1229 . 1 1 1 A 124 124 ARG C C 124 176.320 175.191 1.129 1 1 1230 . 1 1 1 A 124 124 ARG CA C 124 55.320 54.523 0.797 1 1 1231 . 1 1 1 A 124 124 ARG CB C 124 31.750 32.462 -0.712 1 1 1234 . 1 1 1 A 124 124 ARG N N 124 124.290 122.210 2.080 1 1 1236 . 1 1 1 A 125 125 ALA H H 125 8.880 8.545 0.335 1 1 1237 . 1 1 1 A 125 125 ALA HA H 125 4.380 3.906 0.474 1 1 1241 . 1 1 1 A 125 125 ALA C C 125 177.290 177.411 -0.121 1 1 1242 . 1 1 1 A 125 125 ALA CA C 125 52.530 51.355 1.175 1 1 1243 . 1 1 1 A 125 125 ALA CB C 125 19.870 17.110 2.760 1 1 1244 . 1 1 1 A 125 125 ALA N N 125 130.790 129.497 1.293 1 1 1245 . 1 1 1 A 126 126 GLU H H 126 9.260 8.582 0.678 1 1 1246 . 1 1 1 A 126 126 GLU HA H 126 4.460 4.469 -0.009 1 1 1251 . 1 1 1 A 126 126 GLU C C 126 176.120 176.086 0.034 1 1 1252 . 1 1 1 A 126 126 GLU CA C 126 56.940 57.597 -0.657 1 1 1253 . 1 1 1 A 126 126 GLU CB C 126 32.450 30.084 2.366 1 1 1255 . 1 1 1 A 126 126 GLU N N 126 125.740 121.941 3.799 1 1 1256 . 1 1 1 A 127 127 ALA H H 127 7.460 7.462 -0.002 1 1 1257 . 1 1 1 A 127 127 ALA HA H 127 4.360 4.596 -0.236 1 1 1261 . 1 1 1 A 127 127 ALA C C 127 173.400 175.804 -2.404 1 1 1262 . 1 1 1 A 127 127 ALA CA C 127 51.360 51.589 -0.229 1 1 1263 . 1 1 1 A 127 127 ALA CB C 127 22.180 22.128 0.052 1 1 1264 . 1 1 1 A 127 127 ALA N N 127 120.910 120.246 0.664 1 1 1265 . 1 1 1 A 128 128 LYS H H 128 7.940 8.623 -0.683 1 1 1266 . 1 1 1 A 128 128 LYS HA H 128 3.580 4.116 -0.536 1 1 1275 . 1 1 1 A 128 128 LYS C C 128 176.080 175.780 0.300 1 1 1276 . 1 1 1 A 128 128 LYS CA C 128 56.860 57.019 -0.159 1 1 1277 . 1 1 1 A 128 128 LYS CB C 128 33.170 33.214 -0.044 1 1 1281 . 1 1 1 A 128 128 LYS N N 128 116.520 124.528 -8.008 1 1 1282 . 1 1 1 A 129 129 ALA H H 129 8.590 8.742 -0.152 1 1 1283 . 1 1 1 A 129 129 ALA HA H 129 4.390 4.669 -0.279 1 1 1287 . 1 1 1 A 129 129 ALA C C 129 174.970 175.429 -0.459 1 1 1288 . 1 1 1 A 129 129 ALA CA C 129 52.970 51.424 1.546 1 1 1289 . 1 1 1 A 129 129 ALA CB C 129 21.500 18.761 2.739 1 1 1290 . 1 1 1 A 129 129 ALA N N 129 124.710 127.817 -3.107 1 1 1291 . 1 1 1 A 130 130 GLU H H 130 8.660 8.310 0.350 1 1 1292 . 1 1 1 A 130 130 GLU HA H 130 4.660 4.190 0.470 1 1 1297 . 1 1 1 A 130 130 GLU C C 130 177.390 177.084 0.306 1 1 1298 . 1 1 1 A 130 130 GLU CA C 130 55.070 57.615 -2.545 1 1 1299 . 1 1 1 A 130 130 GLU CB C 130 30.860 29.184 1.676 1 1 1301 . 1 1 1 A 130 130 GLU N N 130 123.180 117.998 5.182 1 1 1302 . 1 1 1 A 131 131 GLY H H 131 9.170 8.784 0.386 1 1 1303 . 1 1 1 A 131 131 GLY HA2 H 131 3.560 3.996 -0.436 1 1 1304 . 1 1 1 A 131 131 GLY HA3 H 131 3.750 4.002 -0.252 1 1 1305 . 1 1 1 A 131 131 GLY C C 131 174.550 174.694 -0.144 1 1 1306 . 1 1 1 A 131 131 GLY CA C 131 47.660 45.476 2.184 1 1 1307 . 1 1 1 A 131 131 GLY N N 131 115.530 113.369 2.161 1 1 1308 . 1 1 1 A 132 132 SER H H 132 8.430 8.282 0.148 1 1 1309 . 1 1 1 A 132 132 SER HA H 132 4.170 4.628 -0.458 1 1 1312 . 1 1 1 A 132 132 SER C C 132 175.350 173.883 1.467 1 1 1313 . 1 1 1 A 132 132 SER CA C 132 59.050 57.801 1.249 1 1 1314 . 1 1 1 A 132 132 SER CB C 132 64.880 61.925 2.955 1 1 1315 . 1 1 1 A 132 132 SER N N 132 115.930 119.279 -3.349 1 1 1316 . 1 1 1 A 133 133 ASN H H 133 8.850 8.735 0.115 1 1 1317 . 1 1 1 A 133 133 ASN HA H 133 4.910 5.247 -0.337 1 1 1322 . 1 1 1 A 133 133 ASN C C 133 175.450 175.538 -0.088 1 1 1323 . 1 1 1 A 133 133 ASN CA C 133 54.920 53.635 1.285 1 1 1324 . 1 1 1 A 133 133 ASN CB C 133 41.060 38.959 2.101 1 1 1325 . 1 1 1 A 133 133 ASN N N 133 125.590 120.109 5.481 1 1 1327 . 1 1 1 A 134 134 LEU H H 134 9.070 8.775 0.295 1 1 1328 . 1 1 1 A 134 134 LEU HA H 134 5.230 5.492 -0.262 1 1 1338 . 1 1 1 A 134 134 LEU C C 134 175.240 175.933 -0.693 1 1 1339 . 1 1 1 A 134 134 LEU CA C 134 53.470 53.328 0.142 1 1 1340 . 1 1 1 A 134 134 LEU CB C 134 45.090 46.040 -0.950 1 1 1344 . 1 1 1 A 134 134 LEU N N 134 129.210 122.973 6.237 1 1 1345 . 1 1 1 A 135 135 SER H H 135 8.690 8.403 0.287 1 1 1346 . 1 1 1 A 135 135 SER HA H 135 5.280 5.264 0.016 1 1 1349 . 1 1 1 A 135 135 SER C C 135 173.590 173.261 0.329 1 1 1350 . 1 1 1 A 135 135 SER CA C 135 56.220 56.861 -0.641 1 1 1351 . 1 1 1 A 135 135 SER CB C 135 66.510 65.404 1.106 1 1 1352 . 1 1 1 A 135 135 SER N N 135 113.020 114.607 -1.587 1 1 1353 . 1 1 1 A 136 136 VAL H H 136 8.940 8.605 0.335 1 1 1354 . 1 1 1 A 136 136 VAL HA H 136 5.500 4.714 0.786 1 1 1362 . 1 1 1 A 136 136 VAL C C 136 175.730 175.247 0.483 1 1 1363 . 1 1 1 A 136 136 VAL CA C 136 60.960 61.038 -0.078 1 1 1364 . 1 1 1 A 136 136 VAL CB C 136 33.630 32.513 1.117 1 1 1367 . 1 1 1 A 136 136 VAL N N 136 124.340 121.585 2.755 1 1 1368 . 1 1 1 A 137 137 THR H H 137 9.240 8.425 0.815 1 1 1369 . 1 1 1 A 137 137 THR HA H 137 4.920 4.770 0.150 1 1 1374 . 1 1 1 A 137 137 THR C C 137 173.500 174.275 -0.775 1 1 1375 . 1 1 1 A 137 137 THR CA C 137 59.120 60.093 -0.973 1 1 1376 . 1 1 1 A 137 137 THR CB C 137 72.500 70.918 1.582 1 1 1378 . 1 1 1 A 137 137 THR N N 137 117.010 118.749 -1.739 1 1 1379 . 1 1 1 A 138 138 ASN H H 138 9.190 8.731 0.459 1 1 1380 . 1 1 1 A 138 138 ASN HA H 138 4.420 4.295 0.125 1 1 1385 . 1 1 1 A 138 138 ASN C C 138 175.550 174.953 0.597 1 1 1386 . 1 1 1 A 138 138 ASN CA C 138 54.350 53.868 0.482 1 1 1387 . 1 1 1 A 138 138 ASN CB C 138 37.380 36.379 1.001 1 1 1388 . 1 1 1 A 138 138 ASN N N 138 115.270 120.605 -5.335 1 1 1390 . 1 1 1 A 139 139 SER H H 139 8.560 7.840 0.720 1 1 1391 . 1 1 1 A 139 139 SER HA H 139 5.800 4.346 1.454 1 1 1394 . 1 1 1 A 139 139 SER C C 139 175.750 174.015 1.735 1 1 1395 . 1 1 1 A 139 139 SER CA C 139 56.020 57.763 -1.743 1 1 1396 . 1 1 1 A 139 139 SER CB C 139 65.320 63.256 2.064 1 1 1397 . 1 1 1 A 139 139 SER N N 139 112.360 116.505 -4.145 1 1 1398 . 1 1 1 A 140 140 SER H H 140 9.900 8.053 1.847 1 1 1399 . 1 1 1 A 140 140 SER HA H 140 5.360 4.989 0.371 1 1 1402 . 1 1 1 A 140 140 SER C C 140 172.620 173.766 -1.146 1 1 1403 . 1 1 1 A 140 140 SER CA C 140 57.400 57.255 0.145 1 1 1404 . 1 1 1 A 140 140 SER CB C 140 66.550 65.388 1.162 1 1 1405 . 1 1 1 A 140 140 SER N N 140 119.130 120.871 -1.741 1 1 1406 . 1 1 1 A 141 141 VAL H H 141 9.030 8.726 0.304 1 1 1407 . 1 1 1 A 141 141 VAL HA H 141 5.520 4.766 0.754 1 1 1415 . 1 1 1 A 141 141 VAL C C 141 174.750 174.433 0.317 1 1 1416 . 1 1 1 A 141 141 VAL CA C 141 58.310 59.758 -1.448 1 1 1417 . 1 1 1 A 141 141 VAL CB C 141 35.030 35.870 -0.840 1 1 1420 . 1 1 1 A 141 141 VAL N N 141 111.410 113.773 -2.363 1 1 1421 . 1 1 1 A 142 142 GLY H H 142 8.790 9.218 -0.428 1 1 1422 . 1 1 1 A 142 142 GLY HA2 H 142 3.600 4.023 -0.423 1 1 1423 . 1 1 1 A 142 142 GLY HA3 H 142 5.310 4.055 1.255 1 1 1424 . 1 1 1 A 142 142 GLY C C 142 174.180 173.727 0.453 1 1 1425 . 1 1 1 A 142 142 GLY CA C 142 44.110 46.516 -2.406 1 1 1426 . 1 1 1 A 142 142 GLY N N 142 109.330 110.587 -1.257 1 1 1427 . 1 1 1 A 143 143 ASP H H 143 8.840 8.949 -0.109 1 1 1428 . 1 1 1 A 143 143 ASP HA H 143 5.790 5.058 0.732 1 1 1431 . 1 1 1 A 143 143 ASP C C 143 178.860 177.958 0.902 1 1 1432 . 1 1 1 A 143 143 ASP CA C 143 53.040 54.801 -1.761 1 1 1433 . 1 1 1 A 143 143 ASP CB C 143 43.660 42.528 1.132 1 1 1434 . 1 1 1 A 143 143 ASP N N 143 125.390 126.074 -0.684 1 1 1435 . 1 1 1 A 144 144 GLY H H 144 9.150 8.814 0.336 1 1 1436 . 1 1 1 A 144 144 GLY HA2 H 144 3.450 3.751 -0.301 1 1 1437 . 1 1 1 A 144 144 GLY HA3 H 144 3.720 3.881 -0.161 1 1 1438 . 1 1 1 A 144 144 GLY C C 144 174.770 175.633 -0.863 1 1 1439 . 1 1 1 A 144 144 GLY CA C 144 46.930 47.709 -0.779 1 1 1440 . 1 1 1 A 144 144 GLY N N 144 106.470 110.374 -3.904 1 1 1441 . 1 1 1 A 145 145 GLU H H 145 8.470 7.844 0.626 1 1 1442 . 1 1 1 A 145 145 GLU HA H 145 4.460 4.209 0.251 1 1 1447 . 1 1 1 A 145 145 GLU C C 145 176.520 176.584 -0.064 1 1 1448 . 1 1 1 A 145 145 GLU CA C 145 55.330 56.907 -1.577 1 1 1449 . 1 1 1 A 145 145 GLU CB C 145 30.620 29.774 0.846 1 1 1451 . 1 1 1 A 145 145 GLU N N 145 119.170 120.510 -1.340 1 1 1452 . 1 1 1 A 146 146 GLY H H 146 7.950 7.987 -0.037 1 1 1453 . 1 1 1 A 146 146 GLY HA2 H 146 3.630 4.015 -0.385 1 1 1454 . 1 1 1 A 146 146 GLY HA3 H 146 4.130 4.022 0.108 1 1 1455 . 1 1 1 A 146 146 GLY C C 146 174.350 173.877 0.473 1 1 1456 . 1 1 1 A 146 146 GLY CA C 146 45.330 45.128 0.202 1 1 1457 . 1 1 1 A 146 146 GLY N N 146 108.130 107.777 0.353 1 1 1458 . 1 1 1 A 147 147 LEU H H 147 8.440 7.973 0.467 1 1 1459 . 1 1 1 A 147 147 LEU HA H 147 4.340 4.875 -0.535 1 1 1469 . 1 1 1 A 147 147 LEU C C 147 175.950 175.263 0.687 1 1 1470 . 1 1 1 A 147 147 LEU CA C 147 54.860 52.843 2.017 1 1 1471 . 1 1 1 A 147 147 LEU CB C 147 41.590 44.791 -3.201 1 1 1475 . 1 1 1 A 147 147 LEU N N 147 124.000 121.070 2.930 1 1 1476 . 1 1 1 A 148 148 VAL H H 148 7.780 8.549 -0.769 1 1 1477 . 1 1 1 A 148 148 VAL HA H 148 4.830 5.204 -0.374 1 1 1485 . 1 1 1 A 148 148 VAL C C 148 175.740 174.777 0.963 1 1 1486 . 1 1 1 A 148 148 VAL CA C 148 61.140 61.147 -0.007 1 1 1487 . 1 1 1 A 148 148 VAL CB C 148 33.640 33.907 -0.267 1 1 1490 . 1 1 1 A 148 148 VAL N N 148 120.440 121.177 -0.737 1 1 1491 . 1 1 1 A 149 149 HIS H H 149 9.170 8.990 0.180 1 1 1492 . 1 1 1 A 149 149 HIS HA H 149 4.950 5.029 -0.079 1 1 1496 . 1 1 1 A 149 149 HIS C C 149 174.780 174.797 -0.017 1 1 1497 . 1 1 1 A 149 149 HIS CA C 149 53.900 54.399 -0.499 1 1 1498 . 1 1 1 A 149 149 HIS CB C 149 32.200 30.427 1.773 1 1 1499 . 1 1 1 A 149 149 HIS N N 149 124.700 125.724 -1.024 1 1 1500 . 1 1 1 A 150 150 GLU H H 150 9.060 8.525 0.535 1 1 1501 . 1 1 1 A 150 150 GLU HA H 150 4.420 4.116 0.304 1 1 1506 . 1 1 1 A 150 150 GLU C C 150 176.520 176.453 0.067 1 1 1507 . 1 1 1 A 150 150 GLU CA C 150 57.630 56.868 0.762 1 1 1508 . 1 1 1 A 150 150 GLU CB C 150 30.370 29.519 0.851 1 1 1510 . 1 1 1 A 150 150 GLU N N 150 125.540 123.866 1.674 1 1 1511 . 1 1 1 A 151 151 ILE H H 151 8.150 7.695 0.455 1 1 1512 . 1 1 1 A 151 151 ILE HA H 151 4.780 4.442 0.338 1 1 1522 . 1 1 1 A 151 151 ILE C C 151 174.570 176.177 -1.607 1 1 1523 . 1 1 1 A 151 151 ILE CA C 151 59.390 59.729 -0.339 1 1 1524 . 1 1 1 A 151 151 ILE CB C 151 42.040 39.961 2.079 1 1 1528 . 1 1 1 A 151 151 ILE N N 151 115.880 122.884 -7.004 1 1 1529 . 1 1 1 A 152 152 ALA H H 152 8.010 8.859 -0.849 1 1 1530 . 1 1 1 A 152 152 ALA HA H 152 4.310 4.334 -0.024 1 1 1534 . 1 1 1 A 152 152 ALA C C 152 177.500 176.718 0.782 1 1 1535 . 1 1 1 A 152 152 ALA CA C 152 53.680 51.710 1.970 1 1 1536 . 1 1 1 A 152 152 ALA CB C 152 20.050 19.648 0.402 1 1 1537 . 1 1 1 A 152 152 ALA N N 152 126.640 124.967 1.673 1 1 1538 . 1 1 1 A 153 153 GLY H H 153 8.340 8.246 0.094 1 1 1539 . 1 1 1 A 153 153 GLY HA2 H 153 4.050 4.292 -0.242 1 1 1540 . 1 1 1 A 153 153 GLY HA3 H 153 4.140 4.293 -0.153 1 1 1541 . 1 1 1 A 153 153 GLY C C 153 173.140 171.616 1.524 1 1 1542 . 1 1 1 A 153 153 GLY CA C 153 44.130 45.876 -1.746 1 1 1543 . 1 1 1 A 153 153 GLY N N 153 107.490 105.471 2.019 1 1 1544 . 1 1 1 A 154 154 THR H H 154 7.380 8.279 -0.899 1 1 1545 . 1 1 1 A 154 154 THR HA H 154 4.700 5.168 -0.468 1 1 1550 . 1 1 1 A 154 154 THR C C 154 171.120 173.002 -1.882 1 1 1551 . 1 1 1 A 154 154 THR CA C 154 60.830 61.068 -0.238 1 1 1552 . 1 1 1 A 154 154 THR CB C 154 68.850 73.245 -4.395 1 1 1554 . 1 1 1 A 154 154 THR N N 154 109.340 114.060 -4.720 1 1 1555 . 1 1 1 A 155 155 GLU H H 155 8.020 8.692 -0.672 1 1 1556 . 1 1 1 A 155 155 GLU HA H 155 5.370 5.303 0.067 1 1 1561 . 1 1 1 A 155 155 GLU C C 155 174.240 174.335 -0.095 1 1 1562 . 1 1 1 A 155 155 GLU CA C 155 54.830 54.437 0.393 1 1 1563 . 1 1 1 A 155 155 GLU CB C 155 33.620 33.403 0.217 1 1 1565 . 1 1 1 A 155 155 GLU N N 155 118.690 123.806 -5.116 1 1 1566 . 1 1 1 A 156 156 LYS H H 156 9.230 8.820 0.410 1 1 1567 . 1 1 1 A 156 156 LYS HA H 156 4.650 5.122 -0.472 1 1 1576 . 1 1 1 A 156 156 LYS C C 156 174.000 174.469 -0.469 1 1 1577 . 1 1 1 A 156 156 LYS CA C 156 55.840 54.813 1.027 1 1 1578 . 1 1 1 A 156 156 LYS CB C 156 37.550 36.636 0.914 1 1 1582 . 1 1 1 A 156 156 LYS N N 156 121.940 125.339 -3.399 1 1 1583 . 1 1 1 A 157 157 THR H H 157 8.160 8.732 -0.572 1 1 1584 . 1 1 1 A 157 157 THR HA H 157 5.440 5.151 0.289 1 1 1589 . 1 1 1 A 157 157 THR C C 157 174.360 173.646 0.714 1 1 1590 . 1 1 1 A 157 157 THR CA C 157 60.410 60.704 -0.294 1 1 1591 . 1 1 1 A 157 157 THR CB C 157 71.500 71.155 0.345 1 1 1593 . 1 1 1 A 157 157 THR N N 157 113.240 113.313 -0.073 1 1 1594 . 1 1 1 A 158 158 VAL H H 158 9.120 9.100 0.020 1 1 1595 . 1 1 1 A 158 158 VAL HA H 158 4.580 4.995 -0.415 1 1 1603 . 1 1 1 A 158 158 VAL C C 158 172.800 174.797 -1.997 1 1 1604 . 1 1 1 A 158 158 VAL CA C 158 59.980 59.467 0.513 1 1 1605 . 1 1 1 A 158 158 VAL CB C 158 36.290 34.445 1.845 1 1 1608 . 1 1 1 A 158 158 VAL N N 158 121.710 122.132 -0.422 1 1 1609 . 1 1 1 A 159 159 ASN H H 159 8.240 8.874 -0.634 1 1 1610 . 1 1 1 A 159 159 ASN HA H 159 5.420 5.204 0.216 1 1 1615 . 1 1 1 A 159 159 ASN C C 159 173.800 174.026 -0.226 1 1 1616 . 1 1 1 A 159 159 ASN CA C 159 51.740 52.345 -0.605 1 1 1617 . 1 1 1 A 159 159 ASN CB C 159 40.380 39.790 0.590 1 1 1618 . 1 1 1 A 159 159 ASN N N 159 122.730 122.994 -0.264 1 1 1620 . 1 1 1 A 160 160 ILE H H 160 9.160 8.791 0.369 1 1 1621 . 1 1 1 A 160 160 ILE HA H 160 5.130 5.006 0.124 1 1 1631 . 1 1 1 A 160 160 ILE C C 160 177.320 175.749 1.571 1 1 1632 . 1 1 1 A 160 160 ILE CA C 160 60.640 60.751 -0.111 1 1 1633 . 1 1 1 A 160 160 ILE CB C 160 38.520 37.591 0.929 1 1 1637 . 1 1 1 A 160 160 ILE N N 160 123.690 125.494 -1.804 1 1 1638 . 1 1 1 A 161 161 ILE H H 161 8.780 8.870 -0.090 1 1 1639 . 1 1 1 A 161 161 ILE HA H 161 4.590 4.600 -0.010 1 1 1649 . 1 1 1 A 161 161 ILE C C 161 174.960 175.913 -0.953 1 1 1650 . 1 1 1 A 161 161 ILE CA C 161 59.320 60.632 -1.312 1 1 1651 . 1 1 1 A 161 161 ILE CB C 161 41.030 39.839 1.191 1 1 1655 . 1 1 1 A 161 161 ILE N N 161 122.490 128.846 -6.356 1 1 1656 . 1 1 1 A 162 162 GLU H H 162 8.620 8.469 0.151 1 1 1657 . 1 1 1 A 162 162 GLU HA H 162 4.290 4.263 0.027 1 1 1662 . 1 1 1 A 162 162 GLU C C 162 176.660 177.068 -0.408 1 1 1663 . 1 1 1 A 162 162 GLU CA C 162 56.470 57.368 -0.898 1 1 1664 . 1 1 1 A 162 162 GLU CB C 162 31.150 30.315 0.835 1 1 1666 . 1 1 1 A 162 162 GLU N N 162 120.520 125.559 -5.039 1 1 1667 . 1 1 1 A 163 163 GLY H H 163 8.480 8.426 0.054 1 1 1668 . 1 1 1 A 163 163 GLY HA2 H 163 3.910 4.071 -0.161 1 1 1669 . 1 1 1 A 163 163 GLY HA3 H 163 4.150 4.073 0.077 1 1 1670 . 1 1 1 A 163 163 GLY C C 163 174.000 173.475 0.525 1 1 1671 . 1 1 1 A 163 163 GLY CA C 163 45.270 44.412 0.858 1 1 1672 . 1 1 1 A 163 163 GLY N N 163 110.210 110.473 -0.263 1 1 1673 . 1 1 1 A 164 164 THR H H 164 8.170 8.124 0.046 1 1 1674 . 1 1 1 A 164 164 THR HA H 164 4.410 4.563 -0.153 1 1 1679 . 1 1 1 A 164 164 THR C C 164 174.100 175.097 -0.997 1 1 1680 . 1 1 1 A 164 164 THR CA C 164 61.620 62.251 -0.631 1 1 1681 . 1 1 1 A 164 164 THR CB C 164 70.060 69.596 0.464 1 1 1683 . 1 1 1 A 164 164 THR N N 164 113.480 115.883 -2.403 1 1 1 . 2 1 1 A 13 13 GLY H H 13 8.350 8.440 -0.090 1 1 2 . 2 1 1 A 13 13 GLY HA2 H 13 3.920 3.820 0.100 1 1 3 . 2 1 1 A 13 13 GLY HA3 H 13 3.920 3.833 0.087 1 1 4 . 2 1 1 A 13 13 GLY CA C 13 45.290 46.075 -0.785 1 1 5 . 2 1 1 A 13 13 GLY N N 13 110.450 116.048 -5.598 1 1 6 . 2 1 1 A 14 14 LEU H H 14 8.050 8.431 -0.381 1 1 7 . 2 1 1 A 14 14 LEU N N 14 121.500 126.570 -5.070 1 1 8 . 2 1 1 A 15 15 VAL H H 15 8.070 7.983 0.087 1 1 9 . 2 1 1 A 15 15 VAL N N 15 122.390 118.667 3.723 1 1 10 . 2 1 1 A 16 16 PRO HA H 16 4.360 4.325 0.035 1 1 17 . 2 1 1 A 16 16 PRO CA C 16 62.770 65.782 -3.012 1 1 18 . 2 1 1 A 16 16 PRO CB C 16 32.020 31.887 0.133 1 1 21 . 2 1 1 A 21 21 MET H H 21 8.180 8.620 -0.440 1 1 22 . 2 1 1 A 21 21 MET N N 21 121.310 123.627 -2.317 1 1 23 . 2 1 1 A 22 22 ALA H H 22 8.290 8.872 -0.582 1 1 24 . 2 1 1 A 22 22 ALA N N 22 124.800 128.834 -4.034 1 1 25 . 2 1 1 A 23 23 SER H H 23 8.210 9.031 -0.821 1 1 26 . 2 1 1 A 23 23 SER N N 23 114.830 121.127 -6.297 1 1 27 . 2 1 1 A 24 24 LYS H H 24 8.250 8.926 -0.676 1 1 28 . 2 1 1 A 24 24 LYS N N 24 122.980 127.754 -4.774 1 1 29 . 2 1 1 A 25 25 LEU H H 25 8.140 8.597 -0.457 1 1 30 . 2 1 1 A 25 25 LEU HA H 25 4.290 4.809 -0.519 1 1 40 . 2 1 1 A 25 25 LEU C C 25 177.410 176.021 1.389 1 1 41 . 2 1 1 A 25 25 LEU CA C 25 55.430 54.258 1.172 1 1 42 . 2 1 1 A 25 25 LEU CB C 25 42.350 43.714 -1.364 1 1 46 . 2 1 1 A 25 25 LEU N N 25 122.580 127.116 -4.536 1 1 47 . 2 1 1 A 26 26 LYS H H 26 8.200 8.338 -0.138 1 1 48 . 2 1 1 A 26 26 LYS HA H 26 4.260 4.364 -0.104 1 1 57 . 2 1 1 A 26 26 LYS C C 26 176.520 177.135 -0.615 1 1 58 . 2 1 1 A 26 26 LYS CA C 26 56.700 57.776 -1.076 1 1 59 . 2 1 1 A 26 26 LYS CB C 26 33.060 33.070 -0.010 1 1 63 . 2 1 1 A 26 26 LYS N N 26 121.800 124.260 -2.460 1 1 64 . 2 1 1 A 27 27 GLU H H 27 8.380 7.927 0.453 1 1 65 . 2 1 1 A 27 27 GLU HA H 27 4.240 4.385 -0.145 1 1 70 . 2 1 1 A 27 27 GLU C C 27 176.130 176.878 -0.748 1 1 71 . 2 1 1 A 27 27 GLU CA C 27 56.700 56.120 0.580 1 1 72 . 2 1 1 A 27 27 GLU CB C 27 30.370 30.363 0.007 1 1 74 . 2 1 1 A 27 27 GLU N N 27 121.700 118.843 2.857 1 1 75 . 2 1 1 A 28 28 ALA H H 28 8.230 8.641 -0.411 1 1 76 . 2 1 1 A 28 28 ALA HA H 28 4.280 3.977 0.303 1 1 80 . 2 1 1 A 28 28 ALA C C 28 177.090 177.554 -0.464 1 1 81 . 2 1 1 A 28 28 ALA CA C 28 52.530 53.127 -0.597 1 1 82 . 2 1 1 A 28 28 ALA CB C 28 19.360 17.891 1.469 1 1 83 . 2 1 1 A 28 28 ALA N N 28 124.640 121.702 2.938 1 1 84 . 2 1 1 A 29 29 ALA H H 29 8.150 8.699 -0.549 1 1 85 . 2 1 1 A 29 29 ALA HA H 29 4.320 4.569 -0.249 1 1 89 . 2 1 1 A 29 29 ALA C C 29 177.120 177.275 -0.155 1 1 90 . 2 1 1 A 29 29 ALA CA C 29 52.040 51.297 0.743 1 1 91 . 2 1 1 A 29 29 ALA CB C 29 19.430 18.971 0.459 1 1 92 . 2 1 1 A 29 29 ALA N N 29 123.430 126.427 -2.997 1 1 93 . 2 1 1 A 30 30 GLU H H 30 8.310 7.720 0.590 1 1 94 . 2 1 1 A 30 30 GLU HA H 30 4.220 4.585 -0.365 1 1 99 . 2 1 1 A 30 30 GLU C C 30 176.310 176.167 0.143 1 1 100 . 2 1 1 A 30 30 GLU CA C 30 56.630 56.211 0.419 1 1 101 . 2 1 1 A 30 30 GLU CB C 30 30.320 30.577 -0.257 1 1 103 . 2 1 1 A 30 30 GLU N N 30 120.630 118.356 2.274 1 1 104 . 2 1 1 A 31 31 VAL H H 31 8.630 8.901 -0.271 1 1 105 . 2 1 1 A 31 31 VAL HA H 31 4.430 4.816 -0.386 1 1 113 . 2 1 1 A 31 31 VAL C C 31 176.510 176.469 0.041 1 1 114 . 2 1 1 A 31 31 VAL CA C 31 62.360 63.209 -0.849 1 1 115 . 2 1 1 A 31 31 VAL CB C 31 32.370 31.782 0.588 1 1 118 . 2 1 1 A 31 31 VAL N N 31 127.110 125.947 1.163 1 1 119 . 2 1 1 A 32 32 THR H H 32 7.640 8.737 -1.097 1 1 120 . 2 1 1 A 32 32 THR HA H 32 4.870 3.976 0.894 1 1 125 . 2 1 1 A 32 32 THR C C 32 172.220 174.770 -2.550 1 1 126 . 2 1 1 A 32 32 THR CA C 32 59.510 65.081 -5.571 1 1 127 . 2 1 1 A 32 32 THR CB C 32 71.630 69.826 1.804 1 1 129 . 2 1 1 A 32 32 THR N N 32 118.860 121.188 -2.328 1 1 130 . 2 1 1 A 33 33 GLY H H 33 8.350 7.985 0.365 1 1 131 . 2 1 1 A 33 33 GLY HA2 H 33 4.160 4.042 0.118 1 1 132 . 2 1 1 A 33 33 GLY HA3 H 33 4.250 4.060 0.190 1 1 133 . 2 1 1 A 33 33 GLY C C 33 172.820 172.985 -0.165 1 1 134 . 2 1 1 A 33 33 GLY CA C 33 46.680 44.931 1.749 1 1 135 . 2 1 1 A 33 33 GLY N N 33 106.720 108.820 -2.100 1 1 136 . 2 1 1 A 34 34 SER H H 34 8.810 8.022 0.788 1 1 137 . 2 1 1 A 34 34 SER HA H 34 5.390 4.924 0.466 1 1 140 . 2 1 1 A 34 34 SER C C 34 173.780 172.827 0.953 1 1 141 . 2 1 1 A 34 34 SER CA C 34 57.380 57.494 -0.114 1 1 142 . 2 1 1 A 34 34 SER CB C 34 65.730 65.767 -0.037 1 1 143 . 2 1 1 A 34 34 SER N N 34 112.690 119.774 -7.084 1 1 144 . 2 1 1 A 35 35 VAL H H 35 8.470 8.749 -0.279 1 1 145 . 2 1 1 A 35 35 VAL HA H 35 4.120 4.766 -0.646 1 1 153 . 2 1 1 A 35 35 VAL C C 35 174.750 174.227 0.523 1 1 154 . 2 1 1 A 35 35 VAL CA C 35 62.310 60.098 2.212 1 1 155 . 2 1 1 A 35 35 VAL CB C 35 34.550 33.355 1.195 1 1 158 . 2 1 1 A 35 35 VAL N N 35 123.150 122.052 1.098 1 1 159 . 2 1 1 A 36 36 SER H H 36 8.240 8.790 -0.550 1 1 160 . 2 1 1 A 36 36 SER HA H 36 4.690 4.886 -0.196 1 1 163 . 2 1 1 A 36 36 SER C C 36 171.860 172.992 -1.132 1 1 164 . 2 1 1 A 36 36 SER CA C 36 56.020 56.589 -0.569 1 1 165 . 2 1 1 A 36 36 SER CB C 36 66.050 64.413 1.637 1 1 166 . 2 1 1 A 36 36 SER N N 36 118.760 119.796 -1.036 1 1 167 . 2 1 1 A 37 37 LEU H H 37 8.310 9.015 -0.705 1 1 168 . 2 1 1 A 37 37 LEU HA H 37 4.870 5.047 -0.177 1 1 178 . 2 1 1 A 37 37 LEU C C 37 174.190 175.100 -0.910 1 1 179 . 2 1 1 A 37 37 LEU CA C 37 53.870 53.598 0.272 1 1 180 . 2 1 1 A 37 37 LEU CB C 37 47.000 44.275 2.725 1 1 184 . 2 1 1 A 37 37 LEU N N 37 124.790 130.599 -5.809 1 1 185 . 2 1 1 A 38 38 GLU H H 38 9.270 8.766 0.504 1 1 186 . 2 1 1 A 38 38 GLU HA H 38 4.650 5.249 -0.599 1 1 191 . 2 1 1 A 38 38 GLU C C 38 173.970 174.666 -0.696 1 1 192 . 2 1 1 A 38 38 GLU CA C 38 54.410 55.037 -0.627 1 1 193 . 2 1 1 A 38 38 GLU CB C 38 32.460 33.330 -0.870 1 1 195 . 2 1 1 A 38 38 GLU N N 38 126.550 127.182 -0.632 1 1 196 . 2 1 1 A 39 39 ALA H H 39 8.120 8.349 -0.229 1 1 197 . 2 1 1 A 39 39 ALA HA H 39 4.600 4.754 -0.154 1 1 201 . 2 1 1 A 39 39 ALA C C 39 175.930 177.089 -1.159 1 1 202 . 2 1 1 A 39 39 ALA CA C 39 51.570 51.225 0.345 1 1 203 . 2 1 1 A 39 39 ALA CB C 39 21.780 22.355 -0.575 1 1 204 . 2 1 1 A 39 39 ALA N N 39 124.410 125.569 -1.159 1 1 205 . 2 1 1 A 40 40 LEU H H 40 7.860 8.821 -0.961 1 1 206 . 2 1 1 A 40 40 LEU HA H 40 4.230 4.008 0.222 1 1 216 . 2 1 1 A 40 40 LEU C C 40 175.940 176.637 -0.697 1 1 217 . 2 1 1 A 40 40 LEU CA C 40 55.360 57.823 -2.463 1 1 218 . 2 1 1 A 40 40 LEU CB C 40 42.990 42.959 0.031 1 1 222 . 2 1 1 A 40 40 LEU N N 40 120.640 119.945 0.695 1 1 223 . 2 1 1 A 41 41 GLU H H 41 8.210 7.917 0.293 1 1 224 . 2 1 1 A 41 41 GLU HA H 41 4.240 4.016 0.224 1 1 229 . 2 1 1 A 41 41 GLU C C 41 176.920 174.807 2.113 1 1 230 . 2 1 1 A 41 41 GLU CA C 41 58.090 57.488 0.602 1 1 231 . 2 1 1 A 41 41 GLU CB C 41 30.530 27.276 3.254 1 1 233 . 2 1 1 A 41 41 GLU N N 41 114.680 117.581 -2.901 1 1 234 . 2 1 1 A 42 42 GLU H H 42 7.490 7.757 -0.267 1 1 235 . 2 1 1 A 42 42 GLU HA H 42 5.680 4.814 0.866 1 1 240 . 2 1 1 A 42 42 GLU C C 42 173.790 174.185 -0.395 1 1 241 . 2 1 1 A 42 42 GLU CA C 42 54.360 56.087 -1.727 1 1 242 . 2 1 1 A 42 42 GLU CB C 42 33.850 33.383 0.467 1 1 244 . 2 1 1 A 42 42 GLU N N 42 116.670 118.014 -1.344 1 1 245 . 2 1 1 A 43 43 VAL H H 43 8.550 8.875 -0.325 1 1 246 . 2 1 1 A 43 43 VAL HA H 43 4.550 4.718 -0.168 1 1 254 . 2 1 1 A 43 43 VAL C C 43 172.220 173.740 -1.520 1 1 255 . 2 1 1 A 43 43 VAL CA C 43 59.470 60.526 -1.056 1 1 256 . 2 1 1 A 43 43 VAL CB C 43 35.470 34.703 0.767 1 1 259 . 2 1 1 A 43 43 VAL N N 43 120.030 124.628 -4.598 1 1 260 . 2 1 1 A 44 44 GLN H H 44 8.470 8.611 -0.141 1 1 261 . 2 1 1 A 44 44 GLN HA H 44 4.890 4.502 0.388 1 1 268 . 2 1 1 A 44 44 GLN C C 44 176.130 176.033 0.097 1 1 269 . 2 1 1 A 44 44 GLN CA C 44 54.360 55.674 -1.314 1 1 270 . 2 1 1 A 44 44 GLN CB C 44 30.610 28.977 1.633 1 1 272 . 2 1 1 A 44 44 GLN N N 44 124.690 130.159 -5.469 1 1 274 . 2 1 1 A 45 45 VAL H H 45 8.130 8.202 -0.072 1 1 275 . 2 1 1 A 45 45 VAL HA H 45 3.030 3.971 -0.941 1 1 283 . 2 1 1 A 45 45 VAL C C 45 176.710 177.176 -0.466 1 1 284 . 2 1 1 A 45 45 VAL CA C 45 65.810 64.753 1.057 1 1 285 . 2 1 1 A 45 45 VAL CB C 45 31.960 31.447 0.513 1 1 288 . 2 1 1 A 45 45 VAL N N 45 120.450 127.076 -6.626 1 1 289 . 2 1 1 A 46 46 GLY H H 46 8.950 9.986 -1.036 1 1 290 . 2 1 1 A 46 46 GLY HA2 H 46 3.590 4.018 -0.428 1 1 291 . 2 1 1 A 46 46 GLY HA3 H 46 4.410 4.019 0.391 1 1 292 . 2 1 1 A 46 46 GLY C C 46 174.390 173.779 0.611 1 1 293 . 2 1 1 A 46 46 GLY CA C 46 44.730 44.965 -0.235 1 1 294 . 2 1 1 A 46 46 GLY N N 46 116.490 115.223 1.267 1 1 295 . 2 1 1 A 47 47 GLU H H 47 8.260 7.718 0.542 1 1 296 . 2 1 1 A 47 47 GLU HA H 47 4.460 4.704 -0.244 1 1 301 . 2 1 1 A 47 47 GLU C C 47 174.780 175.132 -0.352 1 1 302 . 2 1 1 A 47 47 GLU CA C 47 54.830 55.019 -0.189 1 1 303 . 2 1 1 A 47 47 GLU CB C 47 31.140 32.217 -1.077 1 1 305 . 2 1 1 A 47 47 GLU N N 47 120.520 121.484 -0.964 1 1 306 . 2 1 1 A 48 48 ASN H H 48 8.440 8.728 -0.288 1 1 307 . 2 1 1 A 48 48 ASN HA H 48 5.380 5.453 -0.073 1 1 312 . 2 1 1 A 48 48 ASN C C 48 174.770 174.493 0.277 1 1 313 . 2 1 1 A 48 48 ASN CA C 48 51.570 51.944 -0.374 1 1 314 . 2 1 1 A 48 48 ASN CB C 48 39.010 41.084 -2.074 1 1 315 . 2 1 1 A 48 48 ASN N N 48 117.180 120.346 -3.166 1 1 317 . 2 1 1 A 49 49 LEU H H 49 9.810 8.426 1.384 1 1 318 . 2 1 1 A 49 49 LEU HA H 49 4.510 5.286 -0.776 1 1 328 . 2 1 1 A 49 49 LEU C C 49 174.560 174.721 -0.161 1 1 329 . 2 1 1 A 49 49 LEU CA C 49 53.460 53.301 0.159 1 1 330 . 2 1 1 A 49 49 LEU CB C 49 45.520 45.817 -0.297 1 1 333 . 2 1 1 A 49 49 LEU N N 49 125.620 122.613 3.007 1 1 334 . 2 1 1 A 50 50 GLU H H 50 8.750 8.802 -0.052 1 1 335 . 2 1 1 A 50 50 GLU HA H 50 4.360 4.892 -0.532 1 1 340 . 2 1 1 A 50 50 GLU C C 50 175.340 174.961 0.379 1 1 341 . 2 1 1 A 50 50 GLU CA C 50 55.550 55.394 0.156 1 1 342 . 2 1 1 A 50 50 GLU CB C 50 29.890 30.955 -1.065 1 1 344 . 2 1 1 A 50 50 GLU N N 50 125.420 123.972 1.448 1 1 345 . 2 1 1 A 51 51 VAL H H 51 9.230 8.818 0.412 1 1 346 . 2 1 1 A 51 51 VAL HA H 51 4.190 4.872 -0.682 1 1 354 . 2 1 1 A 51 51 VAL C C 51 175.310 174.285 1.025 1 1 355 . 2 1 1 A 51 51 VAL CA C 51 62.520 60.866 1.654 1 1 356 . 2 1 1 A 51 51 VAL CB C 51 31.470 32.980 -1.510 1 1 359 . 2 1 1 A 51 51 VAL N N 51 129.810 119.687 10.123 1 1 360 . 2 1 1 A 52 52 GLY H H 52 9.410 8.609 0.801 1 1 361 . 2 1 1 A 52 52 GLY HA2 H 52 3.460 3.902 -0.442 1 1 362 . 2 1 1 A 52 52 GLY HA3 H 52 4.680 3.931 0.749 1 1 363 . 2 1 1 A 52 52 GLY C C 52 173.000 173.023 -0.023 1 1 364 . 2 1 1 A 52 52 GLY CA C 52 46.470 47.297 -0.827 1 1 365 . 2 1 1 A 52 52 GLY N N 52 116.600 113.235 3.365 1 1 366 . 2 1 1 A 53 53 VAL H H 53 9.130 8.379 0.751 1 1 367 . 2 1 1 A 53 53 VAL HA H 53 4.840 4.675 0.165 1 1 375 . 2 1 1 A 53 53 VAL C C 53 175.470 175.168 0.302 1 1 376 . 2 1 1 A 53 53 VAL CA C 53 61.350 61.380 -0.030 1 1 377 . 2 1 1 A 53 53 VAL CB C 53 34.300 31.408 2.892 1 1 380 . 2 1 1 A 53 53 VAL N N 53 129.050 123.561 5.489 1 1 381 . 2 1 1 A 54 54 GLY H H 54 8.420 8.887 -0.467 1 1 382 . 2 1 1 A 54 54 GLY HA2 H 54 3.850 3.916 -0.066 1 1 383 . 2 1 1 A 54 54 GLY HA3 H 54 3.850 3.938 -0.088 1 1 384 . 2 1 1 A 54 54 GLY C C 54 173.310 173.016 0.294 1 1 385 . 2 1 1 A 54 54 GLY CA C 54 45.180 44.297 0.883 1 1 386 . 2 1 1 A 54 54 GLY N N 54 116.890 115.477 1.413 1 1 387 . 2 1 1 A 55 55 ILE H H 55 10.190 8.050 2.140 1 1 388 . 2 1 1 A 55 55 ILE HA H 55 4.010 4.530 -0.520 1 1 398 . 2 1 1 A 55 55 ILE C C 55 174.380 175.262 -0.882 1 1 399 . 2 1 1 A 55 55 ILE CA C 55 61.350 59.754 1.596 1 1 400 . 2 1 1 A 55 55 ILE CB C 55 40.840 40.068 0.772 1 1 404 . 2 1 1 A 55 55 ILE N N 55 129.330 121.098 8.232 1 1 405 . 2 1 1 A 56 56 ASP H H 56 8.810 9.612 -0.802 1 1 406 . 2 1 1 A 56 56 ASP HA H 56 4.440 4.614 -0.174 1 1 409 . 2 1 1 A 56 56 ASP C C 56 175.530 175.420 0.110 1 1 410 . 2 1 1 A 56 56 ASP CA C 56 56.460 55.237 1.223 1 1 411 . 2 1 1 A 56 56 ASP CB C 56 42.720 43.072 -0.352 1 1 412 . 2 1 1 A 56 56 ASP N N 56 128.310 127.938 0.372 1 1 413 . 2 1 1 A 57 57 GLU H H 57 7.270 7.587 -0.317 1 1 414 . 2 1 1 A 57 57 GLU HA H 57 4.290 4.787 -0.497 1 1 419 . 2 1 1 A 57 57 GLU C C 57 173.370 174.198 -0.828 1 1 420 . 2 1 1 A 57 57 GLU CA C 57 54.840 55.707 -0.867 1 1 421 . 2 1 1 A 57 57 GLU CB C 57 33.190 33.762 -0.572 1 1 423 . 2 1 1 A 57 57 GLU N N 57 112.810 115.778 -2.968 1 1 424 . 2 1 1 A 58 58 LEU H H 58 8.370 8.672 -0.302 1 1 425 . 2 1 1 A 58 58 LEU HA H 58 4.830 5.042 -0.212 1 1 434 . 2 1 1 A 58 58 LEU C C 58 174.180 174.644 -0.464 1 1 435 . 2 1 1 A 58 58 LEU CA C 58 55.320 52.980 2.340 1 1 436 . 2 1 1 A 58 58 LEU CB C 58 44.300 42.935 1.365 1 1 439 . 2 1 1 A 58 58 LEU N N 58 123.130 121.404 1.726 1 1 440 . 2 1 1 A 59 59 VAL H H 59 9.120 8.759 0.361 1 1 441 . 2 1 1 A 59 59 VAL HA H 59 4.240 4.541 -0.301 1 1 449 . 2 1 1 A 59 59 VAL C C 59 174.960 175.578 -0.618 1 1 450 . 2 1 1 A 59 59 VAL CA C 59 61.760 60.123 1.637 1 1 451 . 2 1 1 A 59 59 VAL CB C 59 33.760 33.242 0.518 1 1 454 . 2 1 1 A 59 59 VAL N N 59 127.930 125.960 1.970 1 1 455 . 2 1 1 A 60 60 ASN H H 60 8.770 8.715 0.055 1 1 456 . 2 1 1 A 60 60 ASN HA H 60 4.250 4.373 -0.123 1 1 461 . 2 1 1 A 60 60 ASN C C 60 172.810 173.789 -0.979 1 1 462 . 2 1 1 A 60 60 ASN CA C 60 54.830 54.507 0.323 1 1 463 . 2 1 1 A 60 60 ASN CB C 60 36.030 36.675 -0.645 1 1 464 . 2 1 1 A 60 60 ASN N N 60 115.500 123.136 -7.636 1 1 466 . 2 1 1 A 61 61 ALA H H 61 7.330 7.275 0.055 1 1 467 . 2 1 1 A 61 61 ALA HA H 61 4.520 4.487 0.033 1 1 471 . 2 1 1 A 61 61 ALA C C 61 174.580 174.691 -0.111 1 1 472 . 2 1 1 A 61 61 ALA CA C 61 51.560 51.414 0.146 1 1 473 . 2 1 1 A 61 61 ALA CB C 61 22.870 22.140 0.730 1 1 474 . 2 1 1 A 61 61 ALA N N 61 115.640 117.117 -1.477 1 1 475 . 2 1 1 A 62 62 GLU H H 62 7.900 9.142 -1.242 1 1 476 . 2 1 1 A 62 62 GLU HA H 62 4.310 4.555 -0.245 1 1 481 . 2 1 1 A 62 62 GLU C C 62 173.790 175.017 -1.227 1 1 482 . 2 1 1 A 62 62 GLU CA C 62 55.080 54.695 0.385 1 1 483 . 2 1 1 A 62 62 GLU CB C 62 32.610 30.097 2.513 1 1 485 . 2 1 1 A 62 62 GLU N N 62 117.400 122.335 -4.935 1 1 486 . 2 1 1 A 63 63 ALA H H 63 8.910 8.691 0.219 1 1 487 . 2 1 1 A 63 63 ALA HA H 63 4.690 4.481 0.209 1 1 491 . 2 1 1 A 63 63 ALA C C 63 175.720 176.454 -0.734 1 1 492 . 2 1 1 A 63 63 ALA CA C 63 50.600 53.013 -2.413 1 1 493 . 2 1 1 A 63 63 ALA CB C 63 20.660 19.096 1.564 1 1 494 . 2 1 1 A 63 63 ALA N N 63 122.480 129.798 -7.318 1 1 495 . 2 1 1 A 64 64 PHE H H 64 9.220 9.342 -0.122 1 1 496 . 2 1 1 A 64 64 PHE HA H 64 4.320 4.684 -0.364 1 1 501 . 2 1 1 A 64 64 PHE C C 64 174.380 176.365 -1.985 1 1 502 . 2 1 1 A 64 64 PHE CA C 64 59.770 58.717 1.053 1 1 503 . 2 1 1 A 64 64 PHE CB C 64 40.830 40.883 -0.053 1 1 504 . 2 1 1 A 64 64 PHE N N 64 120.870 123.566 -2.696 1 1 505 . 2 1 1 A 65 65 ALA H H 65 8.150 7.825 0.325 1 1 506 . 2 1 1 A 65 65 ALA HA H 65 5.280 4.775 0.505 1 1 510 . 2 1 1 A 65 65 ALA C C 65 175.950 175.087 0.863 1 1 511 . 2 1 1 A 65 65 ALA CA C 65 51.120 51.498 -0.378 1 1 512 . 2 1 1 A 65 65 ALA CB C 65 22.850 20.832 2.018 1 1 513 . 2 1 1 A 65 65 ALA N N 65 122.350 119.593 2.757 1 1 514 . 2 1 1 A 66 66 TYR H H 66 9.260 9.273 -0.013 1 1 515 . 2 1 1 A 66 66 TYR HA H 66 5.710 5.557 0.153 1 1 520 . 2 1 1 A 66 66 TYR C C 66 175.690 173.474 2.216 1 1 521 . 2 1 1 A 66 66 TYR CA C 66 54.390 56.373 -1.983 1 1 522 . 2 1 1 A 66 66 TYR CB C 66 41.560 40.109 1.451 1 1 523 . 2 1 1 A 66 66 TYR N N 66 124.350 126.708 -2.358 1 1 524 . 2 1 1 A 67 67 ASP H H 67 9.070 8.900 0.170 1 1 525 . 2 1 1 A 67 67 ASP HA H 67 5.630 5.166 0.464 1 1 528 . 2 1 1 A 67 67 ASP C C 67 174.300 175.586 -1.286 1 1 529 . 2 1 1 A 67 67 ASP CA C 67 51.590 53.718 -2.128 1 1 530 . 2 1 1 A 67 67 ASP CB C 67 44.380 41.514 2.866 1 1 531 . 2 1 1 A 67 67 ASP N N 67 130.490 127.928 2.562 1 1 532 . 2 1 1 A 68 68 PHE H H 68 8.670 8.386 0.284 1 1 533 . 2 1 1 A 68 68 PHE HA H 68 4.890 5.231 -0.341 1 1 538 . 2 1 1 A 68 68 PHE C C 68 172.220 174.265 -2.045 1 1 539 . 2 1 1 A 68 68 PHE CA C 68 57.360 54.760 2.600 1 1 540 . 2 1 1 A 68 68 PHE CB C 68 40.360 42.097 -1.737 1 1 541 . 2 1 1 A 68 68 PHE N N 68 118.200 121.480 -3.280 1 1 542 . 2 1 1 A 69 69 THR H H 69 8.390 8.977 -0.587 1 1 543 . 2 1 1 A 69 69 THR HA H 69 5.170 4.779 0.391 1 1 548 . 2 1 1 A 69 69 THR C C 69 172.620 174.026 -1.406 1 1 549 . 2 1 1 A 69 69 THR CA C 69 61.370 61.804 -0.434 1 1 550 . 2 1 1 A 69 69 THR CB C 69 64.880 69.352 -4.472 1 1 552 . 2 1 1 A 69 69 THR N N 69 115.810 115.487 0.323 1 1 553 . 2 1 1 A 70 70 LEU H H 70 9.560 8.598 0.962 1 1 554 . 2 1 1 A 70 70 LEU HA H 70 5.270 4.762 0.508 1 1 564 . 2 1 1 A 70 70 LEU C C 70 173.800 174.762 -0.962 1 1 565 . 2 1 1 A 70 70 LEU CA C 70 53.460 55.700 -2.240 1 1 566 . 2 1 1 A 70 70 LEU CB C 70 45.040 43.145 1.895 1 1 570 . 2 1 1 A 70 70 LEU N N 70 129.220 130.359 -1.139 1 1 571 . 2 1 1 A 71 71 ASN H H 71 9.590 8.517 1.073 1 1 572 . 2 1 1 A 71 71 ASN HA H 71 5.880 5.536 0.344 1 1 577 . 2 1 1 A 71 71 ASN C C 71 177.970 174.031 3.939 1 1 578 . 2 1 1 A 71 71 ASN CA C 71 52.060 52.272 -0.212 1 1 579 . 2 1 1 A 71 71 ASN CB C 71 41.020 40.195 0.825 1 1 580 . 2 1 1 A 71 71 ASN N N 71 125.970 124.570 1.400 1 1 582 . 2 1 1 A 72 72 TYR H H 72 8.740 9.501 -0.761 1 1 583 . 2 1 1 A 72 72 TYR HA H 72 5.110 5.304 -0.194 1 1 588 . 2 1 1 A 72 72 TYR C C 72 177.720 172.312 5.408 1 1 589 . 2 1 1 A 72 72 TYR CA C 72 55.310 55.589 -0.279 1 1 590 . 2 1 1 A 72 72 TYR CB C 72 41.510 41.161 0.349 1 1 591 . 2 1 1 A 72 72 TYR N N 72 119.640 120.253 -0.613 1 1 592 . 2 1 1 A 73 73 ASP H H 73 9.780 8.956 0.824 1 1 593 . 2 1 1 A 73 73 ASP HA H 73 4.680 5.174 -0.494 1 1 596 . 2 1 1 A 73 73 ASP C C 73 177.290 176.413 0.877 1 1 597 . 2 1 1 A 73 73 ASP CA C 73 53.650 53.006 0.644 1 1 598 . 2 1 1 A 73 73 ASP CB C 73 40.900 42.959 -2.059 1 1 599 . 2 1 1 A 73 73 ASP N N 73 119.290 119.341 -0.051 1 1 600 . 2 1 1 A 74 74 GLU H H 74 9.430 8.698 0.732 1 1 601 . 2 1 1 A 74 74 GLU HA H 74 4.740 4.476 0.264 1 1 606 . 2 1 1 A 74 74 GLU C C 74 176.320 178.594 -2.274 1 1 607 . 2 1 1 A 74 74 GLU CA C 74 57.410 58.205 -0.795 1 1 608 . 2 1 1 A 74 74 GLU CB C 74 29.490 30.479 -0.989 1 1 610 . 2 1 1 A 74 74 GLU N N 74 130.930 120.572 10.358 1 1 611 . 2 1 1 A 75 75 ASN H H 75 8.680 8.366 0.314 1 1 612 . 2 1 1 A 75 75 ASN HA H 75 4.600 4.470 0.130 1 1 617 . 2 1 1 A 75 75 ASN C C 75 175.340 177.055 -1.715 1 1 618 . 2 1 1 A 75 75 ASN CA C 75 54.620 56.137 -1.517 1 1 619 . 2 1 1 A 75 75 ASN CB C 75 38.770 38.599 0.171 1 1 620 . 2 1 1 A 75 75 ASN N N 75 115.040 118.362 -3.322 1 1 622 . 2 1 1 A 76 76 ALA H H 76 7.740 7.820 -0.080 1 1 623 . 2 1 1 A 76 76 ALA HA H 76 4.310 4.484 -0.174 1 1 627 . 2 1 1 A 76 76 ALA C C 76 175.550 176.957 -1.407 1 1 628 . 2 1 1 A 76 76 ALA CA C 76 53.260 53.101 0.159 1 1 629 . 2 1 1 A 76 76 ALA CB C 76 21.450 20.976 0.474 1 1 630 . 2 1 1 A 76 76 ALA N N 76 122.200 119.741 2.459 1 1 631 . 2 1 1 A 77 77 PHE H H 77 8.070 7.727 0.343 1 1 632 . 2 1 1 A 77 77 PHE HA H 77 5.650 4.926 0.724 1 1 637 . 2 1 1 A 77 77 PHE C C 77 174.570 175.264 -0.694 1 1 638 . 2 1 1 A 77 77 PHE CA C 77 56.360 57.438 -1.078 1 1 639 . 2 1 1 A 77 77 PHE CB C 77 46.080 40.905 5.175 1 1 640 . 2 1 1 A 77 77 PHE N N 77 114.160 114.106 0.054 1 1 641 . 2 1 1 A 78 78 GLU H H 78 8.800 9.086 -0.286 1 1 642 . 2 1 1 A 78 78 GLU HA H 78 4.900 5.098 -0.198 1 1 647 . 2 1 1 A 78 78 GLU C C 78 175.950 174.195 1.755 1 1 648 . 2 1 1 A 78 78 GLU CA C 78 53.670 56.249 -2.579 1 1 649 . 2 1 1 A 78 78 GLU CB C 78 33.600 34.010 -0.410 1 1 651 . 2 1 1 A 78 78 GLU N N 78 117.590 120.491 -2.901 1 1 652 . 2 1 1 A 79 79 TYR H H 79 8.770 9.133 -0.363 1 1 653 . 2 1 1 A 79 79 TYR HA H 79 4.250 4.860 -0.610 1 1 658 . 2 1 1 A 79 79 TYR C C 79 174.580 174.859 -0.279 1 1 659 . 2 1 1 A 79 79 TYR CA C 79 59.250 58.188 1.062 1 1 660 . 2 1 1 A 79 79 TYR CB C 79 38.310 40.408 -2.098 1 1 661 . 2 1 1 A 79 79 TYR N N 79 126.560 125.565 0.995 1 1 662 . 2 1 1 A 80 80 VAL H H 80 8.220 8.400 -0.180 1 1 663 . 2 1 1 A 80 80 VAL HA H 80 3.690 3.934 -0.244 1 1 671 . 2 1 1 A 80 80 VAL C C 80 174.780 174.839 -0.059 1 1 672 . 2 1 1 A 80 80 VAL CA C 80 64.400 62.869 1.531 1 1 673 . 2 1 1 A 80 80 VAL CB C 80 33.510 32.882 0.628 1 1 676 . 2 1 1 A 80 80 VAL N N 80 129.460 125.213 4.247 1 1 677 . 2 1 1 A 81 81 GLU H H 81 6.920 7.504 -0.584 1 1 678 . 2 1 1 A 81 81 GLU HA H 81 4.260 4.614 -0.354 1 1 683 . 2 1 1 A 81 81 GLU C C 81 171.840 175.472 -3.632 1 1 684 . 2 1 1 A 81 81 GLU CA C 81 55.310 55.168 0.142 1 1 685 . 2 1 1 A 81 81 GLU CB C 81 30.520 33.612 -3.092 1 1 687 . 2 1 1 A 81 81 GLU N N 81 112.430 117.234 -4.804 1 1 688 . 2 1 1 A 82 82 ALA H H 82 8.310 8.589 -0.279 1 1 689 . 2 1 1 A 82 82 ALA HA H 82 5.650 4.858 0.792 1 1 693 . 2 1 1 A 82 82 ALA C C 82 176.110 177.233 -1.123 1 1 694 . 2 1 1 A 82 82 ALA CA C 82 50.620 51.648 -1.028 1 1 695 . 2 1 1 A 82 82 ALA CB C 82 21.770 19.931 1.839 1 1 696 . 2 1 1 A 82 82 ALA N N 82 121.240 126.718 -5.478 1 1 697 . 2 1 1 A 83 83 ILE H H 83 9.150 9.548 -0.398 1 1 698 . 2 1 1 A 83 83 ILE HA H 83 4.600 5.040 -0.440 1 1 708 . 2 1 1 A 83 83 ILE C C 83 174.810 174.749 0.061 1 1 709 . 2 1 1 A 83 83 ILE CA C 83 60.060 59.141 0.919 1 1 710 . 2 1 1 A 83 83 ILE CB C 83 42.440 42.539 -0.099 1 1 714 . 2 1 1 A 83 83 ILE N N 83 119.720 118.890 0.830 1 1 715 . 2 1 1 A 84 84 SER H H 84 8.350 8.703 -0.353 1 1 716 . 2 1 1 A 84 84 SER HA H 84 4.660 4.809 -0.149 1 1 719 . 2 1 1 A 84 84 SER C C 84 177.550 172.057 5.493 1 1 720 . 2 1 1 A 84 84 SER CA C 84 57.330 55.792 1.538 1 1 721 . 2 1 1 A 84 84 SER CB C 84 66.490 65.245 1.245 1 1 722 . 2 1 1 A 84 84 SER N N 84 116.740 117.441 -0.701 1 1 723 . 2 1 1 A 85 85 ASP H H 85 8.740 8.686 0.054 1 1 724 . 2 1 1 A 85 85 ASP HA H 85 4.820 4.712 0.108 1 1 727 . 2 1 1 A 85 85 ASP C C 85 176.090 176.783 -0.693 1 1 728 . 2 1 1 A 85 85 ASP CA C 85 53.480 52.584 0.896 1 1 729 . 2 1 1 A 85 85 ASP CB C 85 42.480 42.957 -0.477 1 1 730 . 2 1 1 A 85 85 ASP N N 85 120.960 121.723 -0.763 1 1 731 . 2 1 1 A 86 86 ASP H H 86 8.380 8.696 -0.316 1 1 732 . 2 1 1 A 86 86 ASP HA H 86 4.450 4.874 -0.424 1 1 735 . 2 1 1 A 86 86 ASP C C 86 177.100 176.118 0.982 1 1 736 . 2 1 1 A 86 86 ASP CA C 86 56.240 52.817 3.423 1 1 737 . 2 1 1 A 86 86 ASP CB C 86 41.100 40.458 0.642 1 1 738 . 2 1 1 A 86 86 ASP N N 86 117.710 119.777 -2.067 1 1 739 . 2 1 1 A 87 87 GLY H H 87 8.690 7.606 1.084 1 1 740 . 2 1 1 A 87 87 GLY HA2 H 87 3.870 4.102 -0.232 1 1 741 . 2 1 1 A 87 87 GLY HA3 H 87 4.090 4.110 -0.020 1 1 742 . 2 1 1 A 87 87 GLY C C 87 173.800 174.112 -0.312 1 1 743 . 2 1 1 A 87 87 GLY CA C 87 45.770 45.655 0.115 1 1 744 . 2 1 1 A 87 87 GLY N N 87 108.540 108.086 0.454 1 1 745 . 2 1 1 A 88 88 VAL H H 88 7.910 7.638 0.272 1 1 746 . 2 1 1 A 88 88 VAL HA H 88 4.780 4.165 0.615 1 1 754 . 2 1 1 A 88 88 VAL C C 88 173.970 175.339 -1.369 1 1 755 . 2 1 1 A 88 88 VAL CA C 88 60.900 62.347 -1.447 1 1 756 . 2 1 1 A 88 88 VAL CB C 88 35.460 32.665 2.795 1 1 759 . 2 1 1 A 88 88 VAL N N 88 119.790 120.219 -0.429 1 1 760 . 2 1 1 A 89 89 PHE H H 89 9.210 9.644 -0.434 1 1 761 . 2 1 1 A 89 89 PHE HA H 89 4.930 5.289 -0.359 1 1 766 . 2 1 1 A 89 89 PHE C C 89 173.970 173.931 0.039 1 1 767 . 2 1 1 A 89 89 PHE CA C 89 56.450 55.788 0.662 1 1 768 . 2 1 1 A 89 89 PHE CB C 89 41.120 40.823 0.297 1 1 769 . 2 1 1 A 89 89 PHE N N 89 126.780 127.270 -0.490 1 1 770 . 2 1 1 A 90 90 VAL H H 90 7.880 8.771 -0.891 1 1 771 . 2 1 1 A 90 90 VAL HA H 90 4.860 4.679 0.181 1 1 779 . 2 1 1 A 90 90 VAL C C 90 173.190 175.170 -1.980 1 1 780 . 2 1 1 A 90 90 VAL CA C 90 59.750 61.276 -1.526 1 1 781 . 2 1 1 A 90 90 VAL CB C 90 34.770 32.858 1.912 1 1 784 . 2 1 1 A 90 90 VAL N N 90 124.990 127.791 -2.801 1 1 785 . 2 1 1 A 91 91 ASN H H 91 8.670 8.691 -0.021 1 1 786 . 2 1 1 A 91 91 ASN HA H 91 4.730 5.113 -0.383 1 1 791 . 2 1 1 A 91 91 ASN C C 91 173.200 173.943 -0.743 1 1 792 . 2 1 1 A 91 91 ASN CA C 91 51.970 53.304 -1.334 1 1 793 . 2 1 1 A 91 91 ASN CB C 91 41.340 41.330 0.010 1 1 794 . 2 1 1 A 91 91 ASN N N 91 124.860 123.381 1.479 1 1 796 . 2 1 1 A 92 92 ALA H H 92 8.840 9.125 -0.285 1 1 797 . 2 1 1 A 92 92 ALA HA H 92 5.290 5.309 -0.019 1 1 801 . 2 1 1 A 92 92 ALA C C 92 176.330 176.307 0.023 1 1 802 . 2 1 1 A 92 92 ALA CA C 92 50.170 51.096 -0.926 1 1 803 . 2 1 1 A 92 92 ALA CB C 92 23.610 21.078 2.532 1 1 804 . 2 1 1 A 92 92 ALA N N 92 128.510 128.728 -0.218 1 1 805 . 2 1 1 A 93 93 LYS H H 93 8.670 8.954 -0.284 1 1 806 . 2 1 1 A 93 93 LYS HA H 93 4.460 4.812 -0.352 1 1 815 . 2 1 1 A 93 93 LYS C C 93 174.170 174.916 -0.746 1 1 816 . 2 1 1 A 93 93 LYS CA C 93 55.010 55.071 -0.061 1 1 817 . 2 1 1 A 93 93 LYS CB C 93 36.430 35.854 0.576 1 1 821 . 2 1 1 A 93 93 LYS N N 93 121.300 119.468 1.832 1 1 822 . 2 1 1 A 94 94 LYS H H 94 8.960 8.534 0.426 1 1 823 . 2 1 1 A 94 94 LYS HA H 94 4.460 4.071 0.389 1 1 832 . 2 1 1 A 94 94 LYS C C 94 176.330 176.928 -0.598 1 1 833 . 2 1 1 A 94 94 LYS CA C 94 56.720 56.595 0.125 1 1 834 . 2 1 1 A 94 94 LYS CB C 94 31.930 32.658 -0.728 1 1 837 . 2 1 1 A 94 94 LYS N N 94 127.060 127.187 -0.127 1 1 838 . 2 1 1 A 95 95 ILE H H 95 8.290 8.368 -0.078 1 1 839 . 2 1 1 A 95 95 ILE HA H 95 4.120 4.127 -0.007 1 1 849 . 2 1 1 A 95 95 ILE C C 95 175.740 175.316 0.424 1 1 850 . 2 1 1 A 95 95 ILE CA C 95 62.760 62.630 0.130 1 1 851 . 2 1 1 A 95 95 ILE CB C 95 38.890 39.142 -0.252 1 1 855 . 2 1 1 A 95 95 ILE N N 95 126.530 127.993 -1.463 1 1 856 . 2 1 1 A 96 96 GLU H H 96 8.030 7.242 0.788 1 1 857 . 2 1 1 A 96 96 GLU HA H 96 4.450 4.570 -0.120 1 1 862 . 2 1 1 A 96 96 GLU C C 96 174.380 173.903 0.477 1 1 863 . 2 1 1 A 96 96 GLU CA C 96 54.320 55.644 -1.324 1 1 864 . 2 1 1 A 96 96 GLU CB C 96 32.770 32.642 0.128 1 1 866 . 2 1 1 A 96 96 GLU N N 96 117.080 120.511 -3.431 1 1 867 . 2 1 1 A 97 97 ASP H H 97 8.730 8.763 -0.033 1 1 868 . 2 1 1 A 97 97 ASP HA H 97 4.360 4.594 -0.234 1 1 871 . 2 1 1 A 97 97 ASP C C 97 177.100 177.112 -0.012 1 1 872 . 2 1 1 A 97 97 ASP CA C 97 57.160 55.302 1.858 1 1 873 . 2 1 1 A 97 97 ASP CB C 97 39.920 41.112 -1.192 1 1 874 . 2 1 1 A 97 97 ASP N N 97 120.570 120.571 -0.001 1 1 875 . 2 1 1 A 98 98 GLY H H 98 8.760 8.623 0.137 1 1 876 . 2 1 1 A 98 98 GLY HA2 H 98 2.120 1.662 0.458 1 1 877 . 2 1 1 A 98 98 GLY HA3 H 98 3.910 3.345 0.565 1 1 878 . 2 1 1 A 98 98 GLY C C 98 174.000 172.851 1.149 1 1 879 . 2 1 1 A 98 98 GLY CA C 98 45.720 45.212 0.508 1 1 880 . 2 1 1 A 98 98 GLY N N 98 112.090 111.788 0.302 1 1 881 . 2 1 1 A 99 99 LYS H H 99 7.890 7.214 0.676 1 1 882 . 2 1 1 A 99 99 LYS HA H 99 5.330 5.243 0.087 1 1 891 . 2 1 1 A 99 99 LYS C C 99 174.750 174.359 0.391 1 1 892 . 2 1 1 A 99 99 LYS CA C 99 55.990 54.844 1.146 1 1 893 . 2 1 1 A 99 99 LYS CB C 99 37.840 35.421 2.419 1 1 897 . 2 1 1 A 99 99 LYS N N 99 118.050 114.858 3.192 1 1 898 . 2 1 1 A 100 100 VAL H H 100 8.980 8.530 0.450 1 1 899 . 2 1 1 A 100 100 VAL HA H 100 4.510 4.714 -0.204 1 1 907 . 2 1 1 A 100 100 VAL C C 100 174.760 173.821 0.939 1 1 908 . 2 1 1 A 100 100 VAL CA C 100 60.130 59.037 1.093 1 1 909 . 2 1 1 A 100 100 VAL CB C 100 35.240 35.784 -0.544 1 1 912 . 2 1 1 A 100 100 VAL N N 100 123.850 119.763 4.087 1 1 913 . 2 1 1 A 101 101 ARG H H 101 8.810 8.159 0.651 1 1 914 . 2 1 1 A 101 101 ARG HA H 101 4.850 4.446 0.404 1 1 921 . 2 1 1 A 101 101 ARG C C 101 174.770 174.409 0.361 1 1 922 . 2 1 1 A 101 101 ARG CA C 101 54.580 55.099 -0.519 1 1 923 . 2 1 1 A 101 101 ARG CB C 101 32.400 31.223 1.177 1 1 926 . 2 1 1 A 101 101 ARG N N 101 129.210 123.932 5.278 1 1 927 . 2 1 1 A 102 102 VAL H H 102 9.100 8.256 0.844 1 1 928 . 2 1 1 A 102 102 VAL HA H 102 4.120 4.400 -0.280 1 1 936 . 2 1 1 A 102 102 VAL C C 102 171.640 173.814 -2.174 1 1 937 . 2 1 1 A 102 102 VAL CA C 102 61.350 60.694 0.656 1 1 938 . 2 1 1 A 102 102 VAL CB C 102 32.530 32.596 -0.066 1 1 941 . 2 1 1 A 102 102 VAL N N 102 130.470 123.858 6.612 1 1 942 . 2 1 1 A 103 103 LEU H H 103 8.110 9.215 -1.105 1 1 943 . 2 1 1 A 103 103 LEU HA H 103 5.120 4.639 0.481 1 1 953 . 2 1 1 A 103 103 LEU C C 103 176.410 175.736 0.674 1 1 954 . 2 1 1 A 103 103 LEU CA C 103 53.380 54.118 -0.738 1 1 955 . 2 1 1 A 103 103 LEU CB C 103 43.680 41.074 2.606 1 1 959 . 2 1 1 A 103 103 LEU N N 103 125.560 130.043 -4.483 1 1 960 . 2 1 1 A 104 104 VAL H H 104 9.580 9.173 0.407 1 1 961 . 2 1 1 A 104 104 VAL HA H 104 5.260 5.135 0.125 1 1 969 . 2 1 1 A 104 104 VAL C C 104 176.030 174.324 1.706 1 1 970 . 2 1 1 A 104 104 VAL CA C 104 60.220 59.646 0.574 1 1 971 . 2 1 1 A 104 104 VAL CB C 104 34.310 35.330 -1.020 1 1 974 . 2 1 1 A 104 104 VAL N N 104 125.790 126.332 -0.542 1 1 975 . 2 1 1 A 105 105 SER H H 105 9.340 8.570 0.770 1 1 976 . 2 1 1 A 105 105 SER HA H 105 5.300 5.110 0.190 1 1 979 . 2 1 1 A 105 105 SER C C 105 173.600 172.924 0.676 1 1 980 . 2 1 1 A 105 105 SER CA C 105 57.450 57.212 0.238 1 1 981 . 2 1 1 A 105 105 SER CB C 105 65.600 66.828 -1.228 1 1 982 . 2 1 1 A 105 105 SER N N 105 119.220 122.153 -2.933 1 1 983 . 2 1 1 A 106 106 SER H H 106 8.350 8.717 -0.367 1 1 984 . 2 1 1 A 106 106 SER HA H 106 4.720 4.786 -0.066 1 1 987 . 2 1 1 A 106 106 SER C C 106 176.930 173.910 3.020 1 1 988 . 2 1 1 A 106 106 SER CA C 106 58.170 57.715 0.455 1 1 989 . 2 1 1 A 106 106 SER CB C 106 64.170 63.390 0.780 1 1 990 . 2 1 1 A 106 106 SER N N 106 114.800 117.414 -2.614 1 1 991 . 2 1 1 A 107 107 LEU H H 107 8.770 8.538 0.232 1 1 992 . 2 1 1 A 107 107 LEU HA H 107 4.710 4.644 0.066 1 1 1001 . 2 1 1 A 107 107 LEU C C 107 178.280 177.118 1.162 1 1 1002 . 2 1 1 A 107 107 LEU CA C 107 55.280 54.163 1.117 1 1 1003 . 2 1 1 A 107 107 LEU CB C 107 43.410 42.481 0.929 1 1 1007 . 2 1 1 A 107 107 LEU N N 107 127.210 129.270 -2.060 1 1 1008 . 2 1 1 A 108 108 THR H H 108 8.210 7.850 0.360 1 1 1009 . 2 1 1 A 108 108 THR HA H 108 4.400 4.603 -0.203 1 1 1015 . 2 1 1 A 108 108 THR C C 108 176.130 175.533 0.597 1 1 1016 . 2 1 1 A 108 108 THR CA C 108 62.050 62.342 -0.292 1 1 1017 . 2 1 1 A 108 108 THR CB C 108 70.910 71.175 -0.265 1 1 1019 . 2 1 1 A 108 108 THR N N 108 108.810 111.399 -2.589 1 1 1020 . 2 1 1 A 109 109 GLY H H 109 8.250 7.981 0.269 1 1 1021 . 2 1 1 A 109 109 GLY HA2 H 109 3.780 4.072 -0.292 1 1 1022 . 2 1 1 A 109 109 GLY HA3 H 109 4.290 4.083 0.207 1 1 1023 . 2 1 1 A 109 109 GLY C C 109 173.180 174.276 -1.096 1 1 1024 . 2 1 1 A 109 109 GLY CA C 109 45.340 45.321 0.019 1 1 1025 . 2 1 1 A 109 109 GLY N N 109 110.160 110.714 -0.554 1 1 1026 . 2 1 1 A 110 110 GLU H H 110 7.960 7.550 0.410 1 1 1027 . 2 1 1 A 110 110 GLU HA H 110 4.760 4.901 -0.141 1 1 1032 . 2 1 1 A 110 110 GLU CA C 110 53.450 53.934 -0.484 1 1 1033 . 2 1 1 A 110 110 GLU CB C 110 30.020 31.094 -1.074 1 1 1035 . 2 1 1 A 110 110 GLU N N 110 119.720 117.758 1.962 1 1 1036 . 2 1 1 A 111 111 PRO HA H 111 3.250 4.374 -1.124 1 1 1043 . 2 1 1 A 111 111 PRO C C 111 176.710 176.192 0.518 1 1 1044 . 2 1 1 A 111 111 PRO CA C 111 62.240 62.071 0.169 1 1 1045 . 2 1 1 A 111 111 PRO CB C 111 31.990 32.370 -0.380 1 1 1048 . 2 1 1 A 112 112 LEU H H 112 8.840 7.947 0.893 1 1 1049 . 2 1 1 A 112 112 LEU HA H 112 4.290 4.277 0.013 1 1 1059 . 2 1 1 A 112 112 LEU CA C 112 52.220 53.855 -1.635 1 1 1060 . 2 1 1 A 112 112 LEU CB C 112 41.090 41.813 -0.723 1 1 1063 . 2 1 1 A 112 112 LEU N N 112 122.420 122.003 0.417 1 1 1064 . 2 1 1 A 113 113 PRO HA H 113 4.380 4.240 0.140 1 1 1071 . 2 1 1 A 113 113 PRO C C 113 176.100 177.089 -0.989 1 1 1072 . 2 1 1 A 113 113 PRO CA C 113 61.930 65.254 -3.324 1 1 1073 . 2 1 1 A 113 113 PRO CB C 113 32.470 31.706 0.764 1 1 1076 . 2 1 1 A 114 114 ALA H H 114 8.070 7.833 0.237 1 1 1077 . 2 1 1 A 114 114 ALA HA H 114 4.550 3.982 0.568 1 1 1081 . 2 1 1 A 114 114 ALA C C 114 177.490 177.291 0.199 1 1 1082 . 2 1 1 A 114 114 ALA CA C 114 51.340 53.759 -2.419 1 1 1083 . 2 1 1 A 114 114 ALA CB C 114 19.940 18.210 1.730 1 1 1084 . 2 1 1 A 114 114 ALA N N 114 121.460 120.325 1.135 1 1 1085 . 2 1 1 A 115 115 LYS H H 115 9.000 8.622 0.378 1 1 1086 . 2 1 1 A 115 115 LYS HA H 115 3.930 3.858 0.072 1 1 1095 . 2 1 1 A 115 115 LYS C C 115 175.740 175.019 0.721 1 1 1096 . 2 1 1 A 115 115 LYS CA C 115 57.580 57.790 -0.210 1 1 1097 . 2 1 1 A 115 115 LYS CB C 115 29.510 30.541 -1.031 1 1 1101 . 2 1 1 A 115 115 LYS N N 115 112.560 115.639 -3.079 1 1 1102 . 2 1 1 A 116 116 GLU H H 116 7.620 7.670 -0.050 1 1 1103 . 2 1 1 A 116 116 GLU HA H 116 4.550 4.784 -0.234 1 1 1108 . 2 1 1 A 116 116 GLU C C 116 176.110 174.936 1.174 1 1 1109 . 2 1 1 A 116 116 GLU CA C 116 54.570 54.950 -0.380 1 1 1110 . 2 1 1 A 116 116 GLU CB C 116 33.680 31.152 2.528 1 1 1112 . 2 1 1 A 116 116 GLU N N 116 115.710 117.247 -1.537 1 1 1113 . 2 1 1 A 117 117 VAL H H 117 8.770 8.764 0.006 1 1 1114 . 2 1 1 A 117 117 VAL HA H 117 3.200 4.006 -0.806 1 1 1122 . 2 1 1 A 117 117 VAL C C 117 175.740 176.020 -0.280 1 1 1123 . 2 1 1 A 117 117 VAL CA C 117 65.340 63.418 1.922 1 1 1124 . 2 1 1 A 117 117 VAL CB C 117 31.290 30.868 0.422 1 1 1127 . 2 1 1 A 117 117 VAL N N 117 124.450 120.800 3.650 1 1 1128 . 2 1 1 A 118 118 LEU H H 118 8.550 8.953 -0.403 1 1 1129 . 2 1 1 A 118 118 LEU HA H 118 4.540 4.430 0.110 1 1 1139 . 2 1 1 A 118 118 LEU C C 118 176.210 176.499 -0.289 1 1 1140 . 2 1 1 A 118 118 LEU CA C 118 55.510 56.281 -0.771 1 1 1141 . 2 1 1 A 118 118 LEU CB C 118 44.600 43.234 1.366 1 1 1145 . 2 1 1 A 118 118 LEU N N 118 128.440 130.187 -1.747 1 1 1146 . 2 1 1 A 119 119 ALA H H 119 7.970 7.603 0.367 1 1 1147 . 2 1 1 A 119 119 ALA HA H 119 4.740 4.810 -0.070 1 1 1151 . 2 1 1 A 119 119 ALA C C 119 174.570 175.175 -0.605 1 1 1152 . 2 1 1 A 119 119 ALA CA C 119 50.770 51.853 -1.083 1 1 1153 . 2 1 1 A 119 119 ALA CB C 119 22.450 22.607 -0.157 1 1 1154 . 2 1 1 A 119 119 ALA N N 119 118.100 118.855 -0.755 1 1 1155 . 2 1 1 A 120 120 LYS H H 120 8.760 9.412 -0.652 1 1 1156 . 2 1 1 A 120 120 LYS HA H 120 5.240 5.371 -0.131 1 1 1165 . 2 1 1 A 120 120 LYS C C 120 175.340 174.191 1.149 1 1 1166 . 2 1 1 A 120 120 LYS CA C 120 54.220 54.878 -0.658 1 1 1167 . 2 1 1 A 120 120 LYS CB C 120 34.340 34.547 -0.207 1 1 1171 . 2 1 1 A 120 120 LYS N N 120 120.010 122.170 -2.160 1 1 1172 . 2 1 1 A 121 121 VAL H H 121 9.410 8.725 0.685 1 1 1173 . 2 1 1 A 121 121 VAL HA H 121 4.230 4.741 -0.511 1 1 1181 . 2 1 1 A 121 121 VAL C C 121 173.980 175.035 -1.055 1 1 1182 . 2 1 1 A 121 121 VAL CA C 121 62.370 61.225 1.145 1 1 1183 . 2 1 1 A 121 121 VAL CB C 121 32.410 33.318 -0.908 1 1 1186 . 2 1 1 A 121 121 VAL N N 121 124.960 125.690 -0.730 1 1 1187 . 2 1 1 A 122 122 VAL H H 122 9.280 8.407 0.873 1 1 1188 . 2 1 1 A 122 122 VAL HA H 122 4.360 4.656 -0.296 1 1 1196 . 2 1 1 A 122 122 VAL C C 122 174.190 175.503 -1.313 1 1 1197 . 2 1 1 A 122 122 VAL CA C 122 62.760 61.812 0.948 1 1 1198 . 2 1 1 A 122 122 VAL CB C 122 32.020 32.482 -0.462 1 1 1201 . 2 1 1 A 122 122 VAL N N 122 128.990 127.137 1.853 1 1 1202 . 2 1 1 A 123 123 LEU H H 123 8.610 8.868 -0.258 1 1 1203 . 2 1 1 A 123 123 LEU HA H 123 4.900 5.078 -0.178 1 1 1213 . 2 1 1 A 123 123 LEU C C 123 174.950 176.526 -1.576 1 1 1214 . 2 1 1 A 123 123 LEU CA C 123 52.050 53.451 -1.401 1 1 1215 . 2 1 1 A 123 123 LEU CB C 123 45.210 42.750 2.460 1 1 1219 . 2 1 1 A 123 123 LEU N N 123 127.200 128.287 -1.087 1 1 1220 . 2 1 1 A 124 124 ARG H H 124 9.540 8.775 0.765 1 1 1221 . 2 1 1 A 124 124 ARG HA H 124 4.900 4.322 0.578 1 1 1229 . 2 1 1 A 124 124 ARG C C 124 176.320 175.921 0.399 1 1 1230 . 2 1 1 A 124 124 ARG CA C 124 55.320 57.101 -1.781 1 1 1231 . 2 1 1 A 124 124 ARG CB C 124 31.750 30.659 1.091 1 1 1234 . 2 1 1 A 124 124 ARG N N 124 124.290 125.655 -1.365 1 1 1236 . 2 1 1 A 125 125 ALA H H 125 8.880 8.582 0.298 1 1 1237 . 2 1 1 A 125 125 ALA HA H 125 4.380 4.065 0.315 1 1 1241 . 2 1 1 A 125 125 ALA C C 125 177.290 177.657 -0.367 1 1 1242 . 2 1 1 A 125 125 ALA CA C 125 52.530 51.250 1.280 1 1 1243 . 2 1 1 A 125 125 ALA CB C 125 19.870 17.240 2.630 1 1 1244 . 2 1 1 A 125 125 ALA N N 125 130.790 130.067 0.723 1 1 1245 . 2 1 1 A 126 126 GLU H H 126 9.260 8.530 0.730 1 1 1246 . 2 1 1 A 126 126 GLU HA H 126 4.460 4.311 0.149 1 1 1251 . 2 1 1 A 126 126 GLU C C 126 176.120 176.270 -0.150 1 1 1252 . 2 1 1 A 126 126 GLU CA C 126 56.940 57.135 -0.195 1 1 1253 . 2 1 1 A 126 126 GLU CB C 126 32.450 30.140 2.310 1 1 1255 . 2 1 1 A 126 126 GLU N N 126 125.740 123.546 2.194 1 1 1256 . 2 1 1 A 127 127 ALA H H 127 7.460 7.484 -0.024 1 1 1257 . 2 1 1 A 127 127 ALA HA H 127 4.360 4.599 -0.239 1 1 1261 . 2 1 1 A 127 127 ALA C C 127 173.400 175.784 -2.384 1 1 1262 . 2 1 1 A 127 127 ALA CA C 127 51.360 51.628 -0.268 1 1 1263 . 2 1 1 A 127 127 ALA CB C 127 22.180 21.961 0.219 1 1 1264 . 2 1 1 A 127 127 ALA N N 127 120.910 119.451 1.459 1 1 1265 . 2 1 1 A 128 128 LYS H H 128 7.940 8.655 -0.715 1 1 1266 . 2 1 1 A 128 128 LYS HA H 128 3.580 4.131 -0.551 1 1 1275 . 2 1 1 A 128 128 LYS C C 128 176.080 175.699 0.381 1 1 1276 . 2 1 1 A 128 128 LYS CA C 128 56.860 56.937 -0.077 1 1 1277 . 2 1 1 A 128 128 LYS CB C 128 33.170 33.172 -0.002 1 1 1281 . 2 1 1 A 128 128 LYS N N 128 116.520 124.329 -7.809 1 1 1282 . 2 1 1 A 129 129 ALA H H 129 8.590 8.690 -0.100 1 1 1283 . 2 1 1 A 129 129 ALA HA H 129 4.390 4.673 -0.283 1 1 1287 . 2 1 1 A 129 129 ALA C C 129 174.970 175.503 -0.533 1 1 1288 . 2 1 1 A 129 129 ALA CA C 129 52.970 51.366 1.604 1 1 1289 . 2 1 1 A 129 129 ALA CB C 129 21.500 18.836 2.664 1 1 1290 . 2 1 1 A 129 129 ALA N N 129 124.710 127.778 -3.068 1 1 1291 . 2 1 1 A 130 130 GLU H H 130 8.660 8.160 0.500 1 1 1292 . 2 1 1 A 130 130 GLU HA H 130 4.660 4.185 0.475 1 1 1297 . 2 1 1 A 130 130 GLU C C 130 177.390 177.068 0.322 1 1 1298 . 2 1 1 A 130 130 GLU CA C 130 55.070 57.609 -2.539 1 1 1299 . 2 1 1 A 130 130 GLU CB C 130 30.860 29.167 1.693 1 1 1301 . 2 1 1 A 130 130 GLU N N 130 123.180 118.101 5.079 1 1 1302 . 2 1 1 A 131 131 GLY H H 131 9.170 9.067 0.103 1 1 1303 . 2 1 1 A 131 131 GLY HA2 H 131 3.560 3.980 -0.420 1 1 1304 . 2 1 1 A 131 131 GLY HA3 H 131 3.750 3.985 -0.235 1 1 1305 . 2 1 1 A 131 131 GLY C C 131 174.550 174.428 0.122 1 1 1306 . 2 1 1 A 131 131 GLY CA C 131 47.660 45.039 2.621 1 1 1307 . 2 1 1 A 131 131 GLY N N 131 115.530 113.358 2.172 1 1 1308 . 2 1 1 A 132 132 SER H H 132 8.430 8.399 0.031 1 1 1309 . 2 1 1 A 132 132 SER HA H 132 4.170 4.419 -0.249 1 1 1312 . 2 1 1 A 132 132 SER C C 132 175.350 173.715 1.635 1 1 1313 . 2 1 1 A 132 132 SER CA C 132 59.050 59.118 -0.068 1 1 1314 . 2 1 1 A 132 132 SER CB C 132 64.880 62.689 2.191 1 1 1315 . 2 1 1 A 132 132 SER N N 132 115.930 119.594 -3.664 1 1 1316 . 2 1 1 A 133 133 ASN H H 133 8.850 8.389 0.461 1 1 1317 . 2 1 1 A 133 133 ASN HA H 133 4.910 5.173 -0.263 1 1 1322 . 2 1 1 A 133 133 ASN C C 133 175.450 174.828 0.622 1 1 1323 . 2 1 1 A 133 133 ASN CA C 133 54.920 54.040 0.880 1 1 1324 . 2 1 1 A 133 133 ASN CB C 133 41.060 39.270 1.790 1 1 1325 . 2 1 1 A 133 133 ASN N N 133 125.590 123.375 2.215 1 1 1327 . 2 1 1 A 134 134 LEU H H 134 9.070 9.319 -0.249 1 1 1328 . 2 1 1 A 134 134 LEU HA H 134 5.230 5.357 -0.127 1 1 1338 . 2 1 1 A 134 134 LEU C C 134 175.240 175.394 -0.154 1 1 1339 . 2 1 1 A 134 134 LEU CA C 134 53.470 54.020 -0.550 1 1 1340 . 2 1 1 A 134 134 LEU CB C 134 45.090 44.880 0.210 1 1 1344 . 2 1 1 A 134 134 LEU N N 134 129.210 121.169 8.041 1 1 1345 . 2 1 1 A 135 135 SER H H 135 8.690 8.576 0.114 1 1 1346 . 2 1 1 A 135 135 SER HA H 135 5.280 5.452 -0.172 1 1 1349 . 2 1 1 A 135 135 SER C C 135 173.590 173.624 -0.034 1 1 1350 . 2 1 1 A 135 135 SER CA C 135 56.220 56.644 -0.424 1 1 1351 . 2 1 1 A 135 135 SER CB C 135 66.510 64.606 1.904 1 1 1352 . 2 1 1 A 135 135 SER N N 135 113.020 119.465 -6.445 1 1 1353 . 2 1 1 A 136 136 VAL H H 136 8.940 8.740 0.200 1 1 1354 . 2 1 1 A 136 136 VAL HA H 136 5.500 5.217 0.283 1 1 1362 . 2 1 1 A 136 136 VAL C C 136 175.730 175.248 0.482 1 1 1363 . 2 1 1 A 136 136 VAL CA C 136 60.960 60.904 0.056 1 1 1364 . 2 1 1 A 136 136 VAL CB C 136 33.630 33.001 0.629 1 1 1367 . 2 1 1 A 136 136 VAL N N 136 124.340 119.791 4.549 1 1 1368 . 2 1 1 A 137 137 THR H H 137 9.240 8.545 0.695 1 1 1369 . 2 1 1 A 137 137 THR HA H 137 4.920 4.820 0.100 1 1 1374 . 2 1 1 A 137 137 THR C C 137 173.500 174.173 -0.673 1 1 1375 . 2 1 1 A 137 137 THR CA C 137 59.120 60.279 -1.159 1 1 1376 . 2 1 1 A 137 137 THR CB C 137 72.500 70.760 1.740 1 1 1378 . 2 1 1 A 137 137 THR N N 137 117.010 118.129 -1.119 1 1 1379 . 2 1 1 A 138 138 ASN H H 138 9.190 8.851 0.339 1 1 1380 . 2 1 1 A 138 138 ASN HA H 138 4.420 4.274 0.146 1 1 1385 . 2 1 1 A 138 138 ASN C C 138 175.550 174.385 1.165 1 1 1386 . 2 1 1 A 138 138 ASN CA C 138 54.350 54.250 0.100 1 1 1387 . 2 1 1 A 138 138 ASN CB C 138 37.380 36.690 0.690 1 1 1388 . 2 1 1 A 138 138 ASN N N 138 115.270 118.755 -3.485 1 1 1390 . 2 1 1 A 139 139 SER H H 139 8.560 7.956 0.604 1 1 1391 . 2 1 1 A 139 139 SER HA H 139 5.800 4.338 1.462 1 1 1394 . 2 1 1 A 139 139 SER C C 139 175.750 174.002 1.748 1 1 1395 . 2 1 1 A 139 139 SER CA C 139 56.020 60.272 -4.252 1 1 1396 . 2 1 1 A 139 139 SER CB C 139 65.320 63.710 1.610 1 1 1397 . 2 1 1 A 139 139 SER N N 139 112.360 115.951 -3.591 1 1 1398 . 2 1 1 A 140 140 SER H H 140 9.900 8.479 1.421 1 1 1399 . 2 1 1 A 140 140 SER HA H 140 5.360 5.351 0.009 1 1 1402 . 2 1 1 A 140 140 SER C C 140 172.620 174.147 -1.527 1 1 1403 . 2 1 1 A 140 140 SER CA C 140 57.400 56.298 1.102 1 1 1404 . 2 1 1 A 140 140 SER CB C 140 66.550 65.793 0.757 1 1 1405 . 2 1 1 A 140 140 SER N N 140 119.130 120.178 -1.048 1 1 1406 . 2 1 1 A 141 141 VAL H H 141 9.030 8.763 0.267 1 1 1407 . 2 1 1 A 141 141 VAL HA H 141 5.520 5.365 0.155 1 1 1415 . 2 1 1 A 141 141 VAL C C 141 174.750 175.315 -0.565 1 1 1416 . 2 1 1 A 141 141 VAL CA C 141 58.310 59.727 -1.417 1 1 1417 . 2 1 1 A 141 141 VAL CB C 141 35.030 36.205 -1.175 1 1 1420 . 2 1 1 A 141 141 VAL N N 141 111.410 114.286 -2.876 1 1 1421 . 2 1 1 A 142 142 GLY H H 142 8.790 8.687 0.103 1 1 1422 . 2 1 1 A 142 142 GLY HA2 H 142 3.600 4.220 -0.620 1 1 1423 . 2 1 1 A 142 142 GLY HA3 H 142 5.310 4.253 1.057 1 1 1424 . 2 1 1 A 142 142 GLY C C 142 174.180 173.645 0.535 1 1 1425 . 2 1 1 A 142 142 GLY CA C 142 44.110 45.886 -1.776 1 1 1426 . 2 1 1 A 142 142 GLY N N 142 109.330 109.993 -0.663 1 1 1427 . 2 1 1 A 143 143 ASP H H 143 8.840 8.471 0.369 1 1 1428 . 2 1 1 A 143 143 ASP HA H 143 5.790 5.062 0.728 1 1 1431 . 2 1 1 A 143 143 ASP C C 143 178.860 178.105 0.755 1 1 1432 . 2 1 1 A 143 143 ASP CA C 143 53.040 54.866 -1.826 1 1 1433 . 2 1 1 A 143 143 ASP CB C 143 43.660 42.628 1.032 1 1 1434 . 2 1 1 A 143 143 ASP N N 143 125.390 126.062 -0.672 1 1 1435 . 2 1 1 A 144 144 GLY H H 144 9.150 8.943 0.207 1 1 1436 . 2 1 1 A 144 144 GLY HA2 H 144 3.450 3.893 -0.443 1 1 1437 . 2 1 1 A 144 144 GLY HA3 H 144 3.720 3.990 -0.270 1 1 1438 . 2 1 1 A 144 144 GLY C C 144 174.770 175.564 -0.794 1 1 1439 . 2 1 1 A 144 144 GLY CA C 144 46.930 47.974 -1.044 1 1 1440 . 2 1 1 A 144 144 GLY N N 144 106.470 110.276 -3.806 1 1 1441 . 2 1 1 A 145 145 GLU H H 145 8.470 7.887 0.583 1 1 1442 . 2 1 1 A 145 145 GLU HA H 145 4.460 4.268 0.192 1 1 1447 . 2 1 1 A 145 145 GLU C C 145 176.520 176.222 0.298 1 1 1448 . 2 1 1 A 145 145 GLU CA C 145 55.330 57.029 -1.699 1 1 1449 . 2 1 1 A 145 145 GLU CB C 145 30.620 30.016 0.604 1 1 1451 . 2 1 1 A 145 145 GLU N N 145 119.170 121.204 -2.034 1 1 1452 . 2 1 1 A 146 146 GLY H H 146 7.950 7.942 0.008 1 1 1453 . 2 1 1 A 146 146 GLY HA2 H 146 3.630 4.047 -0.417 1 1 1454 . 2 1 1 A 146 146 GLY HA3 H 146 4.130 4.051 0.079 1 1 1455 . 2 1 1 A 146 146 GLY C C 146 174.350 174.900 -0.550 1 1 1456 . 2 1 1 A 146 146 GLY CA C 146 45.330 45.180 0.150 1 1 1457 . 2 1 1 A 146 146 GLY N N 146 108.130 106.502 1.628 1 1 1458 . 2 1 1 A 147 147 LEU H H 147 8.440 7.971 0.469 1 1 1459 . 2 1 1 A 147 147 LEU HA H 147 4.340 4.476 -0.136 1 1 1469 . 2 1 1 A 147 147 LEU C C 147 175.950 175.582 0.368 1 1 1470 . 2 1 1 A 147 147 LEU CA C 147 54.860 54.707 0.153 1 1 1471 . 2 1 1 A 147 147 LEU CB C 147 41.590 42.396 -0.806 1 1 1475 . 2 1 1 A 147 147 LEU N N 147 124.000 122.396 1.604 1 1 1476 . 2 1 1 A 148 148 VAL H H 148 7.780 8.203 -0.423 1 1 1477 . 2 1 1 A 148 148 VAL HA H 148 4.830 4.915 -0.085 1 1 1485 . 2 1 1 A 148 148 VAL C C 148 175.740 174.520 1.220 1 1 1486 . 2 1 1 A 148 148 VAL CA C 148 61.140 60.921 0.219 1 1 1487 . 2 1 1 A 148 148 VAL CB C 148 33.640 34.701 -1.061 1 1 1490 . 2 1 1 A 148 148 VAL N N 148 120.440 119.460 0.980 1 1 1491 . 2 1 1 A 149 149 HIS H H 149 9.170 8.978 0.192 1 1 1492 . 2 1 1 A 149 149 HIS HA H 149 4.950 5.005 -0.055 1 1 1496 . 2 1 1 A 149 149 HIS C C 149 174.780 174.502 0.278 1 1 1497 . 2 1 1 A 149 149 HIS CA C 149 53.900 54.436 -0.536 1 1 1498 . 2 1 1 A 149 149 HIS CB C 149 32.200 30.125 2.075 1 1 1499 . 2 1 1 A 149 149 HIS N N 149 124.700 125.633 -0.933 1 1 1500 . 2 1 1 A 150 150 GLU H H 150 9.060 8.814 0.246 1 1 1501 . 2 1 1 A 150 150 GLU HA H 150 4.420 4.282 0.138 1 1 1506 . 2 1 1 A 150 150 GLU C C 150 176.520 176.573 -0.053 1 1 1507 . 2 1 1 A 150 150 GLU CA C 150 57.630 56.805 0.825 1 1 1508 . 2 1 1 A 150 150 GLU CB C 150 30.370 29.660 0.710 1 1 1510 . 2 1 1 A 150 150 GLU N N 150 125.540 123.895 1.645 1 1 1511 . 2 1 1 A 151 151 ILE H H 151 8.150 7.991 0.159 1 1 1512 . 2 1 1 A 151 151 ILE HA H 151 4.780 4.500 0.280 1 1 1522 . 2 1 1 A 151 151 ILE C C 151 174.570 176.212 -1.642 1 1 1523 . 2 1 1 A 151 151 ILE CA C 151 59.390 59.593 -0.203 1 1 1524 . 2 1 1 A 151 151 ILE CB C 151 42.040 39.298 2.742 1 1 1528 . 2 1 1 A 151 151 ILE N N 151 115.880 122.172 -6.292 1 1 1529 . 2 1 1 A 152 152 ALA H H 152 8.010 8.376 -0.366 1 1 1530 . 2 1 1 A 152 152 ALA HA H 152 4.310 4.384 -0.074 1 1 1534 . 2 1 1 A 152 152 ALA C C 152 177.500 176.883 0.617 1 1 1535 . 2 1 1 A 152 152 ALA CA C 152 53.680 51.916 1.764 1 1 1536 . 2 1 1 A 152 152 ALA CB C 152 20.050 19.842 0.208 1 1 1537 . 2 1 1 A 152 152 ALA N N 152 126.640 124.379 2.261 1 1 1538 . 2 1 1 A 153 153 GLY H H 153 8.340 8.360 -0.020 1 1 1539 . 2 1 1 A 153 153 GLY HA2 H 153 4.050 4.382 -0.332 1 1 1540 . 2 1 1 A 153 153 GLY HA3 H 153 4.140 4.387 -0.247 1 1 1541 . 2 1 1 A 153 153 GLY C C 153 173.140 171.918 1.222 1 1 1542 . 2 1 1 A 153 153 GLY CA C 153 44.130 45.629 -1.499 1 1 1543 . 2 1 1 A 153 153 GLY N N 153 107.490 105.441 2.049 1 1 1544 . 2 1 1 A 154 154 THR H H 154 7.380 8.499 -1.119 1 1 1545 . 2 1 1 A 154 154 THR HA H 154 4.700 5.111 -0.411 1 1 1550 . 2 1 1 A 154 154 THR C C 154 171.120 172.948 -1.828 1 1 1551 . 2 1 1 A 154 154 THR CA C 154 60.830 61.058 -0.228 1 1 1552 . 2 1 1 A 154 154 THR CB C 154 68.850 72.379 -3.529 1 1 1554 . 2 1 1 A 154 154 THR N N 154 109.340 114.201 -4.861 1 1 1555 . 2 1 1 A 155 155 GLU H H 155 8.020 8.986 -0.966 1 1 1556 . 2 1 1 A 155 155 GLU HA H 155 5.370 5.596 -0.226 1 1 1561 . 2 1 1 A 155 155 GLU C C 155 174.240 174.812 -0.572 1 1 1562 . 2 1 1 A 155 155 GLU CA C 155 54.830 54.580 0.250 1 1 1563 . 2 1 1 A 155 155 GLU CB C 155 33.620 33.399 0.221 1 1 1565 . 2 1 1 A 155 155 GLU N N 155 118.690 125.701 -7.011 1 1 1566 . 2 1 1 A 156 156 LYS H H 156 9.230 9.202 0.028 1 1 1567 . 2 1 1 A 156 156 LYS HA H 156 4.650 5.126 -0.476 1 1 1576 . 2 1 1 A 156 156 LYS C C 156 174.000 174.439 -0.439 1 1 1577 . 2 1 1 A 156 156 LYS CA C 156 55.840 54.728 1.112 1 1 1578 . 2 1 1 A 156 156 LYS CB C 156 37.550 36.686 0.864 1 1 1582 . 2 1 1 A 156 156 LYS N N 156 121.940 125.785 -3.845 1 1 1583 . 2 1 1 A 157 157 THR H H 157 8.160 8.699 -0.539 1 1 1584 . 2 1 1 A 157 157 THR HA H 157 5.440 5.091 0.349 1 1 1589 . 2 1 1 A 157 157 THR C C 157 174.360 173.543 0.817 1 1 1590 . 2 1 1 A 157 157 THR CA C 157 60.410 60.850 -0.440 1 1 1591 . 2 1 1 A 157 157 THR CB C 157 71.500 71.267 0.233 1 1 1593 . 2 1 1 A 157 157 THR N N 157 113.240 113.018 0.222 1 1 1594 . 2 1 1 A 158 158 VAL H H 158 9.120 9.158 -0.038 1 1 1595 . 2 1 1 A 158 158 VAL HA H 158 4.580 5.357 -0.777 1 1 1603 . 2 1 1 A 158 158 VAL C C 158 172.800 174.777 -1.977 1 1 1604 . 2 1 1 A 158 158 VAL CA C 158 59.980 59.338 0.642 1 1 1605 . 2 1 1 A 158 158 VAL CB C 158 36.290 34.586 1.704 1 1 1608 . 2 1 1 A 158 158 VAL N N 158 121.710 121.121 0.589 1 1 1609 . 2 1 1 A 159 159 ASN H H 159 8.240 8.632 -0.392 1 1 1610 . 2 1 1 A 159 159 ASN HA H 159 5.420 5.145 0.275 1 1 1615 . 2 1 1 A 159 159 ASN C C 159 173.800 174.115 -0.315 1 1 1616 . 2 1 1 A 159 159 ASN CA C 159 51.740 52.314 -0.574 1 1 1617 . 2 1 1 A 159 159 ASN CB C 159 40.380 39.399 0.981 1 1 1618 . 2 1 1 A 159 159 ASN N N 159 122.730 122.490 0.240 1 1 1620 . 2 1 1 A 160 160 ILE H H 160 9.160 8.706 0.454 1 1 1621 . 2 1 1 A 160 160 ILE HA H 160 5.130 4.898 0.232 1 1 1631 . 2 1 1 A 160 160 ILE C C 160 177.320 175.704 1.616 1 1 1632 . 2 1 1 A 160 160 ILE CA C 160 60.640 60.771 -0.131 1 1 1633 . 2 1 1 A 160 160 ILE CB C 160 38.520 37.578 0.942 1 1 1637 . 2 1 1 A 160 160 ILE N N 160 123.690 125.927 -2.237 1 1 1638 . 2 1 1 A 161 161 ILE H H 161 8.780 8.952 -0.172 1 1 1639 . 2 1 1 A 161 161 ILE HA H 161 4.590 4.592 -0.002 1 1 1649 . 2 1 1 A 161 161 ILE C C 161 174.960 175.832 -0.872 1 1 1650 . 2 1 1 A 161 161 ILE CA C 161 59.320 60.456 -1.136 1 1 1651 . 2 1 1 A 161 161 ILE CB C 161 41.030 39.757 1.273 1 1 1655 . 2 1 1 A 161 161 ILE N N 161 122.490 128.908 -6.418 1 1 1656 . 2 1 1 A 162 162 GLU H H 162 8.620 8.396 0.224 1 1 1657 . 2 1 1 A 162 162 GLU HA H 162 4.290 4.335 -0.045 1 1 1662 . 2 1 1 A 162 162 GLU C C 162 176.660 176.695 -0.035 1 1 1663 . 2 1 1 A 162 162 GLU CA C 162 56.470 57.168 -0.698 1 1 1664 . 2 1 1 A 162 162 GLU CB C 162 31.150 30.473 0.677 1 1 1666 . 2 1 1 A 162 162 GLU N N 162 120.520 126.058 -5.538 1 1 1667 . 2 1 1 A 163 163 GLY H H 163 8.480 8.483 -0.003 1 1 1668 . 2 1 1 A 163 163 GLY HA2 H 163 3.910 4.251 -0.341 1 1 1669 . 2 1 1 A 163 163 GLY HA3 H 163 4.150 4.253 -0.103 1 1 1670 . 2 1 1 A 163 163 GLY C C 163 174.000 172.362 1.638 1 1 1671 . 2 1 1 A 163 163 GLY CA C 163 45.270 43.786 1.484 1 1 1672 . 2 1 1 A 163 163 GLY N N 163 110.210 109.676 0.534 1 1 1673 . 2 1 1 A 164 164 THR H H 164 8.170 8.915 -0.745 1 1 1674 . 2 1 1 A 164 164 THR HA H 164 4.410 4.840 -0.430 1 1 1679 . 2 1 1 A 164 164 THR C C 164 174.100 174.620 -0.520 1 1 1680 . 2 1 1 A 164 164 THR CA C 164 61.620 61.120 0.500 1 1 1681 . 2 1 1 A 164 164 THR CB C 164 70.060 71.662 -1.602 1 1 1683 . 2 1 1 A 164 164 THR N N 164 113.480 116.399 -2.919 1 1 1 . 3 1 1 A 13 13 GLY H H 13 8.350 7.757 0.593 1 1 2 . 3 1 1 A 13 13 GLY HA2 H 13 3.920 4.249 -0.329 1 1 3 . 3 1 1 A 13 13 GLY HA3 H 13 3.920 4.298 -0.378 1 1 4 . 3 1 1 A 13 13 GLY CA C 13 45.290 44.016 1.274 1 1 5 . 3 1 1 A 13 13 GLY N N 13 110.450 107.163 3.287 1 1 6 . 3 1 1 A 14 14 LEU H H 14 8.050 8.677 -0.627 1 1 7 . 3 1 1 A 14 14 LEU N N 14 121.500 122.875 -1.375 1 1 8 . 3 1 1 A 15 15 VAL H H 15 8.070 7.769 0.301 1 1 9 . 3 1 1 A 15 15 VAL N N 15 122.390 119.308 3.082 1 1 10 . 3 1 1 A 16 16 PRO HA H 16 4.360 4.420 -0.060 1 1 17 . 3 1 1 A 16 16 PRO CA C 16 62.770 63.154 -0.384 1 1 18 . 3 1 1 A 16 16 PRO CB C 16 32.020 32.424 -0.404 1 1 21 . 3 1 1 A 21 21 MET H H 21 8.180 8.124 0.056 1 1 22 . 3 1 1 A 21 21 MET N N 21 121.310 118.864 2.446 1 1 23 . 3 1 1 A 22 22 ALA H H 22 8.290 7.162 1.128 1 1 24 . 3 1 1 A 22 22 ALA N N 22 124.800 121.524 3.276 1 1 25 . 3 1 1 A 23 23 SER H H 23 8.210 8.934 -0.724 1 1 26 . 3 1 1 A 23 23 SER N N 23 114.830 117.046 -2.216 1 1 27 . 3 1 1 A 24 24 LYS H H 24 8.250 8.028 0.222 1 1 28 . 3 1 1 A 24 24 LYS N N 24 122.980 118.264 4.716 1 1 29 . 3 1 1 A 25 25 LEU H H 25 8.140 7.872 0.268 1 1 30 . 3 1 1 A 25 25 LEU HA H 25 4.290 4.384 -0.094 1 1 40 . 3 1 1 A 25 25 LEU C C 25 177.410 175.473 1.937 1 1 41 . 3 1 1 A 25 25 LEU CA C 25 55.430 55.577 -0.147 1 1 42 . 3 1 1 A 25 25 LEU CB C 25 42.350 41.402 0.948 1 1 46 . 3 1 1 A 25 25 LEU N N 25 122.580 119.731 2.849 1 1 47 . 3 1 1 A 26 26 LYS H H 26 8.200 8.710 -0.510 1 1 48 . 3 1 1 A 26 26 LYS HA H 26 4.260 4.545 -0.285 1 1 57 . 3 1 1 A 26 26 LYS C C 26 176.520 174.901 1.619 1 1 58 . 3 1 1 A 26 26 LYS CA C 26 56.700 55.587 1.113 1 1 59 . 3 1 1 A 26 26 LYS CB C 26 33.060 32.814 0.246 1 1 63 . 3 1 1 A 26 26 LYS N N 26 121.800 125.146 -3.346 1 1 64 . 3 1 1 A 27 27 GLU H H 27 8.380 7.568 0.812 1 1 65 . 3 1 1 A 27 27 GLU HA H 27 4.240 4.634 -0.394 1 1 70 . 3 1 1 A 27 27 GLU C C 27 176.130 175.695 0.435 1 1 71 . 3 1 1 A 27 27 GLU CA C 27 56.700 54.309 2.391 1 1 72 . 3 1 1 A 27 27 GLU CB C 27 30.370 33.351 -2.981 1 1 74 . 3 1 1 A 27 27 GLU N N 27 121.700 119.110 2.590 1 1 75 . 3 1 1 A 28 28 ALA H H 28 8.230 8.690 -0.460 1 1 76 . 3 1 1 A 28 28 ALA HA H 28 4.280 4.004 0.276 1 1 80 . 3 1 1 A 28 28 ALA C C 28 177.090 177.462 -0.372 1 1 81 . 3 1 1 A 28 28 ALA CA C 28 52.530 54.412 -1.882 1 1 82 . 3 1 1 A 28 28 ALA CB C 28 19.360 17.881 1.479 1 1 83 . 3 1 1 A 28 28 ALA N N 28 124.640 121.493 3.147 1 1 84 . 3 1 1 A 29 29 ALA H H 29 8.150 8.569 -0.419 1 1 85 . 3 1 1 A 29 29 ALA HA H 29 4.320 4.313 0.007 1 1 89 . 3 1 1 A 29 29 ALA C C 29 177.120 177.521 -0.401 1 1 90 . 3 1 1 A 29 29 ALA CA C 29 52.040 54.643 -2.603 1 1 91 . 3 1 1 A 29 29 ALA CB C 29 19.430 19.919 -0.489 1 1 92 . 3 1 1 A 29 29 ALA N N 29 123.430 122.073 1.357 1 1 93 . 3 1 1 A 30 30 GLU H H 30 8.310 8.116 0.194 1 1 94 . 3 1 1 A 30 30 GLU HA H 30 4.220 4.154 0.066 1 1 99 . 3 1 1 A 30 30 GLU C C 30 176.310 175.959 0.351 1 1 100 . 3 1 1 A 30 30 GLU CA C 30 56.630 56.957 -0.327 1 1 101 . 3 1 1 A 30 30 GLU CB C 30 30.320 28.546 1.774 1 1 103 . 3 1 1 A 30 30 GLU N N 30 120.630 114.591 6.039 1 1 104 . 3 1 1 A 31 31 VAL H H 31 8.630 8.283 0.347 1 1 105 . 3 1 1 A 31 31 VAL HA H 31 4.430 4.747 -0.317 1 1 113 . 3 1 1 A 31 31 VAL C C 31 176.510 176.436 0.074 1 1 114 . 3 1 1 A 31 31 VAL CA C 31 62.360 63.436 -1.076 1 1 115 . 3 1 1 A 31 31 VAL CB C 31 32.370 32.114 0.256 1 1 118 . 3 1 1 A 31 31 VAL N N 31 127.110 123.550 3.560 1 1 119 . 3 1 1 A 32 32 THR H H 32 7.640 8.673 -1.033 1 1 120 . 3 1 1 A 32 32 THR HA H 32 4.870 4.043 0.827 1 1 125 . 3 1 1 A 32 32 THR C C 32 172.220 174.784 -2.564 1 1 126 . 3 1 1 A 32 32 THR CA C 32 59.510 64.780 -5.270 1 1 127 . 3 1 1 A 32 32 THR CB C 32 71.630 69.920 1.710 1 1 129 . 3 1 1 A 32 32 THR N N 32 118.860 120.873 -2.013 1 1 130 . 3 1 1 A 33 33 GLY H H 33 8.350 7.944 0.406 1 1 131 . 3 1 1 A 33 33 GLY HA2 H 33 4.160 4.061 0.099 1 1 132 . 3 1 1 A 33 33 GLY HA3 H 33 4.250 4.072 0.178 1 1 133 . 3 1 1 A 33 33 GLY C C 33 172.820 173.367 -0.547 1 1 134 . 3 1 1 A 33 33 GLY CA C 33 46.680 44.941 1.739 1 1 135 . 3 1 1 A 33 33 GLY N N 33 106.720 108.804 -2.084 1 1 136 . 3 1 1 A 34 34 SER H H 34 8.810 8.797 0.013 1 1 137 . 3 1 1 A 34 34 SER HA H 34 5.390 5.189 0.201 1 1 140 . 3 1 1 A 34 34 SER C C 34 173.780 172.661 1.119 1 1 141 . 3 1 1 A 34 34 SER CA C 34 57.380 57.518 -0.138 1 1 142 . 3 1 1 A 34 34 SER CB C 34 65.730 66.957 -1.227 1 1 143 . 3 1 1 A 34 34 SER N N 34 112.690 118.861 -6.171 1 1 144 . 3 1 1 A 35 35 VAL H H 35 8.470 8.629 -0.159 1 1 145 . 3 1 1 A 35 35 VAL HA H 35 4.120 5.026 -0.906 1 1 153 . 3 1 1 A 35 35 VAL C C 35 174.750 174.967 -0.217 1 1 154 . 3 1 1 A 35 35 VAL CA C 35 62.310 60.627 1.683 1 1 155 . 3 1 1 A 35 35 VAL CB C 35 34.550 33.417 1.133 1 1 158 . 3 1 1 A 35 35 VAL N N 35 123.150 119.370 3.780 1 1 159 . 3 1 1 A 36 36 SER H H 36 8.240 8.649 -0.409 1 1 160 . 3 1 1 A 36 36 SER HA H 36 4.690 4.846 -0.156 1 1 163 . 3 1 1 A 36 36 SER C C 36 171.860 173.966 -2.106 1 1 164 . 3 1 1 A 36 36 SER CA C 36 56.020 58.035 -2.015 1 1 165 . 3 1 1 A 36 36 SER CB C 36 66.050 63.603 2.447 1 1 166 . 3 1 1 A 36 36 SER N N 36 118.760 123.518 -4.758 1 1 167 . 3 1 1 A 37 37 LEU H H 37 8.310 8.882 -0.572 1 1 168 . 3 1 1 A 37 37 LEU HA H 37 4.870 4.878 -0.008 1 1 178 . 3 1 1 A 37 37 LEU C C 37 174.190 175.738 -1.548 1 1 179 . 3 1 1 A 37 37 LEU CA C 37 53.870 53.615 0.255 1 1 180 . 3 1 1 A 37 37 LEU CB C 37 47.000 43.164 3.836 1 1 184 . 3 1 1 A 37 37 LEU N N 37 124.790 127.121 -2.331 1 1 185 . 3 1 1 A 38 38 GLU H H 38 9.270 8.787 0.483 1 1 186 . 3 1 1 A 38 38 GLU HA H 38 4.650 4.933 -0.283 1 1 191 . 3 1 1 A 38 38 GLU C C 38 173.970 174.500 -0.530 1 1 192 . 3 1 1 A 38 38 GLU CA C 38 54.410 55.208 -0.798 1 1 193 . 3 1 1 A 38 38 GLU CB C 38 32.460 31.390 1.070 1 1 195 . 3 1 1 A 38 38 GLU N N 38 126.550 124.218 2.332 1 1 196 . 3 1 1 A 39 39 ALA H H 39 8.120 8.542 -0.422 1 1 197 . 3 1 1 A 39 39 ALA HA H 39 4.600 4.916 -0.316 1 1 201 . 3 1 1 A 39 39 ALA C C 39 175.930 177.392 -1.462 1 1 202 . 3 1 1 A 39 39 ALA CA C 39 51.570 50.919 0.651 1 1 203 . 3 1 1 A 39 39 ALA CB C 39 21.780 22.597 -0.817 1 1 204 . 3 1 1 A 39 39 ALA N N 39 124.410 127.548 -3.138 1 1 205 . 3 1 1 A 40 40 LEU H H 40 7.860 9.019 -1.159 1 1 206 . 3 1 1 A 40 40 LEU HA H 40 4.230 3.986 0.244 1 1 216 . 3 1 1 A 40 40 LEU C C 40 175.940 176.670 -0.730 1 1 217 . 3 1 1 A 40 40 LEU CA C 40 55.360 56.845 -1.485 1 1 218 . 3 1 1 A 40 40 LEU CB C 40 42.990 42.279 0.711 1 1 222 . 3 1 1 A 40 40 LEU N N 40 120.640 124.391 -3.751 1 1 223 . 3 1 1 A 41 41 GLU H H 41 8.210 7.912 0.298 1 1 224 . 3 1 1 A 41 41 GLU HA H 41 4.240 4.073 0.167 1 1 229 . 3 1 1 A 41 41 GLU C C 41 176.920 175.091 1.829 1 1 230 . 3 1 1 A 41 41 GLU CA C 41 58.090 57.779 0.311 1 1 231 . 3 1 1 A 41 41 GLU CB C 41 30.530 27.101 3.429 1 1 233 . 3 1 1 A 41 41 GLU N N 41 114.680 116.428 -1.748 1 1 234 . 3 1 1 A 42 42 GLU H H 42 7.490 7.775 -0.285 1 1 235 . 3 1 1 A 42 42 GLU HA H 42 5.680 4.789 0.891 1 1 240 . 3 1 1 A 42 42 GLU C C 42 173.790 174.182 -0.392 1 1 241 . 3 1 1 A 42 42 GLU CA C 42 54.360 56.244 -1.884 1 1 242 . 3 1 1 A 42 42 GLU CB C 42 33.850 33.379 0.471 1 1 244 . 3 1 1 A 42 42 GLU N N 42 116.670 118.026 -1.356 1 1 245 . 3 1 1 A 43 43 VAL H H 43 8.550 8.836 -0.286 1 1 246 . 3 1 1 A 43 43 VAL HA H 43 4.550 4.640 -0.090 1 1 254 . 3 1 1 A 43 43 VAL C C 43 172.220 173.760 -1.540 1 1 255 . 3 1 1 A 43 43 VAL CA C 43 59.470 60.513 -1.043 1 1 256 . 3 1 1 A 43 43 VAL CB C 43 35.470 34.736 0.734 1 1 259 . 3 1 1 A 43 43 VAL N N 43 120.030 125.063 -5.033 1 1 260 . 3 1 1 A 44 44 GLN H H 44 8.470 8.618 -0.148 1 1 261 . 3 1 1 A 44 44 GLN HA H 44 4.890 4.734 0.156 1 1 268 . 3 1 1 A 44 44 GLN C C 44 176.130 176.026 0.104 1 1 269 . 3 1 1 A 44 44 GLN CA C 44 54.360 55.834 -1.474 1 1 270 . 3 1 1 A 44 44 GLN CB C 44 30.610 28.963 1.647 1 1 272 . 3 1 1 A 44 44 GLN N N 44 124.690 130.160 -5.470 1 1 274 . 3 1 1 A 45 45 VAL H H 45 8.130 8.564 -0.434 1 1 275 . 3 1 1 A 45 45 VAL HA H 45 3.030 3.933 -0.903 1 1 283 . 3 1 1 A 45 45 VAL C C 45 176.710 177.207 -0.497 1 1 284 . 3 1 1 A 45 45 VAL CA C 45 65.810 64.764 1.046 1 1 285 . 3 1 1 A 45 45 VAL CB C 45 31.960 31.494 0.466 1 1 288 . 3 1 1 A 45 45 VAL N N 45 120.450 127.591 -7.141 1 1 289 . 3 1 1 A 46 46 GLY H H 46 8.950 10.088 -1.138 1 1 290 . 3 1 1 A 46 46 GLY HA2 H 46 3.590 4.013 -0.423 1 1 291 . 3 1 1 A 46 46 GLY HA3 H 46 4.410 4.016 0.394 1 1 292 . 3 1 1 A 46 46 GLY C C 46 174.390 173.978 0.412 1 1 293 . 3 1 1 A 46 46 GLY CA C 46 44.730 44.975 -0.245 1 1 294 . 3 1 1 A 46 46 GLY N N 46 116.490 115.209 1.281 1 1 295 . 3 1 1 A 47 47 GLU H H 47 8.260 7.890 0.370 1 1 296 . 3 1 1 A 47 47 GLU HA H 47 4.460 4.679 -0.219 1 1 301 . 3 1 1 A 47 47 GLU C C 47 174.780 175.391 -0.611 1 1 302 . 3 1 1 A 47 47 GLU CA C 47 54.830 55.245 -0.415 1 1 303 . 3 1 1 A 47 47 GLU CB C 47 31.140 31.678 -0.538 1 1 305 . 3 1 1 A 47 47 GLU N N 47 120.520 121.556 -1.036 1 1 306 . 3 1 1 A 48 48 ASN H H 48 8.440 8.678 -0.238 1 1 307 . 3 1 1 A 48 48 ASN HA H 48 5.380 5.320 0.060 1 1 312 . 3 1 1 A 48 48 ASN C C 48 174.770 174.588 0.182 1 1 313 . 3 1 1 A 48 48 ASN CA C 48 51.570 52.732 -1.162 1 1 314 . 3 1 1 A 48 48 ASN CB C 48 39.010 40.723 -1.713 1 1 315 . 3 1 1 A 48 48 ASN N N 48 117.180 121.270 -4.090 1 1 317 . 3 1 1 A 49 49 LEU H H 49 9.810 8.634 1.176 1 1 318 . 3 1 1 A 49 49 LEU HA H 49 4.510 4.834 -0.324 1 1 328 . 3 1 1 A 49 49 LEU C C 49 174.560 174.609 -0.049 1 1 329 . 3 1 1 A 49 49 LEU CA C 49 53.460 54.442 -0.982 1 1 330 . 3 1 1 A 49 49 LEU CB C 49 45.520 45.026 0.494 1 1 333 . 3 1 1 A 49 49 LEU N N 49 125.620 122.342 3.278 1 1 334 . 3 1 1 A 50 50 GLU H H 50 8.750 9.027 -0.277 1 1 335 . 3 1 1 A 50 50 GLU HA H 50 4.360 5.397 -1.037 1 1 340 . 3 1 1 A 50 50 GLU C C 50 175.340 175.288 0.052 1 1 341 . 3 1 1 A 50 50 GLU CA C 50 55.550 54.924 0.626 1 1 342 . 3 1 1 A 50 50 GLU CB C 50 29.890 32.492 -2.602 1 1 344 . 3 1 1 A 50 50 GLU N N 50 125.420 125.855 -0.435 1 1 345 . 3 1 1 A 51 51 VAL H H 51 9.230 8.881 0.349 1 1 346 . 3 1 1 A 51 51 VAL HA H 51 4.190 4.506 -0.316 1 1 354 . 3 1 1 A 51 51 VAL C C 51 175.310 175.701 -0.391 1 1 355 . 3 1 1 A 51 51 VAL CA C 51 62.520 60.970 1.550 1 1 356 . 3 1 1 A 51 51 VAL CB C 51 31.470 32.824 -1.354 1 1 359 . 3 1 1 A 51 51 VAL N N 51 129.810 123.574 6.236 1 1 360 . 3 1 1 A 52 52 GLY H H 52 9.410 8.802 0.608 1 1 361 . 3 1 1 A 52 52 GLY HA2 H 52 3.460 3.849 -0.389 1 1 362 . 3 1 1 A 52 52 GLY HA3 H 52 4.680 3.867 0.813 1 1 363 . 3 1 1 A 52 52 GLY C C 52 173.000 173.237 -0.237 1 1 364 . 3 1 1 A 52 52 GLY CA C 52 46.470 47.403 -0.933 1 1 365 . 3 1 1 A 52 52 GLY N N 52 116.600 114.123 2.477 1 1 366 . 3 1 1 A 53 53 VAL H H 53 9.130 9.051 0.079 1 1 367 . 3 1 1 A 53 53 VAL HA H 53 4.840 4.832 0.008 1 1 375 . 3 1 1 A 53 53 VAL C C 53 175.470 174.887 0.583 1 1 376 . 3 1 1 A 53 53 VAL CA C 53 61.350 61.271 0.079 1 1 377 . 3 1 1 A 53 53 VAL CB C 53 34.300 31.660 2.640 1 1 380 . 3 1 1 A 53 53 VAL N N 53 129.050 122.259 6.791 1 1 381 . 3 1 1 A 54 54 GLY H H 54 8.420 8.358 0.062 1 1 382 . 3 1 1 A 54 54 GLY HA2 H 54 3.850 3.169 0.681 1 1 383 . 3 1 1 A 54 54 GLY HA3 H 54 3.850 3.720 0.130 1 1 384 . 3 1 1 A 54 54 GLY C C 54 173.310 172.526 0.784 1 1 385 . 3 1 1 A 54 54 GLY CA C 54 45.180 44.047 1.133 1 1 386 . 3 1 1 A 54 54 GLY N N 54 116.890 115.144 1.746 1 1 387 . 3 1 1 A 55 55 ILE H H 55 10.190 8.157 2.033 1 1 388 . 3 1 1 A 55 55 ILE HA H 55 4.010 5.002 -0.992 1 1 398 . 3 1 1 A 55 55 ILE C C 55 174.380 174.968 -0.588 1 1 399 . 3 1 1 A 55 55 ILE CA C 55 61.350 59.871 1.479 1 1 400 . 3 1 1 A 55 55 ILE CB C 55 40.840 40.493 0.347 1 1 404 . 3 1 1 A 55 55 ILE N N 55 129.330 121.948 7.382 1 1 405 . 3 1 1 A 56 56 ASP H H 56 8.810 9.484 -0.674 1 1 406 . 3 1 1 A 56 56 ASP HA H 56 4.440 5.297 -0.857 1 1 409 . 3 1 1 A 56 56 ASP C C 56 175.530 176.107 -0.577 1 1 410 . 3 1 1 A 56 56 ASP CA C 56 56.460 55.724 0.736 1 1 411 . 3 1 1 A 56 56 ASP CB C 56 42.720 43.136 -0.416 1 1 412 . 3 1 1 A 56 56 ASP N N 56 128.310 127.290 1.020 1 1 413 . 3 1 1 A 57 57 GLU H H 57 7.270 7.705 -0.435 1 1 414 . 3 1 1 A 57 57 GLU HA H 57 4.290 4.839 -0.549 1 1 419 . 3 1 1 A 57 57 GLU C C 57 173.370 174.346 -0.976 1 1 420 . 3 1 1 A 57 57 GLU CA C 57 54.840 55.415 -0.575 1 1 421 . 3 1 1 A 57 57 GLU CB C 57 33.190 33.590 -0.400 1 1 423 . 3 1 1 A 57 57 GLU N N 57 112.810 116.396 -3.586 1 1 424 . 3 1 1 A 58 58 LEU H H 58 8.370 8.672 -0.302 1 1 425 . 3 1 1 A 58 58 LEU HA H 58 4.830 4.743 0.087 1 1 434 . 3 1 1 A 58 58 LEU C C 58 174.180 174.373 -0.193 1 1 435 . 3 1 1 A 58 58 LEU CA C 58 55.320 54.604 0.716 1 1 436 . 3 1 1 A 58 58 LEU CB C 58 44.300 43.931 0.369 1 1 439 . 3 1 1 A 58 58 LEU N N 58 123.130 125.019 -1.889 1 1 440 . 3 1 1 A 59 59 VAL H H 59 9.120 8.871 0.249 1 1 441 . 3 1 1 A 59 59 VAL HA H 59 4.240 4.678 -0.438 1 1 449 . 3 1 1 A 59 59 VAL C C 59 174.960 175.471 -0.511 1 1 450 . 3 1 1 A 59 59 VAL CA C 59 61.760 59.739 2.021 1 1 451 . 3 1 1 A 59 59 VAL CB C 59 33.760 33.744 0.016 1 1 454 . 3 1 1 A 59 59 VAL N N 59 127.930 125.688 2.242 1 1 455 . 3 1 1 A 60 60 ASN H H 60 8.770 8.521 0.249 1 1 456 . 3 1 1 A 60 60 ASN HA H 60 4.250 4.757 -0.507 1 1 461 . 3 1 1 A 60 60 ASN C C 60 172.810 173.861 -1.051 1 1 462 . 3 1 1 A 60 60 ASN CA C 60 54.830 54.679 0.151 1 1 463 . 3 1 1 A 60 60 ASN CB C 60 36.030 36.522 -0.492 1 1 464 . 3 1 1 A 60 60 ASN N N 60 115.500 123.242 -7.742 1 1 466 . 3 1 1 A 61 61 ALA H H 61 7.330 7.383 -0.053 1 1 467 . 3 1 1 A 61 61 ALA HA H 61 4.520 4.526 -0.006 1 1 471 . 3 1 1 A 61 61 ALA C C 61 174.580 174.961 -0.381 1 1 472 . 3 1 1 A 61 61 ALA CA C 61 51.560 51.233 0.327 1 1 473 . 3 1 1 A 61 61 ALA CB C 61 22.870 22.350 0.520 1 1 474 . 3 1 1 A 61 61 ALA N N 61 115.640 118.018 -2.378 1 1 475 . 3 1 1 A 62 62 GLU H H 62 7.900 8.316 -0.416 1 1 476 . 3 1 1 A 62 62 GLU HA H 62 4.310 4.944 -0.634 1 1 481 . 3 1 1 A 62 62 GLU C C 62 173.790 175.519 -1.729 1 1 482 . 3 1 1 A 62 62 GLU CA C 62 55.080 55.302 -0.222 1 1 483 . 3 1 1 A 62 62 GLU CB C 62 32.610 30.735 1.875 1 1 485 . 3 1 1 A 62 62 GLU N N 62 117.400 118.094 -0.694 1 1 486 . 3 1 1 A 63 63 ALA H H 63 8.910 8.714 0.196 1 1 487 . 3 1 1 A 63 63 ALA HA H 63 4.690 4.456 0.234 1 1 491 . 3 1 1 A 63 63 ALA C C 63 175.720 176.838 -1.118 1 1 492 . 3 1 1 A 63 63 ALA CA C 63 50.600 53.161 -2.561 1 1 493 . 3 1 1 A 63 63 ALA CB C 63 20.660 19.225 1.435 1 1 494 . 3 1 1 A 63 63 ALA N N 63 122.480 128.097 -5.617 1 1 495 . 3 1 1 A 64 64 PHE H H 64 9.220 9.280 -0.060 1 1 496 . 3 1 1 A 64 64 PHE HA H 64 4.320 4.724 -0.404 1 1 501 . 3 1 1 A 64 64 PHE C C 64 174.380 175.877 -1.497 1 1 502 . 3 1 1 A 64 64 PHE CA C 64 59.770 58.909 0.861 1 1 503 . 3 1 1 A 64 64 PHE CB C 64 40.830 41.060 -0.230 1 1 504 . 3 1 1 A 64 64 PHE N N 64 120.870 122.400 -1.530 1 1 505 . 3 1 1 A 65 65 ALA H H 65 8.150 8.017 0.133 1 1 506 . 3 1 1 A 65 65 ALA HA H 65 5.280 4.866 0.414 1 1 510 . 3 1 1 A 65 65 ALA C C 65 175.950 174.894 1.056 1 1 511 . 3 1 1 A 65 65 ALA CA C 65 51.120 50.748 0.372 1 1 512 . 3 1 1 A 65 65 ALA CB C 65 22.850 21.291 1.559 1 1 513 . 3 1 1 A 65 65 ALA N N 65 122.350 119.958 2.392 1 1 514 . 3 1 1 A 66 66 TYR H H 66 9.260 9.244 0.016 1 1 515 . 3 1 1 A 66 66 TYR HA H 66 5.710 5.028 0.682 1 1 520 . 3 1 1 A 66 66 TYR C C 66 175.690 173.937 1.753 1 1 521 . 3 1 1 A 66 66 TYR CA C 66 54.390 56.538 -2.148 1 1 522 . 3 1 1 A 66 66 TYR CB C 66 41.560 39.316 2.244 1 1 523 . 3 1 1 A 66 66 TYR N N 66 124.350 126.907 -2.557 1 1 524 . 3 1 1 A 67 67 ASP H H 67 9.070 8.898 0.172 1 1 525 . 3 1 1 A 67 67 ASP HA H 67 5.630 5.354 0.276 1 1 528 . 3 1 1 A 67 67 ASP C C 67 174.300 175.032 -0.732 1 1 529 . 3 1 1 A 67 67 ASP CA C 67 51.590 52.121 -0.531 1 1 530 . 3 1 1 A 67 67 ASP CB C 67 44.380 42.230 2.150 1 1 531 . 3 1 1 A 67 67 ASP N N 67 130.490 126.660 3.830 1 1 532 . 3 1 1 A 68 68 PHE H H 68 8.670 8.837 -0.167 1 1 533 . 3 1 1 A 68 68 PHE HA H 68 4.890 5.394 -0.504 1 1 538 . 3 1 1 A 68 68 PHE C C 68 172.220 173.873 -1.653 1 1 539 . 3 1 1 A 68 68 PHE CA C 68 57.360 54.632 2.728 1 1 540 . 3 1 1 A 68 68 PHE CB C 68 40.360 42.204 -1.844 1 1 541 . 3 1 1 A 68 68 PHE N N 68 118.200 118.863 -0.663 1 1 542 . 3 1 1 A 69 69 THR H H 69 8.390 8.818 -0.428 1 1 543 . 3 1 1 A 69 69 THR HA H 69 5.170 4.539 0.631 1 1 548 . 3 1 1 A 69 69 THR C C 69 172.620 173.589 -0.969 1 1 549 . 3 1 1 A 69 69 THR CA C 69 61.370 61.309 0.061 1 1 550 . 3 1 1 A 69 69 THR CB C 69 64.880 69.821 -4.941 1 1 552 . 3 1 1 A 69 69 THR N N 69 115.810 114.536 1.274 1 1 553 . 3 1 1 A 70 70 LEU H H 70 9.560 8.287 1.273 1 1 554 . 3 1 1 A 70 70 LEU HA H 70 5.270 4.914 0.356 1 1 564 . 3 1 1 A 70 70 LEU C C 70 173.800 175.101 -1.301 1 1 565 . 3 1 1 A 70 70 LEU CA C 70 53.460 55.354 -1.894 1 1 566 . 3 1 1 A 70 70 LEU CB C 70 45.040 43.166 1.874 1 1 570 . 3 1 1 A 70 70 LEU N N 70 129.220 130.062 -0.842 1 1 571 . 3 1 1 A 71 71 ASN H H 71 9.590 8.849 0.741 1 1 572 . 3 1 1 A 71 71 ASN HA H 71 5.880 5.550 0.330 1 1 577 . 3 1 1 A 71 71 ASN C C 71 177.970 174.155 3.815 1 1 578 . 3 1 1 A 71 71 ASN CA C 71 52.060 52.235 -0.175 1 1 579 . 3 1 1 A 71 71 ASN CB C 71 41.020 40.514 0.506 1 1 580 . 3 1 1 A 71 71 ASN N N 71 125.970 124.461 1.509 1 1 582 . 3 1 1 A 72 72 TYR H H 72 8.740 9.343 -0.603 1 1 583 . 3 1 1 A 72 72 TYR HA H 72 5.110 5.276 -0.166 1 1 588 . 3 1 1 A 72 72 TYR C C 72 177.720 172.287 5.433 1 1 589 . 3 1 1 A 72 72 TYR CA C 72 55.310 55.293 0.017 1 1 590 . 3 1 1 A 72 72 TYR CB C 72 41.510 41.369 0.141 1 1 591 . 3 1 1 A 72 72 TYR N N 72 119.640 120.792 -1.152 1 1 592 . 3 1 1 A 73 73 ASP H H 73 9.780 9.012 0.768 1 1 593 . 3 1 1 A 73 73 ASP HA H 73 4.680 4.900 -0.220 1 1 596 . 3 1 1 A 73 73 ASP C C 73 177.290 176.320 0.970 1 1 597 . 3 1 1 A 73 73 ASP CA C 73 53.650 52.483 1.167 1 1 598 . 3 1 1 A 73 73 ASP CB C 73 40.900 42.100 -1.200 1 1 599 . 3 1 1 A 73 73 ASP N N 73 119.290 121.170 -1.880 1 1 600 . 3 1 1 A 74 74 GLU H H 74 9.430 8.458 0.972 1 1 601 . 3 1 1 A 74 74 GLU HA H 74 4.740 4.079 0.661 1 1 606 . 3 1 1 A 74 74 GLU C C 74 176.320 178.107 -1.787 1 1 607 . 3 1 1 A 74 74 GLU CA C 74 57.410 59.714 -2.304 1 1 608 . 3 1 1 A 74 74 GLU CB C 74 29.490 29.328 0.162 1 1 610 . 3 1 1 A 74 74 GLU N N 74 130.930 125.870 5.060 1 1 611 . 3 1 1 A 75 75 ASN H H 75 8.680 8.195 0.485 1 1 612 . 3 1 1 A 75 75 ASN HA H 75 4.600 4.521 0.079 1 1 617 . 3 1 1 A 75 75 ASN C C 75 175.340 176.606 -1.266 1 1 618 . 3 1 1 A 75 75 ASN CA C 75 54.620 56.175 -1.555 1 1 619 . 3 1 1 A 75 75 ASN CB C 75 38.770 38.021 0.749 1 1 620 . 3 1 1 A 75 75 ASN N N 75 115.040 117.984 -2.944 1 1 622 . 3 1 1 A 76 76 ALA H H 76 7.740 7.599 0.141 1 1 623 . 3 1 1 A 76 76 ALA HA H 76 4.310 4.518 -0.208 1 1 627 . 3 1 1 A 76 76 ALA C C 76 175.550 176.069 -0.519 1 1 628 . 3 1 1 A 76 76 ALA CA C 76 53.260 51.556 1.704 1 1 629 . 3 1 1 A 76 76 ALA CB C 76 21.450 19.328 2.122 1 1 630 . 3 1 1 A 76 76 ALA N N 76 122.200 117.828 4.372 1 1 631 . 3 1 1 A 77 77 PHE H H 77 8.070 7.449 0.621 1 1 632 . 3 1 1 A 77 77 PHE HA H 77 5.650 4.887 0.763 1 1 637 . 3 1 1 A 77 77 PHE C C 77 174.570 173.677 0.893 1 1 638 . 3 1 1 A 77 77 PHE CA C 77 56.360 57.074 -0.714 1 1 639 . 3 1 1 A 77 77 PHE CB C 77 46.080 42.802 3.278 1 1 640 . 3 1 1 A 77 77 PHE N N 77 114.160 116.411 -2.251 1 1 641 . 3 1 1 A 78 78 GLU H H 78 8.800 9.047 -0.247 1 1 642 . 3 1 1 A 78 78 GLU HA H 78 4.900 4.941 -0.041 1 1 647 . 3 1 1 A 78 78 GLU C C 78 175.950 174.703 1.247 1 1 648 . 3 1 1 A 78 78 GLU CA C 78 53.670 56.477 -2.807 1 1 649 . 3 1 1 A 78 78 GLU CB C 78 33.600 32.380 1.220 1 1 651 . 3 1 1 A 78 78 GLU N N 78 117.590 119.967 -2.377 1 1 652 . 3 1 1 A 79 79 TYR H H 79 8.770 9.383 -0.613 1 1 653 . 3 1 1 A 79 79 TYR HA H 79 4.250 4.240 0.010 1 1 658 . 3 1 1 A 79 79 TYR C C 79 174.580 174.912 -0.332 1 1 659 . 3 1 1 A 79 79 TYR CA C 79 59.250 59.531 -0.281 1 1 660 . 3 1 1 A 79 79 TYR CB C 79 38.310 39.128 -0.818 1 1 661 . 3 1 1 A 79 79 TYR N N 79 126.560 129.403 -2.843 1 1 662 . 3 1 1 A 80 80 VAL H H 80 8.220 8.365 -0.145 1 1 663 . 3 1 1 A 80 80 VAL HA H 80 3.690 3.829 -0.139 1 1 671 . 3 1 1 A 80 80 VAL C C 80 174.780 174.844 -0.064 1 1 672 . 3 1 1 A 80 80 VAL CA C 80 64.400 62.857 1.543 1 1 673 . 3 1 1 A 80 80 VAL CB C 80 33.510 32.767 0.743 1 1 676 . 3 1 1 A 80 80 VAL N N 80 129.460 125.169 4.291 1 1 677 . 3 1 1 A 81 81 GLU H H 81 6.920 7.474 -0.554 1 1 678 . 3 1 1 A 81 81 GLU HA H 81 4.260 4.717 -0.457 1 1 683 . 3 1 1 A 81 81 GLU C C 81 171.840 175.476 -3.636 1 1 684 . 3 1 1 A 81 81 GLU CA C 81 55.310 55.068 0.242 1 1 685 . 3 1 1 A 81 81 GLU CB C 81 30.520 33.712 -3.192 1 1 687 . 3 1 1 A 81 81 GLU N N 81 112.430 117.236 -4.806 1 1 688 . 3 1 1 A 82 82 ALA H H 82 8.310 8.558 -0.248 1 1 689 . 3 1 1 A 82 82 ALA HA H 82 5.650 5.084 0.566 1 1 693 . 3 1 1 A 82 82 ALA C C 82 176.110 177.001 -0.891 1 1 694 . 3 1 1 A 82 82 ALA CA C 82 50.620 51.748 -1.128 1 1 695 . 3 1 1 A 82 82 ALA CB C 82 21.770 19.919 1.851 1 1 696 . 3 1 1 A 82 82 ALA N N 82 121.240 125.196 -3.956 1 1 697 . 3 1 1 A 83 83 ILE H H 83 9.150 9.310 -0.160 1 1 698 . 3 1 1 A 83 83 ILE HA H 83 4.600 4.962 -0.362 1 1 708 . 3 1 1 A 83 83 ILE C C 83 174.810 175.047 -0.237 1 1 709 . 3 1 1 A 83 83 ILE CA C 83 60.060 59.303 0.757 1 1 710 . 3 1 1 A 83 83 ILE CB C 83 42.440 41.267 1.173 1 1 714 . 3 1 1 A 83 83 ILE N N 83 119.720 120.249 -0.529 1 1 715 . 3 1 1 A 84 84 SER H H 84 8.350 8.668 -0.318 1 1 716 . 3 1 1 A 84 84 SER HA H 84 4.660 5.054 -0.394 1 1 719 . 3 1 1 A 84 84 SER C C 84 177.550 172.283 5.267 1 1 720 . 3 1 1 A 84 84 SER CA C 84 57.330 57.851 -0.521 1 1 721 . 3 1 1 A 84 84 SER CB C 84 66.490 66.606 -0.116 1 1 722 . 3 1 1 A 84 84 SER N N 84 116.740 121.584 -4.844 1 1 723 . 3 1 1 A 85 85 ASP H H 85 8.740 8.964 -0.224 1 1 724 . 3 1 1 A 85 85 ASP HA H 85 4.820 5.117 -0.297 1 1 727 . 3 1 1 A 85 85 ASP C C 85 176.090 175.148 0.942 1 1 728 . 3 1 1 A 85 85 ASP CA C 85 53.480 52.490 0.990 1 1 729 . 3 1 1 A 85 85 ASP CB C 85 42.480 43.885 -1.405 1 1 730 . 3 1 1 A 85 85 ASP N N 85 120.960 125.023 -4.063 1 1 731 . 3 1 1 A 86 86 ASP H H 86 8.380 9.365 -0.985 1 1 732 . 3 1 1 A 86 86 ASP HA H 86 4.450 4.260 0.190 1 1 735 . 3 1 1 A 86 86 ASP C C 86 177.100 175.510 1.590 1 1 736 . 3 1 1 A 86 86 ASP CA C 86 56.240 55.017 1.223 1 1 737 . 3 1 1 A 86 86 ASP CB C 86 41.100 39.684 1.416 1 1 738 . 3 1 1 A 86 86 ASP N N 86 117.710 123.222 -5.512 1 1 739 . 3 1 1 A 87 87 GLY H H 87 8.690 8.672 0.018 1 1 740 . 3 1 1 A 87 87 GLY HA2 H 87 3.870 3.917 -0.047 1 1 741 . 3 1 1 A 87 87 GLY HA3 H 87 4.090 3.924 0.166 1 1 742 . 3 1 1 A 87 87 GLY C C 87 173.800 173.760 0.040 1 1 743 . 3 1 1 A 87 87 GLY CA C 87 45.770 46.076 -0.306 1 1 744 . 3 1 1 A 87 87 GLY N N 87 108.540 104.769 3.771 1 1 745 . 3 1 1 A 88 88 VAL H H 88 7.910 7.751 0.159 1 1 746 . 3 1 1 A 88 88 VAL HA H 88 4.780 4.562 0.218 1 1 754 . 3 1 1 A 88 88 VAL C C 88 173.970 173.544 0.426 1 1 755 . 3 1 1 A 88 88 VAL CA C 88 60.900 61.510 -0.610 1 1 756 . 3 1 1 A 88 88 VAL CB C 88 35.460 34.465 0.995 1 1 759 . 3 1 1 A 88 88 VAL N N 88 119.790 120.272 -0.482 1 1 760 . 3 1 1 A 89 89 PHE H H 89 9.210 8.847 0.363 1 1 761 . 3 1 1 A 89 89 PHE HA H 89 4.930 5.479 -0.549 1 1 766 . 3 1 1 A 89 89 PHE C C 89 173.970 173.435 0.535 1 1 767 . 3 1 1 A 89 89 PHE CA C 89 56.450 55.183 1.267 1 1 768 . 3 1 1 A 89 89 PHE CB C 89 41.120 42.174 -1.054 1 1 769 . 3 1 1 A 89 89 PHE N N 89 126.780 128.884 -2.104 1 1 770 . 3 1 1 A 90 90 VAL H H 90 7.880 8.773 -0.893 1 1 771 . 3 1 1 A 90 90 VAL HA H 90 4.860 5.320 -0.460 1 1 779 . 3 1 1 A 90 90 VAL C C 90 173.190 173.365 -0.175 1 1 780 . 3 1 1 A 90 90 VAL CA C 90 59.750 59.443 0.307 1 1 781 . 3 1 1 A 90 90 VAL CB C 90 34.770 35.223 -0.453 1 1 784 . 3 1 1 A 90 90 VAL N N 90 124.990 127.256 -2.266 1 1 785 . 3 1 1 A 91 91 ASN H H 91 8.670 9.196 -0.526 1 1 786 . 3 1 1 A 91 91 ASN HA H 91 4.730 5.356 -0.626 1 1 791 . 3 1 1 A 91 91 ASN C C 91 173.200 174.108 -0.908 1 1 792 . 3 1 1 A 91 91 ASN CA C 91 51.970 51.893 0.077 1 1 793 . 3 1 1 A 91 91 ASN CB C 91 41.340 42.343 -1.003 1 1 794 . 3 1 1 A 91 91 ASN N N 91 124.860 124.798 0.062 1 1 796 . 3 1 1 A 92 92 ALA H H 92 8.840 9.073 -0.233 1 1 797 . 3 1 1 A 92 92 ALA HA H 92 5.290 5.243 0.047 1 1 801 . 3 1 1 A 92 92 ALA C C 92 176.330 176.159 0.171 1 1 802 . 3 1 1 A 92 92 ALA CA C 92 50.170 50.980 -0.810 1 1 803 . 3 1 1 A 92 92 ALA CB C 92 23.610 21.301 2.309 1 1 804 . 3 1 1 A 92 92 ALA N N 92 128.510 127.632 0.878 1 1 805 . 3 1 1 A 93 93 LYS H H 93 8.670 9.342 -0.672 1 1 806 . 3 1 1 A 93 93 LYS HA H 93 4.460 4.839 -0.379 1 1 815 . 3 1 1 A 93 93 LYS C C 93 174.170 175.116 -0.946 1 1 816 . 3 1 1 A 93 93 LYS CA C 93 55.010 54.893 0.117 1 1 817 . 3 1 1 A 93 93 LYS CB C 93 36.430 35.786 0.644 1 1 821 . 3 1 1 A 93 93 LYS N N 93 121.300 120.981 0.319 1 1 822 . 3 1 1 A 94 94 LYS H H 94 8.960 8.774 0.186 1 1 823 . 3 1 1 A 94 94 LYS HA H 94 4.460 4.094 0.366 1 1 832 . 3 1 1 A 94 94 LYS C C 94 176.330 176.550 -0.220 1 1 833 . 3 1 1 A 94 94 LYS CA C 94 56.720 57.063 -0.343 1 1 834 . 3 1 1 A 94 94 LYS CB C 94 31.930 32.703 -0.773 1 1 837 . 3 1 1 A 94 94 LYS N N 94 127.060 127.646 -0.586 1 1 838 . 3 1 1 A 95 95 ILE H H 95 8.290 8.936 -0.646 1 1 839 . 3 1 1 A 95 95 ILE HA H 95 4.120 4.287 -0.167 1 1 849 . 3 1 1 A 95 95 ILE C C 95 175.740 174.669 1.071 1 1 850 . 3 1 1 A 95 95 ILE CA C 95 62.760 61.918 0.842 1 1 851 . 3 1 1 A 95 95 ILE CB C 95 38.890 40.253 -1.363 1 1 855 . 3 1 1 A 95 95 ILE N N 95 126.530 128.871 -2.341 1 1 856 . 3 1 1 A 96 96 GLU H H 96 8.030 7.426 0.604 1 1 857 . 3 1 1 A 96 96 GLU HA H 96 4.450 4.734 -0.284 1 1 862 . 3 1 1 A 96 96 GLU C C 96 174.380 175.089 -0.709 1 1 863 . 3 1 1 A 96 96 GLU CA C 96 54.320 54.967 -0.647 1 1 864 . 3 1 1 A 96 96 GLU CB C 96 32.770 33.801 -1.031 1 1 866 . 3 1 1 A 96 96 GLU N N 96 117.080 119.005 -1.925 1 1 867 . 3 1 1 A 97 97 ASP H H 97 8.730 8.687 0.043 1 1 868 . 3 1 1 A 97 97 ASP HA H 97 4.360 4.618 -0.258 1 1 871 . 3 1 1 A 97 97 ASP C C 97 177.100 176.520 0.580 1 1 872 . 3 1 1 A 97 97 ASP CA C 97 57.160 55.424 1.736 1 1 873 . 3 1 1 A 97 97 ASP CB C 97 39.920 40.201 -0.281 1 1 874 . 3 1 1 A 97 97 ASP N N 97 120.570 122.162 -1.592 1 1 875 . 3 1 1 A 98 98 GLY H H 98 8.760 8.460 0.300 1 1 876 . 3 1 1 A 98 98 GLY HA2 H 98 2.120 1.302 0.818 1 1 877 . 3 1 1 A 98 98 GLY HA3 H 98 3.910 3.322 0.588 1 1 878 . 3 1 1 A 98 98 GLY C C 98 174.000 172.896 1.104 1 1 879 . 3 1 1 A 98 98 GLY CA C 98 45.720 44.930 0.790 1 1 880 . 3 1 1 A 98 98 GLY N N 98 112.090 111.235 0.855 1 1 881 . 3 1 1 A 99 99 LYS H H 99 7.890 6.956 0.934 1 1 882 . 3 1 1 A 99 99 LYS HA H 99 5.330 5.152 0.178 1 1 891 . 3 1 1 A 99 99 LYS C C 99 174.750 174.336 0.414 1 1 892 . 3 1 1 A 99 99 LYS CA C 99 55.990 54.877 1.113 1 1 893 . 3 1 1 A 99 99 LYS CB C 99 37.840 35.474 2.366 1 1 897 . 3 1 1 A 99 99 LYS N N 99 118.050 114.895 3.155 1 1 898 . 3 1 1 A 100 100 VAL H H 100 8.980 8.608 0.372 1 1 899 . 3 1 1 A 100 100 VAL HA H 100 4.510 4.672 -0.162 1 1 907 . 3 1 1 A 100 100 VAL C C 100 174.760 173.747 1.013 1 1 908 . 3 1 1 A 100 100 VAL CA C 100 60.130 58.976 1.154 1 1 909 . 3 1 1 A 100 100 VAL CB C 100 35.240 35.688 -0.448 1 1 912 . 3 1 1 A 100 100 VAL N N 100 123.850 119.488 4.362 1 1 913 . 3 1 1 A 101 101 ARG H H 101 8.810 8.232 0.578 1 1 914 . 3 1 1 A 101 101 ARG HA H 101 4.850 4.695 0.155 1 1 921 . 3 1 1 A 101 101 ARG C C 101 174.770 174.366 0.404 1 1 922 . 3 1 1 A 101 101 ARG CA C 101 54.580 54.688 -0.108 1 1 923 . 3 1 1 A 101 101 ARG CB C 101 32.400 31.634 0.766 1 1 926 . 3 1 1 A 101 101 ARG N N 101 129.210 122.986 6.224 1 1 927 . 3 1 1 A 102 102 VAL H H 102 9.100 8.156 0.944 1 1 928 . 3 1 1 A 102 102 VAL HA H 102 4.120 4.864 -0.744 1 1 936 . 3 1 1 A 102 102 VAL C C 102 171.640 173.764 -2.124 1 1 937 . 3 1 1 A 102 102 VAL CA C 102 61.350 59.152 2.198 1 1 938 . 3 1 1 A 102 102 VAL CB C 102 32.530 35.440 -2.910 1 1 941 . 3 1 1 A 102 102 VAL N N 102 130.470 122.844 7.626 1 1 942 . 3 1 1 A 103 103 LEU H H 103 8.110 9.366 -1.256 1 1 943 . 3 1 1 A 103 103 LEU HA H 103 5.120 4.915 0.205 1 1 953 . 3 1 1 A 103 103 LEU C C 103 176.410 175.676 0.734 1 1 954 . 3 1 1 A 103 103 LEU CA C 103 53.380 53.316 0.064 1 1 955 . 3 1 1 A 103 103 LEU CB C 103 43.680 43.799 -0.119 1 1 959 . 3 1 1 A 103 103 LEU N N 103 125.560 127.630 -2.070 1 1 960 . 3 1 1 A 104 104 VAL H H 104 9.580 9.188 0.392 1 1 961 . 3 1 1 A 104 104 VAL HA H 104 5.260 4.843 0.417 1 1 969 . 3 1 1 A 104 104 VAL C C 104 176.030 175.010 1.020 1 1 970 . 3 1 1 A 104 104 VAL CA C 104 60.220 61.335 -1.115 1 1 971 . 3 1 1 A 104 104 VAL CB C 104 34.310 33.612 0.698 1 1 974 . 3 1 1 A 104 104 VAL N N 104 125.790 127.306 -1.516 1 1 975 . 3 1 1 A 105 105 SER H H 105 9.340 8.918 0.422 1 1 976 . 3 1 1 A 105 105 SER HA H 105 5.300 5.110 0.190 1 1 979 . 3 1 1 A 105 105 SER C C 105 173.600 172.998 0.602 1 1 980 . 3 1 1 A 105 105 SER CA C 105 57.450 57.460 -0.010 1 1 981 . 3 1 1 A 105 105 SER CB C 105 65.600 66.802 -1.202 1 1 982 . 3 1 1 A 105 105 SER N N 105 119.220 119.943 -0.723 1 1 983 . 3 1 1 A 106 106 SER H H 106 8.350 9.046 -0.696 1 1 984 . 3 1 1 A 106 106 SER HA H 106 4.720 4.789 -0.069 1 1 987 . 3 1 1 A 106 106 SER C C 106 176.930 174.378 2.552 1 1 988 . 3 1 1 A 106 106 SER CA C 106 58.170 58.878 -0.708 1 1 989 . 3 1 1 A 106 106 SER CB C 106 64.170 63.839 0.331 1 1 990 . 3 1 1 A 106 106 SER N N 106 114.800 120.372 -5.572 1 1 991 . 3 1 1 A 107 107 LEU H H 107 8.770 8.601 0.169 1 1 992 . 3 1 1 A 107 107 LEU HA H 107 4.710 4.616 0.094 1 1 1001 . 3 1 1 A 107 107 LEU C C 107 178.280 177.291 0.989 1 1 1002 . 3 1 1 A 107 107 LEU CA C 107 55.280 54.262 1.018 1 1 1003 . 3 1 1 A 107 107 LEU CB C 107 43.410 41.343 2.067 1 1 1007 . 3 1 1 A 107 107 LEU N N 107 127.210 126.889 0.321 1 1 1008 . 3 1 1 A 108 108 THR H H 108 8.210 7.827 0.383 1 1 1009 . 3 1 1 A 108 108 THR HA H 108 4.400 4.611 -0.211 1 1 1015 . 3 1 1 A 108 108 THR C C 108 176.130 175.680 0.450 1 1 1016 . 3 1 1 A 108 108 THR CA C 108 62.050 62.127 -0.077 1 1 1017 . 3 1 1 A 108 108 THR CB C 108 70.910 71.407 -0.497 1 1 1019 . 3 1 1 A 108 108 THR N N 108 108.810 111.838 -3.028 1 1 1020 . 3 1 1 A 109 109 GLY H H 109 8.250 8.157 0.093 1 1 1021 . 3 1 1 A 109 109 GLY HA2 H 109 3.780 4.087 -0.307 1 1 1022 . 3 1 1 A 109 109 GLY HA3 H 109 4.290 4.108 0.182 1 1 1023 . 3 1 1 A 109 109 GLY C C 109 173.180 174.628 -1.448 1 1 1024 . 3 1 1 A 109 109 GLY CA C 109 45.340 45.189 0.151 1 1 1025 . 3 1 1 A 109 109 GLY N N 109 110.160 111.014 -0.854 1 1 1026 . 3 1 1 A 110 110 GLU H H 110 7.960 7.544 0.416 1 1 1027 . 3 1 1 A 110 110 GLU HA H 110 4.760 4.683 0.077 1 1 1032 . 3 1 1 A 110 110 GLU CA C 110 53.450 53.970 -0.520 1 1 1033 . 3 1 1 A 110 110 GLU CB C 110 30.020 29.349 0.671 1 1 1035 . 3 1 1 A 110 110 GLU N N 110 119.720 121.121 -1.401 1 1 1036 . 3 1 1 A 111 111 PRO HA H 111 3.250 4.078 -0.828 1 1 1043 . 3 1 1 A 111 111 PRO C C 111 176.710 176.796 -0.086 1 1 1044 . 3 1 1 A 111 111 PRO CA C 111 62.240 61.945 0.295 1 1 1045 . 3 1 1 A 111 111 PRO CB C 111 31.990 31.071 0.919 1 1 1048 . 3 1 1 A 112 112 LEU H H 112 8.840 7.939 0.901 1 1 1049 . 3 1 1 A 112 112 LEU HA H 112 4.290 4.277 0.013 1 1 1059 . 3 1 1 A 112 112 LEU CA C 112 52.220 53.387 -1.167 1 1 1060 . 3 1 1 A 112 112 LEU CB C 112 41.090 42.180 -1.090 1 1 1063 . 3 1 1 A 112 112 LEU N N 112 122.420 119.872 2.548 1 1 1064 . 3 1 1 A 113 113 PRO HA H 113 4.380 4.686 -0.306 1 1 1071 . 3 1 1 A 113 113 PRO C C 113 176.100 176.374 -0.274 1 1 1072 . 3 1 1 A 113 113 PRO CA C 113 61.930 62.192 -0.262 1 1 1073 . 3 1 1 A 113 113 PRO CB C 113 32.470 32.484 -0.014 1 1 1076 . 3 1 1 A 114 114 ALA H H 114 8.070 8.181 -0.111 1 1 1077 . 3 1 1 A 114 114 ALA HA H 114 4.550 4.450 0.100 1 1 1081 . 3 1 1 A 114 114 ALA C C 114 177.490 177.111 0.379 1 1 1082 . 3 1 1 A 114 114 ALA CA C 114 51.340 51.308 0.032 1 1 1083 . 3 1 1 A 114 114 ALA CB C 114 19.940 20.602 -0.662 1 1 1084 . 3 1 1 A 114 114 ALA N N 114 121.460 123.131 -1.671 1 1 1085 . 3 1 1 A 115 115 LYS H H 115 9.000 8.414 0.586 1 1 1086 . 3 1 1 A 115 115 LYS HA H 115 3.930 3.781 0.149 1 1 1095 . 3 1 1 A 115 115 LYS C C 115 175.740 174.949 0.791 1 1 1096 . 3 1 1 A 115 115 LYS CA C 115 57.580 57.425 0.155 1 1 1097 . 3 1 1 A 115 115 LYS CB C 115 29.510 30.197 -0.687 1 1 1101 . 3 1 1 A 115 115 LYS N N 115 112.560 115.738 -3.178 1 1 1102 . 3 1 1 A 116 116 GLU H H 116 7.620 7.622 -0.002 1 1 1103 . 3 1 1 A 116 116 GLU HA H 116 4.550 4.552 -0.002 1 1 1108 . 3 1 1 A 116 116 GLU C C 116 176.110 174.401 1.709 1 1 1109 . 3 1 1 A 116 116 GLU CA C 116 54.570 55.485 -0.915 1 1 1110 . 3 1 1 A 116 116 GLU CB C 116 33.680 33.322 0.358 1 1 1112 . 3 1 1 A 116 116 GLU N N 116 115.710 117.567 -1.857 1 1 1113 . 3 1 1 A 117 117 VAL H H 117 8.770 8.810 -0.040 1 1 1114 . 3 1 1 A 117 117 VAL HA H 117 3.200 3.928 -0.728 1 1 1122 . 3 1 1 A 117 117 VAL C C 117 175.740 175.691 0.049 1 1 1123 . 3 1 1 A 117 117 VAL CA C 117 65.340 63.552 1.788 1 1 1124 . 3 1 1 A 117 117 VAL CB C 117 31.290 30.944 0.346 1 1 1127 . 3 1 1 A 117 117 VAL N N 117 124.450 126.250 -1.800 1 1 1128 . 3 1 1 A 118 118 LEU H H 118 8.550 8.874 -0.324 1 1 1129 . 3 1 1 A 118 118 LEU HA H 118 4.540 4.342 0.198 1 1 1139 . 3 1 1 A 118 118 LEU C C 118 176.210 176.891 -0.681 1 1 1140 . 3 1 1 A 118 118 LEU CA C 118 55.510 55.834 -0.324 1 1 1141 . 3 1 1 A 118 118 LEU CB C 118 44.600 42.342 2.258 1 1 1145 . 3 1 1 A 118 118 LEU N N 118 128.440 128.968 -0.528 1 1 1146 . 3 1 1 A 119 119 ALA H H 119 7.970 7.481 0.489 1 1 1147 . 3 1 1 A 119 119 ALA HA H 119 4.740 4.890 -0.150 1 1 1151 . 3 1 1 A 119 119 ALA C C 119 174.570 175.176 -0.606 1 1 1152 . 3 1 1 A 119 119 ALA CA C 119 50.770 51.664 -0.894 1 1 1153 . 3 1 1 A 119 119 ALA CB C 119 22.450 22.355 0.095 1 1 1154 . 3 1 1 A 119 119 ALA N N 119 118.100 117.287 0.813 1 1 1155 . 3 1 1 A 120 120 LYS H H 120 8.760 8.556 0.204 1 1 1156 . 3 1 1 A 120 120 LYS HA H 120 5.240 5.514 -0.274 1 1 1165 . 3 1 1 A 120 120 LYS C C 120 175.340 175.340 0.000 1 1 1166 . 3 1 1 A 120 120 LYS CA C 120 54.220 54.799 -0.579 1 1 1167 . 3 1 1 A 120 120 LYS CB C 120 34.340 35.736 -1.396 1 1 1171 . 3 1 1 A 120 120 LYS N N 120 120.010 121.740 -1.730 1 1 1172 . 3 1 1 A 121 121 VAL H H 121 9.410 9.247 0.163 1 1 1173 . 3 1 1 A 121 121 VAL HA H 121 4.230 4.664 -0.434 1 1 1181 . 3 1 1 A 121 121 VAL C C 121 173.980 174.995 -1.015 1 1 1182 . 3 1 1 A 121 121 VAL CA C 121 62.370 61.362 1.008 1 1 1183 . 3 1 1 A 121 121 VAL CB C 121 32.410 32.959 -0.549 1 1 1186 . 3 1 1 A 121 121 VAL N N 121 124.960 124.904 0.056 1 1 1187 . 3 1 1 A 122 122 VAL H H 122 9.280 8.120 1.160 1 1 1188 . 3 1 1 A 122 122 VAL HA H 122 4.360 4.731 -0.371 1 1 1196 . 3 1 1 A 122 122 VAL C C 122 174.190 175.201 -1.011 1 1 1197 . 3 1 1 A 122 122 VAL CA C 122 62.760 61.469 1.291 1 1 1198 . 3 1 1 A 122 122 VAL CB C 122 32.020 31.404 0.616 1 1 1201 . 3 1 1 A 122 122 VAL N N 122 128.990 125.698 3.292 1 1 1202 . 3 1 1 A 123 123 LEU H H 123 8.610 9.014 -0.404 1 1 1203 . 3 1 1 A 123 123 LEU HA H 123 4.900 4.359 0.541 1 1 1213 . 3 1 1 A 123 123 LEU C C 123 174.950 176.605 -1.655 1 1 1214 . 3 1 1 A 123 123 LEU CA C 123 52.050 53.991 -1.941 1 1 1215 . 3 1 1 A 123 123 LEU CB C 123 45.210 40.904 4.306 1 1 1219 . 3 1 1 A 123 123 LEU N N 123 127.200 128.944 -1.744 1 1 1220 . 3 1 1 A 124 124 ARG H H 124 9.540 8.789 0.751 1 1 1221 . 3 1 1 A 124 124 ARG HA H 124 4.900 4.318 0.582 1 1 1229 . 3 1 1 A 124 124 ARG C C 124 176.320 175.762 0.558 1 1 1230 . 3 1 1 A 124 124 ARG CA C 124 55.320 57.099 -1.779 1 1 1231 . 3 1 1 A 124 124 ARG CB C 124 31.750 30.658 1.092 1 1 1234 . 3 1 1 A 124 124 ARG N N 124 124.290 126.058 -1.768 1 1 1236 . 3 1 1 A 125 125 ALA H H 125 8.880 8.546 0.334 1 1 1237 . 3 1 1 A 125 125 ALA HA H 125 4.380 4.142 0.238 1 1 1241 . 3 1 1 A 125 125 ALA C C 125 177.290 177.692 -0.402 1 1 1242 . 3 1 1 A 125 125 ALA CA C 125 52.530 51.514 1.016 1 1 1243 . 3 1 1 A 125 125 ALA CB C 125 19.870 17.306 2.564 1 1 1244 . 3 1 1 A 125 125 ALA N N 125 130.790 129.675 1.115 1 1 1245 . 3 1 1 A 126 126 GLU H H 126 9.260 8.809 0.451 1 1 1246 . 3 1 1 A 126 126 GLU HA H 126 4.460 4.432 0.028 1 1 1251 . 3 1 1 A 126 126 GLU C C 126 176.120 175.956 0.164 1 1 1252 . 3 1 1 A 126 126 GLU CA C 126 56.940 57.478 -0.538 1 1 1253 . 3 1 1 A 126 126 GLU CB C 126 32.450 30.193 2.257 1 1 1255 . 3 1 1 A 126 126 GLU N N 126 125.740 123.429 2.311 1 1 1256 . 3 1 1 A 127 127 ALA H H 127 7.460 7.509 -0.049 1 1 1257 . 3 1 1 A 127 127 ALA HA H 127 4.360 4.606 -0.246 1 1 1261 . 3 1 1 A 127 127 ALA C C 127 173.400 175.733 -2.333 1 1 1262 . 3 1 1 A 127 127 ALA CA C 127 51.360 51.688 -0.328 1 1 1263 . 3 1 1 A 127 127 ALA CB C 127 22.180 21.891 0.289 1 1 1264 . 3 1 1 A 127 127 ALA N N 127 120.910 119.188 1.722 1 1 1265 . 3 1 1 A 128 128 LYS H H 128 7.940 8.699 -0.759 1 1 1266 . 3 1 1 A 128 128 LYS HA H 128 3.580 4.129 -0.549 1 1 1275 . 3 1 1 A 128 128 LYS C C 128 176.080 175.702 0.378 1 1 1276 . 3 1 1 A 128 128 LYS CA C 128 56.860 57.186 -0.326 1 1 1277 . 3 1 1 A 128 128 LYS CB C 128 33.170 33.188 -0.018 1 1 1281 . 3 1 1 A 128 128 LYS N N 128 116.520 124.632 -8.112 1 1 1282 . 3 1 1 A 129 129 ALA H H 129 8.590 8.581 0.009 1 1 1283 . 3 1 1 A 129 129 ALA HA H 129 4.390 4.671 -0.281 1 1 1287 . 3 1 1 A 129 129 ALA C C 129 174.970 175.826 -0.856 1 1 1288 . 3 1 1 A 129 129 ALA CA C 129 52.970 51.017 1.953 1 1 1289 . 3 1 1 A 129 129 ALA CB C 129 21.500 19.369 2.131 1 1 1290 . 3 1 1 A 129 129 ALA N N 129 124.710 128.580 -3.870 1 1 1291 . 3 1 1 A 130 130 GLU H H 130 8.660 8.153 0.507 1 1 1292 . 3 1 1 A 130 130 GLU HA H 130 4.660 4.163 0.497 1 1 1297 . 3 1 1 A 130 130 GLU C C 130 177.390 177.088 0.302 1 1 1298 . 3 1 1 A 130 130 GLU CA C 130 55.070 57.712 -2.642 1 1 1299 . 3 1 1 A 130 130 GLU CB C 130 30.860 29.169 1.691 1 1 1301 . 3 1 1 A 130 130 GLU N N 130 123.180 118.292 4.888 1 1 1302 . 3 1 1 A 131 131 GLY H H 131 9.170 8.771 0.399 1 1 1303 . 3 1 1 A 131 131 GLY HA2 H 131 3.560 3.990 -0.430 1 1 1304 . 3 1 1 A 131 131 GLY HA3 H 131 3.750 3.999 -0.249 1 1 1305 . 3 1 1 A 131 131 GLY C C 131 174.550 174.515 0.035 1 1 1306 . 3 1 1 A 131 131 GLY CA C 131 47.660 45.871 1.789 1 1 1307 . 3 1 1 A 131 131 GLY N N 131 115.530 113.440 2.090 1 1 1308 . 3 1 1 A 132 132 SER H H 132 8.430 8.102 0.328 1 1 1309 . 3 1 1 A 132 132 SER HA H 132 4.170 4.634 -0.464 1 1 1312 . 3 1 1 A 132 132 SER C C 132 175.350 174.194 1.156 1 1 1313 . 3 1 1 A 132 132 SER CA C 132 59.050 57.671 1.379 1 1 1314 . 3 1 1 A 132 132 SER CB C 132 64.880 62.047 2.833 1 1 1315 . 3 1 1 A 132 132 SER N N 132 115.930 118.355 -2.425 1 1 1316 . 3 1 1 A 133 133 ASN H H 133 8.850 9.063 -0.213 1 1 1317 . 3 1 1 A 133 133 ASN HA H 133 4.910 5.228 -0.318 1 1 1322 . 3 1 1 A 133 133 ASN C C 133 175.450 174.767 0.683 1 1 1323 . 3 1 1 A 133 133 ASN CA C 133 54.920 53.943 0.977 1 1 1324 . 3 1 1 A 133 133 ASN CB C 133 41.060 39.095 1.965 1 1 1325 . 3 1 1 A 133 133 ASN N N 133 125.590 123.118 2.472 1 1 1327 . 3 1 1 A 134 134 LEU H H 134 9.070 9.579 -0.509 1 1 1328 . 3 1 1 A 134 134 LEU HA H 134 5.230 5.291 -0.061 1 1 1338 . 3 1 1 A 134 134 LEU C C 134 175.240 175.896 -0.656 1 1 1339 . 3 1 1 A 134 134 LEU CA C 134 53.470 53.560 -0.090 1 1 1340 . 3 1 1 A 134 134 LEU CB C 134 45.090 44.804 0.286 1 1 1344 . 3 1 1 A 134 134 LEU N N 134 129.210 126.443 2.767 1 1 1345 . 3 1 1 A 135 135 SER H H 135 8.690 8.743 -0.053 1 1 1346 . 3 1 1 A 135 135 SER HA H 135 5.280 5.453 -0.173 1 1 1349 . 3 1 1 A 135 135 SER C C 135 173.590 173.334 0.256 1 1 1350 . 3 1 1 A 135 135 SER CA C 135 56.220 56.798 -0.578 1 1 1351 . 3 1 1 A 135 135 SER CB C 135 66.510 64.820 1.690 1 1 1352 . 3 1 1 A 135 135 SER N N 135 113.020 118.572 -5.552 1 1 1353 . 3 1 1 A 136 136 VAL H H 136 8.940 8.495 0.445 1 1 1354 . 3 1 1 A 136 136 VAL HA H 136 5.500 5.001 0.499 1 1 1362 . 3 1 1 A 136 136 VAL C C 136 175.730 175.200 0.530 1 1 1363 . 3 1 1 A 136 136 VAL CA C 136 60.960 61.103 -0.143 1 1 1364 . 3 1 1 A 136 136 VAL CB C 136 33.630 32.770 0.860 1 1 1367 . 3 1 1 A 136 136 VAL N N 136 124.340 121.564 2.776 1 1 1368 . 3 1 1 A 137 137 THR H H 137 9.240 8.597 0.643 1 1 1369 . 3 1 1 A 137 137 THR HA H 137 4.920 4.805 0.115 1 1 1374 . 3 1 1 A 137 137 THR C C 137 173.500 174.647 -1.147 1 1 1375 . 3 1 1 A 137 137 THR CA C 137 59.120 60.289 -1.169 1 1 1376 . 3 1 1 A 137 137 THR CB C 137 72.500 70.611 1.889 1 1 1378 . 3 1 1 A 137 137 THR N N 137 117.010 118.707 -1.697 1 1 1379 . 3 1 1 A 138 138 ASN H H 138 9.190 8.943 0.247 1 1 1380 . 3 1 1 A 138 138 ASN HA H 138 4.420 4.436 -0.016 1 1 1385 . 3 1 1 A 138 138 ASN C C 138 175.550 175.263 0.287 1 1 1386 . 3 1 1 A 138 138 ASN CA C 138 54.350 54.072 0.278 1 1 1387 . 3 1 1 A 138 138 ASN CB C 138 37.380 36.335 1.045 1 1 1388 . 3 1 1 A 138 138 ASN N N 138 115.270 120.700 -5.430 1 1 1390 . 3 1 1 A 139 139 SER H H 139 8.560 7.881 0.679 1 1 1391 . 3 1 1 A 139 139 SER HA H 139 5.800 4.390 1.410 1 1 1394 . 3 1 1 A 139 139 SER C C 139 175.750 173.617 2.133 1 1 1395 . 3 1 1 A 139 139 SER CA C 139 56.020 58.229 -2.209 1 1 1396 . 3 1 1 A 139 139 SER CB C 139 65.320 63.589 1.731 1 1 1397 . 3 1 1 A 139 139 SER N N 139 112.360 117.003 -4.643 1 1 1398 . 3 1 1 A 140 140 SER H H 140 9.900 8.487 1.413 1 1 1399 . 3 1 1 A 140 140 SER HA H 140 5.360 5.180 0.180 1 1 1402 . 3 1 1 A 140 140 SER C C 140 172.620 173.650 -1.030 1 1 1403 . 3 1 1 A 140 140 SER CA C 140 57.400 57.321 0.079 1 1 1404 . 3 1 1 A 140 140 SER CB C 140 66.550 65.639 0.911 1 1 1405 . 3 1 1 A 140 140 SER N N 140 119.130 124.090 -4.960 1 1 1406 . 3 1 1 A 141 141 VAL H H 141 9.030 8.768 0.262 1 1 1407 . 3 1 1 A 141 141 VAL HA H 141 5.520 5.108 0.412 1 1 1415 . 3 1 1 A 141 141 VAL C C 141 174.750 175.291 -0.541 1 1 1416 . 3 1 1 A 141 141 VAL CA C 141 58.310 59.640 -1.330 1 1 1417 . 3 1 1 A 141 141 VAL CB C 141 35.030 36.142 -1.112 1 1 1420 . 3 1 1 A 141 141 VAL N N 141 111.410 115.894 -4.484 1 1 1421 . 3 1 1 A 142 142 GLY H H 142 8.790 8.674 0.116 1 1 1422 . 3 1 1 A 142 142 GLY HA2 H 142 3.600 4.277 -0.677 1 1 1423 . 3 1 1 A 142 142 GLY HA3 H 142 5.310 4.308 1.002 1 1 1424 . 3 1 1 A 142 142 GLY C C 142 174.180 173.594 0.586 1 1 1425 . 3 1 1 A 142 142 GLY CA C 142 44.110 45.562 -1.452 1 1 1426 . 3 1 1 A 142 142 GLY N N 142 109.330 109.824 -0.494 1 1 1427 . 3 1 1 A 143 143 ASP H H 143 8.840 8.620 0.220 1 1 1428 . 3 1 1 A 143 143 ASP HA H 143 5.790 5.020 0.770 1 1 1431 . 3 1 1 A 143 143 ASP C C 143 178.860 178.011 0.849 1 1 1432 . 3 1 1 A 143 143 ASP CA C 143 53.040 54.704 -1.664 1 1 1433 . 3 1 1 A 143 143 ASP CB C 143 43.660 42.491 1.169 1 1 1434 . 3 1 1 A 143 143 ASP N N 143 125.390 126.143 -0.753 1 1 1435 . 3 1 1 A 144 144 GLY H H 144 9.150 8.796 0.354 1 1 1436 . 3 1 1 A 144 144 GLY HA2 H 144 3.450 3.754 -0.304 1 1 1437 . 3 1 1 A 144 144 GLY HA3 H 144 3.720 3.899 -0.179 1 1 1438 . 3 1 1 A 144 144 GLY C C 144 174.770 175.606 -0.836 1 1 1439 . 3 1 1 A 144 144 GLY CA C 144 46.930 47.655 -0.725 1 1 1440 . 3 1 1 A 144 144 GLY N N 144 106.470 110.568 -4.098 1 1 1441 . 3 1 1 A 145 145 GLU H H 145 8.470 7.669 0.801 1 1 1442 . 3 1 1 A 145 145 GLU HA H 145 4.460 4.197 0.263 1 1 1447 . 3 1 1 A 145 145 GLU C C 145 176.520 176.215 0.305 1 1 1448 . 3 1 1 A 145 145 GLU CA C 145 55.330 57.260 -1.930 1 1 1449 . 3 1 1 A 145 145 GLU CB C 145 30.620 29.986 0.634 1 1 1451 . 3 1 1 A 145 145 GLU N N 145 119.170 121.394 -2.224 1 1 1452 . 3 1 1 A 146 146 GLY H H 146 7.950 7.905 0.045 1 1 1453 . 3 1 1 A 146 146 GLY HA2 H 146 3.630 4.023 -0.393 1 1 1454 . 3 1 1 A 146 146 GLY HA3 H 146 4.130 4.027 0.103 1 1 1455 . 3 1 1 A 146 146 GLY C C 146 174.350 174.650 -0.300 1 1 1456 . 3 1 1 A 146 146 GLY CA C 146 45.330 45.219 0.111 1 1 1457 . 3 1 1 A 146 146 GLY N N 146 108.130 106.309 1.821 1 1 1458 . 3 1 1 A 147 147 LEU H H 147 8.440 7.905 0.535 1 1 1459 . 3 1 1 A 147 147 LEU HA H 147 4.340 4.280 0.060 1 1 1469 . 3 1 1 A 147 147 LEU C C 147 175.950 176.143 -0.193 1 1 1470 . 3 1 1 A 147 147 LEU CA C 147 54.860 55.333 -0.473 1 1 1471 . 3 1 1 A 147 147 LEU CB C 147 41.590 42.650 -1.060 1 1 1475 . 3 1 1 A 147 147 LEU N N 147 124.000 122.889 1.111 1 1 1476 . 3 1 1 A 148 148 VAL H H 148 7.780 8.602 -0.822 1 1 1477 . 3 1 1 A 148 148 VAL HA H 148 4.830 4.663 0.167 1 1 1485 . 3 1 1 A 148 148 VAL C C 148 175.740 175.426 0.314 1 1 1486 . 3 1 1 A 148 148 VAL CA C 148 61.140 61.386 -0.246 1 1 1487 . 3 1 1 A 148 148 VAL CB C 148 33.640 33.460 0.180 1 1 1490 . 3 1 1 A 148 148 VAL N N 148 120.440 123.545 -3.105 1 1 1491 . 3 1 1 A 149 149 HIS H H 149 9.170 8.952 0.218 1 1 1492 . 3 1 1 A 149 149 HIS HA H 149 4.950 5.084 -0.134 1 1 1496 . 3 1 1 A 149 149 HIS C C 149 174.780 174.466 0.314 1 1 1497 . 3 1 1 A 149 149 HIS CA C 149 53.900 54.276 -0.376 1 1 1498 . 3 1 1 A 149 149 HIS CB C 149 32.200 30.482 1.718 1 1 1499 . 3 1 1 A 149 149 HIS N N 149 124.700 124.917 -0.217 1 1 1500 . 3 1 1 A 150 150 GLU H H 150 9.060 8.849 0.211 1 1 1501 . 3 1 1 A 150 150 GLU HA H 150 4.420 4.231 0.189 1 1 1506 . 3 1 1 A 150 150 GLU C C 150 176.520 176.798 -0.278 1 1 1507 . 3 1 1 A 150 150 GLU CA C 150 57.630 56.753 0.877 1 1 1508 . 3 1 1 A 150 150 GLU CB C 150 30.370 29.869 0.501 1 1 1510 . 3 1 1 A 150 150 GLU N N 150 125.540 124.061 1.479 1 1 1511 . 3 1 1 A 151 151 ILE H H 151 8.150 7.966 0.184 1 1 1512 . 3 1 1 A 151 151 ILE HA H 151 4.780 4.525 0.255 1 1 1522 . 3 1 1 A 151 151 ILE C C 151 174.570 176.209 -1.639 1 1 1523 . 3 1 1 A 151 151 ILE CA C 151 59.390 59.517 -0.127 1 1 1524 . 3 1 1 A 151 151 ILE CB C 151 42.040 39.282 2.758 1 1 1528 . 3 1 1 A 151 151 ILE N N 151 115.880 122.214 -6.334 1 1 1529 . 3 1 1 A 152 152 ALA H H 152 8.010 8.463 -0.453 1 1 1530 . 3 1 1 A 152 152 ALA HA H 152 4.310 4.411 -0.101 1 1 1534 . 3 1 1 A 152 152 ALA C C 152 177.500 176.687 0.813 1 1 1535 . 3 1 1 A 152 152 ALA CA C 152 53.680 51.529 2.151 1 1 1536 . 3 1 1 A 152 152 ALA CB C 152 20.050 19.650 0.400 1 1 1537 . 3 1 1 A 152 152 ALA N N 152 126.640 124.535 2.105 1 1 1538 . 3 1 1 A 153 153 GLY H H 153 8.340 8.367 -0.027 1 1 1539 . 3 1 1 A 153 153 GLY HA2 H 153 4.050 4.326 -0.276 1 1 1540 . 3 1 1 A 153 153 GLY HA3 H 153 4.140 4.327 -0.187 1 1 1541 . 3 1 1 A 153 153 GLY C C 153 173.140 171.824 1.316 1 1 1542 . 3 1 1 A 153 153 GLY CA C 153 44.130 45.702 -1.572 1 1 1543 . 3 1 1 A 153 153 GLY N N 153 107.490 105.437 2.053 1 1 1544 . 3 1 1 A 154 154 THR H H 154 7.380 8.427 -1.047 1 1 1545 . 3 1 1 A 154 154 THR HA H 154 4.700 5.050 -0.350 1 1 1550 . 3 1 1 A 154 154 THR C C 154 171.120 173.881 -2.761 1 1 1551 . 3 1 1 A 154 154 THR CA C 154 60.830 60.997 -0.167 1 1 1552 . 3 1 1 A 154 154 THR CB C 154 68.850 72.381 -3.531 1 1 1554 . 3 1 1 A 154 154 THR N N 154 109.340 114.208 -4.868 1 1 1555 . 3 1 1 A 155 155 GLU H H 155 8.020 8.641 -0.621 1 1 1556 . 3 1 1 A 155 155 GLU HA H 155 5.370 5.614 -0.244 1 1 1561 . 3 1 1 A 155 155 GLU C C 155 174.240 174.663 -0.423 1 1 1562 . 3 1 1 A 155 155 GLU CA C 155 54.830 54.543 0.287 1 1 1563 . 3 1 1 A 155 155 GLU CB C 155 33.620 32.737 0.883 1 1 1565 . 3 1 1 A 155 155 GLU N N 155 118.690 122.706 -4.016 1 1 1566 . 3 1 1 A 156 156 LYS H H 156 9.230 9.108 0.122 1 1 1567 . 3 1 1 A 156 156 LYS HA H 156 4.650 5.111 -0.461 1 1 1576 . 3 1 1 A 156 156 LYS C C 156 174.000 174.513 -0.513 1 1 1577 . 3 1 1 A 156 156 LYS CA C 156 55.840 55.206 0.634 1 1 1578 . 3 1 1 A 156 156 LYS CB C 156 37.550 36.622 0.928 1 1 1582 . 3 1 1 A 156 156 LYS N N 156 121.940 120.987 0.953 1 1 1583 . 3 1 1 A 157 157 THR H H 157 8.160 8.700 -0.540 1 1 1584 . 3 1 1 A 157 157 THR HA H 157 5.440 5.138 0.302 1 1 1589 . 3 1 1 A 157 157 THR C C 157 174.360 173.665 0.695 1 1 1590 . 3 1 1 A 157 157 THR CA C 157 60.410 60.739 -0.329 1 1 1591 . 3 1 1 A 157 157 THR CB C 157 71.500 71.359 0.141 1 1 1593 . 3 1 1 A 157 157 THR N N 157 113.240 112.972 0.268 1 1 1594 . 3 1 1 A 158 158 VAL H H 158 9.120 9.124 -0.004 1 1 1595 . 3 1 1 A 158 158 VAL HA H 158 4.580 5.054 -0.474 1 1 1603 . 3 1 1 A 158 158 VAL C C 158 172.800 174.535 -1.735 1 1 1604 . 3 1 1 A 158 158 VAL CA C 158 59.980 59.257 0.723 1 1 1605 . 3 1 1 A 158 158 VAL CB C 158 36.290 34.671 1.619 1 1 1608 . 3 1 1 A 158 158 VAL N N 158 121.710 121.785 -0.075 1 1 1609 . 3 1 1 A 159 159 ASN H H 159 8.240 9.139 -0.899 1 1 1610 . 3 1 1 A 159 159 ASN HA H 159 5.420 5.277 0.143 1 1 1615 . 3 1 1 A 159 159 ASN C C 159 173.800 174.361 -0.561 1 1 1616 . 3 1 1 A 159 159 ASN CA C 159 51.740 52.075 -0.335 1 1 1617 . 3 1 1 A 159 159 ASN CB C 159 40.380 39.904 0.476 1 1 1618 . 3 1 1 A 159 159 ASN N N 159 122.730 122.413 0.317 1 1 1620 . 3 1 1 A 160 160 ILE H H 160 9.160 8.685 0.475 1 1 1621 . 3 1 1 A 160 160 ILE HA H 160 5.130 4.861 0.269 1 1 1631 . 3 1 1 A 160 160 ILE C C 160 177.320 175.607 1.713 1 1 1632 . 3 1 1 A 160 160 ILE CA C 160 60.640 61.487 -0.847 1 1 1633 . 3 1 1 A 160 160 ILE CB C 160 38.520 37.568 0.952 1 1 1637 . 3 1 1 A 160 160 ILE N N 160 123.690 125.281 -1.591 1 1 1638 . 3 1 1 A 161 161 ILE H H 161 8.780 8.990 -0.210 1 1 1639 . 3 1 1 A 161 161 ILE HA H 161 4.590 4.559 0.031 1 1 1649 . 3 1 1 A 161 161 ILE C C 161 174.960 175.842 -0.882 1 1 1650 . 3 1 1 A 161 161 ILE CA C 161 59.320 60.424 -1.104 1 1 1651 . 3 1 1 A 161 161 ILE CB C 161 41.030 40.602 0.428 1 1 1655 . 3 1 1 A 161 161 ILE N N 161 122.490 129.264 -6.774 1 1 1656 . 3 1 1 A 162 162 GLU H H 162 8.620 8.553 0.067 1 1 1657 . 3 1 1 A 162 162 GLU HA H 162 4.290 4.290 0.000 1 1 1662 . 3 1 1 A 162 162 GLU C C 162 176.660 176.007 0.653 1 1 1663 . 3 1 1 A 162 162 GLU CA C 162 56.470 57.855 -1.385 1 1 1664 . 3 1 1 A 162 162 GLU CB C 162 31.150 30.244 0.906 1 1 1666 . 3 1 1 A 162 162 GLU N N 162 120.520 127.203 -6.683 1 1 1667 . 3 1 1 A 163 163 GLY H H 163 8.480 8.682 -0.202 1 1 1668 . 3 1 1 A 163 163 GLY HA2 H 163 3.910 4.192 -0.282 1 1 1669 . 3 1 1 A 163 163 GLY HA3 H 163 4.150 4.192 -0.042 1 1 1670 . 3 1 1 A 163 163 GLY C C 163 174.000 173.729 0.271 1 1 1671 . 3 1 1 A 163 163 GLY CA C 163 45.270 45.012 0.258 1 1 1672 . 3 1 1 A 163 163 GLY N N 163 110.210 109.281 0.929 1 1 1673 . 3 1 1 A 164 164 THR H H 164 8.170 8.500 -0.330 1 1 1674 . 3 1 1 A 164 164 THR HA H 164 4.410 4.485 -0.075 1 1 1679 . 3 1 1 A 164 164 THR C C 164 174.100 175.171 -1.071 1 1 1680 . 3 1 1 A 164 164 THR CA C 164 61.620 62.469 -0.849 1 1 1681 . 3 1 1 A 164 164 THR CB C 164 70.060 69.628 0.432 1 1 1683 . 3 1 1 A 164 164 THR N N 164 113.480 120.270 -6.790 1 1 1 . 4 1 1 A 13 13 GLY H H 13 8.350 7.905 0.445 1 1 2 . 4 1 1 A 13 13 GLY HA2 H 13 3.920 4.194 -0.274 1 1 3 . 4 1 1 A 13 13 GLY HA3 H 13 3.920 4.199 -0.279 1 1 4 . 4 1 1 A 13 13 GLY CA C 13 45.290 43.739 1.551 1 1 5 . 4 1 1 A 13 13 GLY N N 13 110.450 105.348 5.102 1 1 6 . 4 1 1 A 14 14 LEU H H 14 8.050 8.610 -0.560 1 1 7 . 4 1 1 A 14 14 LEU N N 14 121.500 119.750 1.750 1 1 8 . 4 1 1 A 15 15 VAL H H 15 8.070 7.992 0.078 1 1 9 . 4 1 1 A 15 15 VAL N N 15 122.390 118.808 3.582 1 1 10 . 4 1 1 A 16 16 PRO HA H 16 4.360 4.274 0.086 1 1 17 . 4 1 1 A 16 16 PRO CA C 16 62.770 65.670 -2.900 1 1 18 . 4 1 1 A 16 16 PRO CB C 16 32.020 31.843 0.177 1 1 21 . 4 1 1 A 21 21 MET H H 21 8.180 8.206 -0.026 1 1 22 . 4 1 1 A 21 21 MET N N 21 121.310 117.867 3.443 1 1 23 . 4 1 1 A 22 22 ALA H H 22 8.290 8.205 0.085 1 1 24 . 4 1 1 A 22 22 ALA N N 22 124.800 120.710 4.090 1 1 25 . 4 1 1 A 23 23 SER H H 23 8.210 7.509 0.701 1 1 26 . 4 1 1 A 23 23 SER N N 23 114.830 111.908 2.922 1 1 27 . 4 1 1 A 24 24 LYS H H 24 8.250 8.437 -0.187 1 1 28 . 4 1 1 A 24 24 LYS N N 24 122.980 124.926 -1.946 1 1 29 . 4 1 1 A 25 25 LEU H H 25 8.140 7.419 0.721 1 1 30 . 4 1 1 A 25 25 LEU HA H 25 4.290 4.732 -0.442 1 1 40 . 4 1 1 A 25 25 LEU C C 25 177.410 174.692 2.718 1 1 41 . 4 1 1 A 25 25 LEU CA C 25 55.430 53.540 1.890 1 1 42 . 4 1 1 A 25 25 LEU CB C 25 42.350 43.975 -1.625 1 1 46 . 4 1 1 A 25 25 LEU N N 25 122.580 121.069 1.511 1 1 47 . 4 1 1 A 26 26 LYS H H 26 8.200 8.615 -0.415 1 1 48 . 4 1 1 A 26 26 LYS HA H 26 4.260 4.537 -0.277 1 1 57 . 4 1 1 A 26 26 LYS C C 26 176.520 175.961 0.559 1 1 58 . 4 1 1 A 26 26 LYS CA C 26 56.700 55.262 1.438 1 1 59 . 4 1 1 A 26 26 LYS CB C 26 33.060 32.570 0.490 1 1 63 . 4 1 1 A 26 26 LYS N N 26 121.800 123.908 -2.108 1 1 64 . 4 1 1 A 27 27 GLU H H 27 8.380 8.098 0.282 1 1 65 . 4 1 1 A 27 27 GLU HA H 27 4.240 4.200 0.040 1 1 70 . 4 1 1 A 27 27 GLU C C 27 176.130 174.899 1.231 1 1 71 . 4 1 1 A 27 27 GLU CA C 27 56.700 58.732 -2.032 1 1 72 . 4 1 1 A 27 27 GLU CB C 27 30.370 28.536 1.834 1 1 74 . 4 1 1 A 27 27 GLU N N 27 121.700 116.473 5.227 1 1 75 . 4 1 1 A 28 28 ALA H H 28 8.230 8.578 -0.348 1 1 76 . 4 1 1 A 28 28 ALA HA H 28 4.280 4.977 -0.697 1 1 80 . 4 1 1 A 28 28 ALA C C 28 177.090 175.634 1.456 1 1 81 . 4 1 1 A 28 28 ALA CA C 28 52.530 51.590 0.940 1 1 82 . 4 1 1 A 28 28 ALA CB C 28 19.360 22.868 -3.508 1 1 83 . 4 1 1 A 28 28 ALA N N 28 124.640 121.591 3.049 1 1 84 . 4 1 1 A 29 29 ALA H H 29 8.150 8.457 -0.307 1 1 85 . 4 1 1 A 29 29 ALA HA H 29 4.320 4.808 -0.488 1 1 89 . 4 1 1 A 29 29 ALA C C 29 177.120 175.827 1.293 1 1 90 . 4 1 1 A 29 29 ALA CA C 29 52.040 51.795 0.245 1 1 91 . 4 1 1 A 29 29 ALA CB C 29 19.430 18.899 0.531 1 1 92 . 4 1 1 A 29 29 ALA N N 29 123.430 121.485 1.945 1 1 93 . 4 1 1 A 30 30 GLU H H 30 8.310 8.779 -0.469 1 1 94 . 4 1 1 A 30 30 GLU HA H 30 4.220 4.841 -0.621 1 1 99 . 4 1 1 A 30 30 GLU C C 30 176.310 175.320 0.990 1 1 100 . 4 1 1 A 30 30 GLU CA C 30 56.630 55.507 1.123 1 1 101 . 4 1 1 A 30 30 GLU CB C 30 30.320 30.253 0.067 1 1 103 . 4 1 1 A 30 30 GLU N N 30 120.630 122.169 -1.539 1 1 104 . 4 1 1 A 31 31 VAL H H 31 8.630 8.957 -0.327 1 1 105 . 4 1 1 A 31 31 VAL HA H 31 4.430 4.802 -0.372 1 1 113 . 4 1 1 A 31 31 VAL C C 31 176.510 176.439 0.071 1 1 114 . 4 1 1 A 31 31 VAL CA C 31 62.360 63.092 -0.732 1 1 115 . 4 1 1 A 31 31 VAL CB C 31 32.370 32.009 0.361 1 1 118 . 4 1 1 A 31 31 VAL N N 31 127.110 126.124 0.986 1 1 119 . 4 1 1 A 32 32 THR H H 32 7.640 8.826 -1.186 1 1 120 . 4 1 1 A 32 32 THR HA H 32 4.870 3.960 0.910 1 1 125 . 4 1 1 A 32 32 THR C C 32 172.220 174.779 -2.559 1 1 126 . 4 1 1 A 32 32 THR CA C 32 59.510 64.556 -5.046 1 1 127 . 4 1 1 A 32 32 THR CB C 32 71.630 70.063 1.567 1 1 129 . 4 1 1 A 32 32 THR N N 32 118.860 121.365 -2.505 1 1 130 . 4 1 1 A 33 33 GLY H H 33 8.350 7.881 0.469 1 1 131 . 4 1 1 A 33 33 GLY HA2 H 33 4.160 4.030 0.130 1 1 132 . 4 1 1 A 33 33 GLY HA3 H 33 4.250 4.034 0.216 1 1 133 . 4 1 1 A 33 33 GLY C C 33 172.820 172.929 -0.109 1 1 134 . 4 1 1 A 33 33 GLY CA C 33 46.680 45.110 1.570 1 1 135 . 4 1 1 A 33 33 GLY N N 33 106.720 109.291 -2.571 1 1 136 . 4 1 1 A 34 34 SER H H 34 8.810 8.201 0.609 1 1 137 . 4 1 1 A 34 34 SER HA H 34 5.390 5.117 0.273 1 1 140 . 4 1 1 A 34 34 SER C C 34 173.780 172.948 0.832 1 1 141 . 4 1 1 A 34 34 SER CA C 34 57.380 57.273 0.107 1 1 142 . 4 1 1 A 34 34 SER CB C 34 65.730 66.112 -0.382 1 1 143 . 4 1 1 A 34 34 SER N N 34 112.690 119.716 -7.026 1 1 144 . 4 1 1 A 35 35 VAL H H 35 8.470 8.675 -0.205 1 1 145 . 4 1 1 A 35 35 VAL HA H 35 4.120 5.078 -0.958 1 1 153 . 4 1 1 A 35 35 VAL C C 35 174.750 174.638 0.112 1 1 154 . 4 1 1 A 35 35 VAL CA C 35 62.310 59.955 2.355 1 1 155 . 4 1 1 A 35 35 VAL CB C 35 34.550 33.878 0.672 1 1 158 . 4 1 1 A 35 35 VAL N N 35 123.150 119.945 3.205 1 1 159 . 4 1 1 A 36 36 SER H H 36 8.240 8.731 -0.491 1 1 160 . 4 1 1 A 36 36 SER HA H 36 4.690 5.232 -0.542 1 1 163 . 4 1 1 A 36 36 SER C C 36 171.860 173.965 -2.105 1 1 164 . 4 1 1 A 36 36 SER CA C 36 56.020 58.248 -2.228 1 1 165 . 4 1 1 A 36 36 SER CB C 36 66.050 63.588 2.462 1 1 166 . 4 1 1 A 36 36 SER N N 36 118.760 123.336 -4.576 1 1 167 . 4 1 1 A 37 37 LEU H H 37 8.310 8.880 -0.570 1 1 168 . 4 1 1 A 37 37 LEU HA H 37 4.870 4.764 0.106 1 1 178 . 4 1 1 A 37 37 LEU C C 37 174.190 175.800 -1.610 1 1 179 . 4 1 1 A 37 37 LEU CA C 37 53.870 53.731 0.139 1 1 180 . 4 1 1 A 37 37 LEU CB C 37 47.000 42.487 4.513 1 1 184 . 4 1 1 A 37 37 LEU N N 37 124.790 127.252 -2.462 1 1 185 . 4 1 1 A 38 38 GLU H H 38 9.270 8.863 0.407 1 1 186 . 4 1 1 A 38 38 GLU HA H 38 4.650 4.969 -0.319 1 1 191 . 4 1 1 A 38 38 GLU C C 38 173.970 175.201 -1.231 1 1 192 . 4 1 1 A 38 38 GLU CA C 38 54.410 55.848 -1.438 1 1 193 . 4 1 1 A 38 38 GLU CB C 38 32.460 32.073 0.387 1 1 195 . 4 1 1 A 38 38 GLU N N 38 126.550 126.705 -0.155 1 1 196 . 4 1 1 A 39 39 ALA H H 39 8.120 8.526 -0.406 1 1 197 . 4 1 1 A 39 39 ALA HA H 39 4.600 4.799 -0.199 1 1 201 . 4 1 1 A 39 39 ALA C C 39 175.930 177.497 -1.567 1 1 202 . 4 1 1 A 39 39 ALA CA C 39 51.570 51.022 0.548 1 1 203 . 4 1 1 A 39 39 ALA CB C 39 21.780 22.785 -1.005 1 1 204 . 4 1 1 A 39 39 ALA N N 39 124.410 128.777 -4.367 1 1 205 . 4 1 1 A 40 40 LEU H H 40 7.860 8.945 -1.085 1 1 206 . 4 1 1 A 40 40 LEU HA H 40 4.230 4.045 0.185 1 1 216 . 4 1 1 A 40 40 LEU C C 40 175.940 176.578 -0.638 1 1 217 . 4 1 1 A 40 40 LEU CA C 40 55.360 57.751 -2.391 1 1 218 . 4 1 1 A 40 40 LEU CB C 40 42.990 42.720 0.270 1 1 222 . 4 1 1 A 40 40 LEU N N 40 120.640 122.488 -1.848 1 1 223 . 4 1 1 A 41 41 GLU H H 41 8.210 7.879 0.331 1 1 224 . 4 1 1 A 41 41 GLU HA H 41 4.240 4.007 0.233 1 1 229 . 4 1 1 A 41 41 GLU C C 41 176.920 174.814 2.106 1 1 230 . 4 1 1 A 41 41 GLU CA C 41 58.090 57.726 0.364 1 1 231 . 4 1 1 A 41 41 GLU CB C 41 30.530 27.115 3.415 1 1 233 . 4 1 1 A 41 41 GLU N N 41 114.680 117.830 -3.150 1 1 234 . 4 1 1 A 42 42 GLU H H 42 7.490 7.736 -0.246 1 1 235 . 4 1 1 A 42 42 GLU HA H 42 5.680 4.771 0.909 1 1 240 . 4 1 1 A 42 42 GLU C C 42 173.790 174.174 -0.384 1 1 241 . 4 1 1 A 42 42 GLU CA C 42 54.360 56.102 -1.742 1 1 242 . 4 1 1 A 42 42 GLU CB C 42 33.850 33.409 0.441 1 1 244 . 4 1 1 A 42 42 GLU N N 42 116.670 118.232 -1.562 1 1 245 . 4 1 1 A 43 43 VAL H H 43 8.550 8.872 -0.322 1 1 246 . 4 1 1 A 43 43 VAL HA H 43 4.550 4.657 -0.107 1 1 254 . 4 1 1 A 43 43 VAL C C 43 172.220 173.740 -1.520 1 1 255 . 4 1 1 A 43 43 VAL CA C 43 59.470 60.516 -1.046 1 1 256 . 4 1 1 A 43 43 VAL CB C 43 35.470 34.742 0.728 1 1 259 . 4 1 1 A 43 43 VAL N N 43 120.030 125.067 -5.037 1 1 260 . 4 1 1 A 44 44 GLN H H 44 8.470 8.614 -0.144 1 1 261 . 4 1 1 A 44 44 GLN HA H 44 4.890 4.469 0.421 1 1 268 . 4 1 1 A 44 44 GLN C C 44 176.130 176.014 0.116 1 1 269 . 4 1 1 A 44 44 GLN CA C 44 54.360 55.839 -1.479 1 1 270 . 4 1 1 A 44 44 GLN CB C 44 30.610 28.959 1.651 1 1 272 . 4 1 1 A 44 44 GLN N N 44 124.690 130.153 -5.463 1 1 274 . 4 1 1 A 45 45 VAL H H 45 8.130 8.554 -0.424 1 1 275 . 4 1 1 A 45 45 VAL HA H 45 3.030 3.917 -0.887 1 1 283 . 4 1 1 A 45 45 VAL C C 45 176.710 177.186 -0.476 1 1 284 . 4 1 1 A 45 45 VAL CA C 45 65.810 64.755 1.055 1 1 285 . 4 1 1 A 45 45 VAL CB C 45 31.960 31.451 0.509 1 1 288 . 4 1 1 A 45 45 VAL N N 45 120.450 127.663 -7.213 1 1 289 . 4 1 1 A 46 46 GLY H H 46 8.950 9.983 -1.033 1 1 290 . 4 1 1 A 46 46 GLY HA2 H 46 3.590 4.008 -0.418 1 1 291 . 4 1 1 A 46 46 GLY HA3 H 46 4.410 4.010 0.400 1 1 292 . 4 1 1 A 46 46 GLY C C 46 174.390 173.960 0.430 1 1 293 . 4 1 1 A 46 46 GLY CA C 46 44.730 44.982 -0.252 1 1 294 . 4 1 1 A 46 46 GLY N N 46 116.490 115.244 1.246 1 1 295 . 4 1 1 A 47 47 GLU H H 47 8.260 7.838 0.422 1 1 296 . 4 1 1 A 47 47 GLU HA H 47 4.460 4.689 -0.229 1 1 301 . 4 1 1 A 47 47 GLU C C 47 174.780 175.260 -0.480 1 1 302 . 4 1 1 A 47 47 GLU CA C 47 54.830 55.215 -0.385 1 1 303 . 4 1 1 A 47 47 GLU CB C 47 31.140 31.688 -0.548 1 1 305 . 4 1 1 A 47 47 GLU N N 47 120.520 121.508 -0.988 1 1 306 . 4 1 1 A 48 48 ASN H H 48 8.440 8.783 -0.343 1 1 307 . 4 1 1 A 48 48 ASN HA H 48 5.380 5.455 -0.075 1 1 312 . 4 1 1 A 48 48 ASN C C 48 174.770 174.427 0.343 1 1 313 . 4 1 1 A 48 48 ASN CA C 48 51.570 51.801 -0.231 1 1 314 . 4 1 1 A 48 48 ASN CB C 48 39.010 41.395 -2.385 1 1 315 . 4 1 1 A 48 48 ASN N N 48 117.180 120.191 -3.011 1 1 317 . 4 1 1 A 49 49 LEU H H 49 9.810 8.576 1.234 1 1 318 . 4 1 1 A 49 49 LEU HA H 49 4.510 5.242 -0.732 1 1 328 . 4 1 1 A 49 49 LEU C C 49 174.560 174.962 -0.402 1 1 329 . 4 1 1 A 49 49 LEU CA C 49 53.460 53.514 -0.054 1 1 330 . 4 1 1 A 49 49 LEU CB C 49 45.520 46.321 -0.801 1 1 333 . 4 1 1 A 49 49 LEU N N 49 125.620 121.728 3.892 1 1 334 . 4 1 1 A 50 50 GLU H H 50 8.750 8.819 -0.069 1 1 335 . 4 1 1 A 50 50 GLU HA H 50 4.360 4.891 -0.531 1 1 340 . 4 1 1 A 50 50 GLU C C 50 175.340 174.480 0.860 1 1 341 . 4 1 1 A 50 50 GLU CA C 50 55.550 55.395 0.155 1 1 342 . 4 1 1 A 50 50 GLU CB C 50 29.890 30.959 -1.069 1 1 344 . 4 1 1 A 50 50 GLU N N 50 125.420 122.909 2.511 1 1 345 . 4 1 1 A 51 51 VAL H H 51 9.230 8.540 0.690 1 1 346 . 4 1 1 A 51 51 VAL HA H 51 4.190 4.781 -0.591 1 1 354 . 4 1 1 A 51 51 VAL C C 51 175.310 174.654 0.656 1 1 355 . 4 1 1 A 51 51 VAL CA C 51 62.520 61.033 1.487 1 1 356 . 4 1 1 A 51 51 VAL CB C 51 31.470 33.514 -2.044 1 1 359 . 4 1 1 A 51 51 VAL N N 51 129.810 125.448 4.362 1 1 360 . 4 1 1 A 52 52 GLY H H 52 9.410 9.048 0.362 1 1 361 . 4 1 1 A 52 52 GLY HA2 H 52 3.460 3.985 -0.525 1 1 362 . 4 1 1 A 52 52 GLY HA3 H 52 4.680 4.035 0.645 1 1 363 . 4 1 1 A 52 52 GLY C C 52 173.000 172.771 0.229 1 1 364 . 4 1 1 A 52 52 GLY CA C 52 46.470 46.714 -0.244 1 1 365 . 4 1 1 A 52 52 GLY N N 52 116.600 116.853 -0.253 1 1 366 . 4 1 1 A 53 53 VAL H H 53 9.130 8.344 0.786 1 1 367 . 4 1 1 A 53 53 VAL HA H 53 4.840 4.911 -0.071 1 1 375 . 4 1 1 A 53 53 VAL C C 53 175.470 175.205 0.265 1 1 376 . 4 1 1 A 53 53 VAL CA C 53 61.350 61.363 -0.013 1 1 377 . 4 1 1 A 53 53 VAL CB C 53 34.300 31.630 2.670 1 1 380 . 4 1 1 A 53 53 VAL N N 53 129.050 125.702 3.348 1 1 381 . 4 1 1 A 54 54 GLY H H 54 8.420 8.316 0.104 1 1 382 . 4 1 1 A 54 54 GLY HA2 H 54 3.850 3.599 0.251 1 1 383 . 4 1 1 A 54 54 GLY HA3 H 54 3.850 3.843 0.007 1 1 384 . 4 1 1 A 54 54 GLY C C 54 173.310 172.979 0.331 1 1 385 . 4 1 1 A 54 54 GLY CA C 54 45.180 44.462 0.718 1 1 386 . 4 1 1 A 54 54 GLY N N 54 116.890 115.446 1.444 1 1 387 . 4 1 1 A 55 55 ILE H H 55 10.190 8.270 1.920 1 1 388 . 4 1 1 A 55 55 ILE HA H 55 4.010 4.973 -0.963 1 1 398 . 4 1 1 A 55 55 ILE C C 55 174.380 174.819 -0.439 1 1 399 . 4 1 1 A 55 55 ILE CA C 55 61.350 59.978 1.372 1 1 400 . 4 1 1 A 55 55 ILE CB C 55 40.840 40.728 0.112 1 1 404 . 4 1 1 A 55 55 ILE N N 55 129.330 121.722 7.608 1 1 405 . 4 1 1 A 56 56 ASP H H 56 8.810 8.662 0.148 1 1 406 . 4 1 1 A 56 56 ASP HA H 56 4.440 5.248 -0.808 1 1 409 . 4 1 1 A 56 56 ASP C C 56 175.530 175.706 -0.176 1 1 410 . 4 1 1 A 56 56 ASP CA C 56 56.460 54.794 1.666 1 1 411 . 4 1 1 A 56 56 ASP CB C 56 42.720 42.821 -0.101 1 1 412 . 4 1 1 A 56 56 ASP N N 56 128.310 127.716 0.594 1 1 413 . 4 1 1 A 57 57 GLU H H 57 7.270 7.759 -0.489 1 1 414 . 4 1 1 A 57 57 GLU HA H 57 4.290 4.935 -0.645 1 1 419 . 4 1 1 A 57 57 GLU C C 57 173.370 174.653 -1.283 1 1 420 . 4 1 1 A 57 57 GLU CA C 57 54.840 55.564 -0.724 1 1 421 . 4 1 1 A 57 57 GLU CB C 57 33.190 33.817 -0.627 1 1 423 . 4 1 1 A 57 57 GLU N N 57 112.810 117.326 -4.516 1 1 424 . 4 1 1 A 58 58 LEU H H 58 8.370 8.507 -0.137 1 1 425 . 4 1 1 A 58 58 LEU HA H 58 4.830 4.696 0.134 1 1 434 . 4 1 1 A 58 58 LEU C C 58 174.180 174.493 -0.313 1 1 435 . 4 1 1 A 58 58 LEU CA C 58 55.320 55.045 0.275 1 1 436 . 4 1 1 A 58 58 LEU CB C 58 44.300 43.382 0.918 1 1 439 . 4 1 1 A 58 58 LEU N N 58 123.130 124.704 -1.574 1 1 440 . 4 1 1 A 59 59 VAL H H 59 9.120 8.744 0.376 1 1 441 . 4 1 1 A 59 59 VAL HA H 59 4.240 4.501 -0.261 1 1 449 . 4 1 1 A 59 59 VAL C C 59 174.960 175.621 -0.661 1 1 450 . 4 1 1 A 59 59 VAL CA C 59 61.760 59.902 1.858 1 1 451 . 4 1 1 A 59 59 VAL CB C 59 33.760 33.395 0.365 1 1 454 . 4 1 1 A 59 59 VAL N N 59 127.930 126.712 1.218 1 1 455 . 4 1 1 A 60 60 ASN H H 60 8.770 8.774 -0.004 1 1 456 . 4 1 1 A 60 60 ASN HA H 60 4.250 4.341 -0.091 1 1 461 . 4 1 1 A 60 60 ASN C C 60 172.810 173.867 -1.057 1 1 462 . 4 1 1 A 60 60 ASN CA C 60 54.830 54.486 0.344 1 1 463 . 4 1 1 A 60 60 ASN CB C 60 36.030 36.890 -0.860 1 1 464 . 4 1 1 A 60 60 ASN N N 60 115.500 122.892 -7.392 1 1 466 . 4 1 1 A 61 61 ALA H H 61 7.330 7.285 0.045 1 1 467 . 4 1 1 A 61 61 ALA HA H 61 4.520 4.606 -0.086 1 1 471 . 4 1 1 A 61 61 ALA C C 61 174.580 174.962 -0.382 1 1 472 . 4 1 1 A 61 61 ALA CA C 61 51.560 50.989 0.571 1 1 473 . 4 1 1 A 61 61 ALA CB C 61 22.870 22.456 0.414 1 1 474 . 4 1 1 A 61 61 ALA N N 61 115.640 118.771 -3.131 1 1 475 . 4 1 1 A 62 62 GLU H H 62 7.900 9.071 -1.171 1 1 476 . 4 1 1 A 62 62 GLU HA H 62 4.310 4.573 -0.263 1 1 481 . 4 1 1 A 62 62 GLU C C 62 173.790 175.074 -1.284 1 1 482 . 4 1 1 A 62 62 GLU CA C 62 55.080 54.910 0.170 1 1 483 . 4 1 1 A 62 62 GLU CB C 62 32.610 30.100 2.510 1 1 485 . 4 1 1 A 62 62 GLU N N 62 117.400 123.663 -6.263 1 1 486 . 4 1 1 A 63 63 ALA H H 63 8.910 8.655 0.255 1 1 487 . 4 1 1 A 63 63 ALA HA H 63 4.690 4.526 0.164 1 1 491 . 4 1 1 A 63 63 ALA C C 63 175.720 176.521 -0.801 1 1 492 . 4 1 1 A 63 63 ALA CA C 63 50.600 53.166 -2.566 1 1 493 . 4 1 1 A 63 63 ALA CB C 63 20.660 19.154 1.506 1 1 494 . 4 1 1 A 63 63 ALA N N 63 122.480 129.847 -7.367 1 1 495 . 4 1 1 A 64 64 PHE H H 64 9.220 9.066 0.154 1 1 496 . 4 1 1 A 64 64 PHE HA H 64 4.320 4.719 -0.399 1 1 501 . 4 1 1 A 64 64 PHE C C 64 174.380 176.349 -1.969 1 1 502 . 4 1 1 A 64 64 PHE CA C 64 59.770 58.788 0.982 1 1 503 . 4 1 1 A 64 64 PHE CB C 64 40.830 40.991 -0.161 1 1 504 . 4 1 1 A 64 64 PHE N N 64 120.870 123.588 -2.718 1 1 505 . 4 1 1 A 65 65 ALA H H 65 8.150 7.911 0.239 1 1 506 . 4 1 1 A 65 65 ALA HA H 65 5.280 4.870 0.410 1 1 510 . 4 1 1 A 65 65 ALA C C 65 175.950 175.716 0.234 1 1 511 . 4 1 1 A 65 65 ALA CA C 65 51.120 51.074 0.046 1 1 512 . 4 1 1 A 65 65 ALA CB C 65 22.850 21.566 1.284 1 1 513 . 4 1 1 A 65 65 ALA N N 65 122.350 120.220 2.130 1 1 514 . 4 1 1 A 66 66 TYR H H 66 9.260 9.293 -0.033 1 1 515 . 4 1 1 A 66 66 TYR HA H 66 5.710 5.051 0.659 1 1 520 . 4 1 1 A 66 66 TYR C C 66 175.690 174.524 1.166 1 1 521 . 4 1 1 A 66 66 TYR CA C 66 54.390 58.452 -4.062 1 1 522 . 4 1 1 A 66 66 TYR CB C 66 41.560 40.048 1.512 1 1 523 . 4 1 1 A 66 66 TYR N N 66 124.350 126.660 -2.310 1 1 524 . 4 1 1 A 67 67 ASP H H 67 9.070 8.451 0.619 1 1 525 . 4 1 1 A 67 67 ASP HA H 67 5.630 5.507 0.123 1 1 528 . 4 1 1 A 67 67 ASP C C 67 174.300 174.427 -0.127 1 1 529 . 4 1 1 A 67 67 ASP CA C 67 51.590 53.261 -1.671 1 1 530 . 4 1 1 A 67 67 ASP CB C 67 44.380 43.431 0.949 1 1 531 . 4 1 1 A 67 67 ASP N N 67 130.490 126.062 4.428 1 1 532 . 4 1 1 A 68 68 PHE H H 68 8.670 8.335 0.335 1 1 533 . 4 1 1 A 68 68 PHE HA H 68 4.890 5.391 -0.501 1 1 538 . 4 1 1 A 68 68 PHE C C 68 172.220 172.971 -0.751 1 1 539 . 4 1 1 A 68 68 PHE CA C 68 57.360 55.409 1.951 1 1 540 . 4 1 1 A 68 68 PHE CB C 68 40.360 41.847 -1.487 1 1 541 . 4 1 1 A 68 68 PHE N N 68 118.200 119.989 -1.789 1 1 542 . 4 1 1 A 69 69 THR H H 69 8.390 8.583 -0.193 1 1 543 . 4 1 1 A 69 69 THR HA H 69 5.170 5.323 -0.153 1 1 548 . 4 1 1 A 69 69 THR C C 69 172.620 173.869 -1.249 1 1 549 . 4 1 1 A 69 69 THR CA C 69 61.370 61.453 -0.083 1 1 550 . 4 1 1 A 69 69 THR CB C 69 64.880 71.509 -6.629 1 1 552 . 4 1 1 A 69 69 THR N N 69 115.810 114.470 1.340 1 1 553 . 4 1 1 A 70 70 LEU H H 70 9.560 8.787 0.773 1 1 554 . 4 1 1 A 70 70 LEU HA H 70 5.270 4.470 0.800 1 1 564 . 4 1 1 A 70 70 LEU C C 70 173.800 175.889 -2.089 1 1 565 . 4 1 1 A 70 70 LEU CA C 70 53.460 55.174 -1.714 1 1 566 . 4 1 1 A 70 70 LEU CB C 70 45.040 42.975 2.065 1 1 570 . 4 1 1 A 70 70 LEU N N 70 129.220 129.865 -0.645 1 1 571 . 4 1 1 A 71 71 ASN H H 71 9.590 8.641 0.949 1 1 572 . 4 1 1 A 71 71 ASN HA H 71 5.880 5.678 0.202 1 1 577 . 4 1 1 A 71 71 ASN C C 71 177.970 174.010 3.960 1 1 578 . 4 1 1 A 71 71 ASN CA C 71 52.060 52.058 0.002 1 1 579 . 4 1 1 A 71 71 ASN CB C 71 41.020 40.596 0.424 1 1 580 . 4 1 1 A 71 71 ASN N N 71 125.970 119.157 6.813 1 1 582 . 4 1 1 A 72 72 TYR H H 72 8.740 9.163 -0.423 1 1 583 . 4 1 1 A 72 72 TYR HA H 72 5.110 5.292 -0.182 1 1 588 . 4 1 1 A 72 72 TYR C C 72 177.720 173.926 3.794 1 1 589 . 4 1 1 A 72 72 TYR CA C 72 55.310 55.274 0.036 1 1 590 . 4 1 1 A 72 72 TYR CB C 72 41.510 41.409 0.101 1 1 591 . 4 1 1 A 72 72 TYR N N 72 119.640 120.682 -1.042 1 1 592 . 4 1 1 A 73 73 ASP H H 73 9.780 8.960 0.820 1 1 593 . 4 1 1 A 73 73 ASP HA H 73 4.680 5.168 -0.488 1 1 596 . 4 1 1 A 73 73 ASP C C 73 177.290 176.906 0.384 1 1 597 . 4 1 1 A 73 73 ASP CA C 73 53.650 53.330 0.320 1 1 598 . 4 1 1 A 73 73 ASP CB C 73 40.900 43.355 -2.455 1 1 599 . 4 1 1 A 73 73 ASP N N 73 119.290 119.284 0.006 1 1 600 . 4 1 1 A 74 74 GLU H H 74 9.430 8.421 1.009 1 1 601 . 4 1 1 A 74 74 GLU HA H 74 4.740 4.610 0.130 1 1 606 . 4 1 1 A 74 74 GLU C C 74 176.320 176.208 0.112 1 1 607 . 4 1 1 A 74 74 GLU CA C 74 57.410 55.793 1.617 1 1 608 . 4 1 1 A 74 74 GLU CB C 74 29.490 29.513 -0.023 1 1 610 . 4 1 1 A 74 74 GLU N N 74 130.930 118.397 12.533 1 1 611 . 4 1 1 A 75 75 ASN H H 75 8.680 8.038 0.642 1 1 612 . 4 1 1 A 75 75 ASN HA H 75 4.600 4.874 -0.274 1 1 617 . 4 1 1 A 75 75 ASN C C 75 175.340 176.189 -0.849 1 1 618 . 4 1 1 A 75 75 ASN CA C 75 54.620 54.036 0.584 1 1 619 . 4 1 1 A 75 75 ASN CB C 75 38.770 39.900 -1.130 1 1 620 . 4 1 1 A 75 75 ASN N N 75 115.040 117.718 -2.678 1 1 622 . 4 1 1 A 76 76 ALA H H 76 7.740 8.081 -0.341 1 1 623 . 4 1 1 A 76 76 ALA HA H 76 4.310 4.468 -0.158 1 1 627 . 4 1 1 A 76 76 ALA C C 76 175.550 176.923 -1.373 1 1 628 . 4 1 1 A 76 76 ALA CA C 76 53.260 53.223 0.037 1 1 629 . 4 1 1 A 76 76 ALA CB C 76 21.450 20.727 0.723 1 1 630 . 4 1 1 A 76 76 ALA N N 76 122.200 120.356 1.844 1 1 631 . 4 1 1 A 77 77 PHE H H 77 8.070 7.985 0.085 1 1 632 . 4 1 1 A 77 77 PHE HA H 77 5.650 4.941 0.709 1 1 637 . 4 1 1 A 77 77 PHE C C 77 174.570 175.358 -0.788 1 1 638 . 4 1 1 A 77 77 PHE CA C 77 56.360 57.483 -1.123 1 1 639 . 4 1 1 A 77 77 PHE CB C 77 46.080 40.824 5.256 1 1 640 . 4 1 1 A 77 77 PHE N N 77 114.160 114.202 -0.042 1 1 641 . 4 1 1 A 78 78 GLU H H 78 8.800 8.950 -0.150 1 1 642 . 4 1 1 A 78 78 GLU HA H 78 4.900 5.000 -0.100 1 1 647 . 4 1 1 A 78 78 GLU C C 78 175.950 174.689 1.261 1 1 648 . 4 1 1 A 78 78 GLU CA C 78 53.670 56.446 -2.776 1 1 649 . 4 1 1 A 78 78 GLU CB C 78 33.600 32.488 1.112 1 1 651 . 4 1 1 A 78 78 GLU N N 78 117.590 120.779 -3.189 1 1 652 . 4 1 1 A 79 79 TYR H H 79 8.770 9.600 -0.830 1 1 653 . 4 1 1 A 79 79 TYR HA H 79 4.250 4.263 -0.013 1 1 658 . 4 1 1 A 79 79 TYR C C 79 174.580 174.965 -0.385 1 1 659 . 4 1 1 A 79 79 TYR CA C 79 59.250 59.572 -0.322 1 1 660 . 4 1 1 A 79 79 TYR CB C 79 38.310 39.338 -1.028 1 1 661 . 4 1 1 A 79 79 TYR N N 79 126.560 129.308 -2.748 1 1 662 . 4 1 1 A 80 80 VAL H H 80 8.220 8.163 0.057 1 1 663 . 4 1 1 A 80 80 VAL HA H 80 3.690 3.945 -0.255 1 1 671 . 4 1 1 A 80 80 VAL C C 80 174.780 174.811 -0.031 1 1 672 . 4 1 1 A 80 80 VAL CA C 80 64.400 62.844 1.556 1 1 673 . 4 1 1 A 80 80 VAL CB C 80 33.510 33.224 0.286 1 1 676 . 4 1 1 A 80 80 VAL N N 80 129.460 124.415 5.045 1 1 677 . 4 1 1 A 81 81 GLU H H 81 6.920 7.447 -0.527 1 1 678 . 4 1 1 A 81 81 GLU HA H 81 4.260 4.626 -0.366 1 1 683 . 4 1 1 A 81 81 GLU C C 81 171.840 175.442 -3.602 1 1 684 . 4 1 1 A 81 81 GLU CA C 81 55.310 55.049 0.261 1 1 685 . 4 1 1 A 81 81 GLU CB C 81 30.520 33.322 -2.802 1 1 687 . 4 1 1 A 81 81 GLU N N 81 112.430 117.399 -4.969 1 1 688 . 4 1 1 A 82 82 ALA H H 82 8.310 8.634 -0.324 1 1 689 . 4 1 1 A 82 82 ALA HA H 82 5.650 4.703 0.947 1 1 693 . 4 1 1 A 82 82 ALA C C 82 176.110 177.070 -0.960 1 1 694 . 4 1 1 A 82 82 ALA CA C 82 50.620 51.995 -1.375 1 1 695 . 4 1 1 A 82 82 ALA CB C 82 21.770 20.167 1.603 1 1 696 . 4 1 1 A 82 82 ALA N N 82 121.240 125.377 -4.137 1 1 697 . 4 1 1 A 83 83 ILE H H 83 9.150 9.555 -0.405 1 1 698 . 4 1 1 A 83 83 ILE HA H 83 4.600 4.930 -0.330 1 1 708 . 4 1 1 A 83 83 ILE C C 83 174.810 175.128 -0.318 1 1 709 . 4 1 1 A 83 83 ILE CA C 83 60.060 59.287 0.773 1 1 710 . 4 1 1 A 83 83 ILE CB C 83 42.440 42.223 0.217 1 1 714 . 4 1 1 A 83 83 ILE N N 83 119.720 118.997 0.723 1 1 715 . 4 1 1 A 84 84 SER H H 84 8.350 9.025 -0.675 1 1 716 . 4 1 1 A 84 84 SER HA H 84 4.660 4.932 -0.272 1 1 719 . 4 1 1 A 84 84 SER C C 84 177.550 172.965 4.585 1 1 720 . 4 1 1 A 84 84 SER CA C 84 57.330 55.560 1.770 1 1 721 . 4 1 1 A 84 84 SER CB C 84 66.490 65.385 1.105 1 1 722 . 4 1 1 A 84 84 SER N N 84 116.740 120.228 -3.488 1 1 723 . 4 1 1 A 85 85 ASP H H 85 8.740 8.371 0.369 1 1 724 . 4 1 1 A 85 85 ASP HA H 85 4.820 4.846 -0.026 1 1 727 . 4 1 1 A 85 85 ASP C C 85 176.090 176.424 -0.334 1 1 728 . 4 1 1 A 85 85 ASP CA C 85 53.480 51.960 1.520 1 1 729 . 4 1 1 A 85 85 ASP CB C 85 42.480 41.484 0.996 1 1 730 . 4 1 1 A 85 85 ASP N N 85 120.960 120.366 0.594 1 1 731 . 4 1 1 A 86 86 ASP H H 86 8.380 8.696 -0.316 1 1 732 . 4 1 1 A 86 86 ASP HA H 86 4.450 4.852 -0.402 1 1 735 . 4 1 1 A 86 86 ASP C C 86 177.100 176.787 0.313 1 1 736 . 4 1 1 A 86 86 ASP CA C 86 56.240 54.096 2.144 1 1 737 . 4 1 1 A 86 86 ASP CB C 86 41.100 41.312 -0.212 1 1 738 . 4 1 1 A 86 86 ASP N N 86 117.710 117.052 0.658 1 1 739 . 4 1 1 A 87 87 GLY H H 87 8.690 7.531 1.159 1 1 740 . 4 1 1 A 87 87 GLY HA2 H 87 3.870 4.083 -0.213 1 1 741 . 4 1 1 A 87 87 GLY HA3 H 87 4.090 4.088 0.002 1 1 742 . 4 1 1 A 87 87 GLY C C 87 173.800 174.200 -0.400 1 1 743 . 4 1 1 A 87 87 GLY CA C 87 45.770 45.719 0.051 1 1 744 . 4 1 1 A 87 87 GLY N N 87 108.540 107.424 1.116 1 1 745 . 4 1 1 A 88 88 VAL H H 88 7.910 8.238 -0.328 1 1 746 . 4 1 1 A 88 88 VAL HA H 88 4.780 4.225 0.555 1 1 754 . 4 1 1 A 88 88 VAL C C 88 173.970 175.291 -1.321 1 1 755 . 4 1 1 A 88 88 VAL CA C 88 60.900 62.212 -1.312 1 1 756 . 4 1 1 A 88 88 VAL CB C 88 35.460 32.802 2.658 1 1 759 . 4 1 1 A 88 88 VAL N N 88 119.790 120.462 -0.672 1 1 760 . 4 1 1 A 89 89 PHE H H 89 9.210 9.541 -0.331 1 1 761 . 4 1 1 A 89 89 PHE HA H 89 4.930 5.384 -0.454 1 1 766 . 4 1 1 A 89 89 PHE C C 89 173.970 173.804 0.166 1 1 767 . 4 1 1 A 89 89 PHE CA C 89 56.450 55.348 1.102 1 1 768 . 4 1 1 A 89 89 PHE CB C 89 41.120 41.816 -0.696 1 1 769 . 4 1 1 A 89 89 PHE N N 89 126.780 126.444 0.336 1 1 770 . 4 1 1 A 90 90 VAL H H 90 7.880 8.826 -0.946 1 1 771 . 4 1 1 A 90 90 VAL HA H 90 4.860 4.947 -0.087 1 1 779 . 4 1 1 A 90 90 VAL C C 90 173.190 175.208 -2.018 1 1 780 . 4 1 1 A 90 90 VAL CA C 90 59.750 61.098 -1.348 1 1 781 . 4 1 1 A 90 90 VAL CB C 90 34.770 34.064 0.706 1 1 784 . 4 1 1 A 90 90 VAL N N 90 124.990 127.229 -2.239 1 1 785 . 4 1 1 A 91 91 ASN H H 91 8.670 8.507 0.163 1 1 786 . 4 1 1 A 91 91 ASN HA H 91 4.730 5.279 -0.549 1 1 791 . 4 1 1 A 91 91 ASN C C 91 173.200 174.216 -1.016 1 1 792 . 4 1 1 A 91 91 ASN CA C 91 51.970 53.495 -1.525 1 1 793 . 4 1 1 A 91 91 ASN CB C 91 41.340 40.744 0.596 1 1 794 . 4 1 1 A 91 91 ASN N N 91 124.860 124.717 0.143 1 1 796 . 4 1 1 A 92 92 ALA H H 92 8.840 9.178 -0.338 1 1 797 . 4 1 1 A 92 92 ALA HA H 92 5.290 4.639 0.651 1 1 801 . 4 1 1 A 92 92 ALA C C 92 176.330 176.555 -0.225 1 1 802 . 4 1 1 A 92 92 ALA CA C 92 50.170 51.260 -1.090 1 1 803 . 4 1 1 A 92 92 ALA CB C 92 23.610 21.244 2.366 1 1 804 . 4 1 1 A 92 92 ALA N N 92 128.510 129.215 -0.705 1 1 805 . 4 1 1 A 93 93 LYS H H 93 8.670 8.884 -0.214 1 1 806 . 4 1 1 A 93 93 LYS HA H 93 4.460 4.710 -0.250 1 1 815 . 4 1 1 A 93 93 LYS C C 93 174.170 174.750 -0.580 1 1 816 . 4 1 1 A 93 93 LYS CA C 93 55.010 55.710 -0.700 1 1 817 . 4 1 1 A 93 93 LYS CB C 93 36.430 35.563 0.867 1 1 821 . 4 1 1 A 93 93 LYS N N 93 121.300 118.127 3.173 1 1 822 . 4 1 1 A 94 94 LYS H H 94 8.960 8.774 0.186 1 1 823 . 4 1 1 A 94 94 LYS HA H 94 4.460 4.199 0.261 1 1 832 . 4 1 1 A 94 94 LYS C C 94 176.330 176.892 -0.562 1 1 833 . 4 1 1 A 94 94 LYS CA C 94 56.720 56.703 0.017 1 1 834 . 4 1 1 A 94 94 LYS CB C 94 31.930 32.751 -0.821 1 1 837 . 4 1 1 A 94 94 LYS N N 94 127.060 127.235 -0.175 1 1 838 . 4 1 1 A 95 95 ILE H H 95 8.290 8.586 -0.296 1 1 839 . 4 1 1 A 95 95 ILE HA H 95 4.120 4.058 0.062 1 1 849 . 4 1 1 A 95 95 ILE C C 95 175.740 175.183 0.557 1 1 850 . 4 1 1 A 95 95 ILE CA C 95 62.760 62.715 0.045 1 1 851 . 4 1 1 A 95 95 ILE CB C 95 38.890 39.182 -0.292 1 1 855 . 4 1 1 A 95 95 ILE N N 95 126.530 128.006 -1.476 1 1 856 . 4 1 1 A 96 96 GLU H H 96 8.030 7.378 0.652 1 1 857 . 4 1 1 A 96 96 GLU HA H 96 4.450 4.673 -0.223 1 1 862 . 4 1 1 A 96 96 GLU C C 96 174.380 174.707 -0.327 1 1 863 . 4 1 1 A 96 96 GLU CA C 96 54.320 55.023 -0.703 1 1 864 . 4 1 1 A 96 96 GLU CB C 96 32.770 33.630 -0.860 1 1 866 . 4 1 1 A 96 96 GLU N N 96 117.080 118.926 -1.846 1 1 867 . 4 1 1 A 97 97 ASP H H 97 8.730 8.803 -0.073 1 1 868 . 4 1 1 A 97 97 ASP HA H 97 4.360 4.419 -0.059 1 1 871 . 4 1 1 A 97 97 ASP C C 97 177.100 177.347 -0.247 1 1 872 . 4 1 1 A 97 97 ASP CA C 97 57.160 55.690 1.470 1 1 873 . 4 1 1 A 97 97 ASP CB C 97 39.920 40.399 -0.479 1 1 874 . 4 1 1 A 97 97 ASP N N 97 120.570 120.687 -0.117 1 1 875 . 4 1 1 A 98 98 GLY H H 98 8.760 8.548 0.212 1 1 876 . 4 1 1 A 98 98 GLY HA2 H 98 2.120 1.340 0.780 1 1 877 . 4 1 1 A 98 98 GLY HA3 H 98 3.910 3.333 0.577 1 1 878 . 4 1 1 A 98 98 GLY C C 98 174.000 172.916 1.084 1 1 879 . 4 1 1 A 98 98 GLY CA C 98 45.720 45.282 0.438 1 1 880 . 4 1 1 A 98 98 GLY N N 98 112.090 111.832 0.258 1 1 881 . 4 1 1 A 99 99 LYS H H 99 7.890 7.234 0.656 1 1 882 . 4 1 1 A 99 99 LYS HA H 99 5.330 5.170 0.160 1 1 891 . 4 1 1 A 99 99 LYS C C 99 174.750 174.384 0.366 1 1 892 . 4 1 1 A 99 99 LYS CA C 99 55.990 54.872 1.118 1 1 893 . 4 1 1 A 99 99 LYS CB C 99 37.840 35.438 2.402 1 1 897 . 4 1 1 A 99 99 LYS N N 99 118.050 114.863 3.187 1 1 898 . 4 1 1 A 100 100 VAL H H 100 8.980 8.542 0.438 1 1 899 . 4 1 1 A 100 100 VAL HA H 100 4.510 4.774 -0.264 1 1 907 . 4 1 1 A 100 100 VAL C C 100 174.760 173.644 1.116 1 1 908 . 4 1 1 A 100 100 VAL CA C 100 60.130 59.009 1.121 1 1 909 . 4 1 1 A 100 100 VAL CB C 100 35.240 35.834 -0.594 1 1 912 . 4 1 1 A 100 100 VAL N N 100 123.850 119.784 4.066 1 1 913 . 4 1 1 A 101 101 ARG H H 101 8.810 8.236 0.574 1 1 914 . 4 1 1 A 101 101 ARG HA H 101 4.850 5.248 -0.398 1 1 921 . 4 1 1 A 101 101 ARG C C 101 174.770 174.145 0.625 1 1 922 . 4 1 1 A 101 101 ARG CA C 101 54.580 54.553 0.027 1 1 923 . 4 1 1 A 101 101 ARG CB C 101 32.400 32.397 0.003 1 1 926 . 4 1 1 A 101 101 ARG N N 101 129.210 122.803 6.407 1 1 927 . 4 1 1 A 102 102 VAL H H 102 9.100 8.920 0.180 1 1 928 . 4 1 1 A 102 102 VAL HA H 102 4.120 4.954 -0.834 1 1 936 . 4 1 1 A 102 102 VAL C C 102 171.640 173.988 -2.348 1 1 937 . 4 1 1 A 102 102 VAL CA C 102 61.350 59.165 2.185 1 1 938 . 4 1 1 A 102 102 VAL CB C 102 32.530 34.472 -1.942 1 1 941 . 4 1 1 A 102 102 VAL N N 102 130.470 123.559 6.911 1 1 942 . 4 1 1 A 103 103 LEU H H 103 8.110 8.819 -0.709 1 1 943 . 4 1 1 A 103 103 LEU HA H 103 5.120 5.069 0.051 1 1 953 . 4 1 1 A 103 103 LEU C C 103 176.410 175.094 1.316 1 1 954 . 4 1 1 A 103 103 LEU CA C 103 53.380 54.025 -0.645 1 1 955 . 4 1 1 A 103 103 LEU CB C 103 43.680 43.640 0.040 1 1 959 . 4 1 1 A 103 103 LEU N N 103 125.560 128.167 -2.607 1 1 960 . 4 1 1 A 104 104 VAL H H 104 9.580 8.931 0.649 1 1 961 . 4 1 1 A 104 104 VAL HA H 104 5.260 5.397 -0.137 1 1 969 . 4 1 1 A 104 104 VAL C C 104 176.030 174.210 1.820 1 1 970 . 4 1 1 A 104 104 VAL CA C 104 60.220 59.953 0.267 1 1 971 . 4 1 1 A 104 104 VAL CB C 104 34.310 34.876 -0.566 1 1 974 . 4 1 1 A 104 104 VAL N N 104 125.790 125.674 0.116 1 1 975 . 4 1 1 A 105 105 SER H H 105 9.340 9.025 0.315 1 1 976 . 4 1 1 A 105 105 SER HA H 105 5.300 5.090 0.210 1 1 979 . 4 1 1 A 105 105 SER C C 105 173.600 173.185 0.415 1 1 980 . 4 1 1 A 105 105 SER CA C 105 57.450 57.327 0.123 1 1 981 . 4 1 1 A 105 105 SER CB C 105 65.600 66.875 -1.275 1 1 982 . 4 1 1 A 105 105 SER N N 105 119.220 120.988 -1.768 1 1 983 . 4 1 1 A 106 106 SER H H 106 8.350 9.124 -0.774 1 1 984 . 4 1 1 A 106 106 SER HA H 106 4.720 4.435 0.285 1 1 987 . 4 1 1 A 106 106 SER C C 106 176.930 174.128 2.802 1 1 988 . 4 1 1 A 106 106 SER CA C 106 58.170 58.963 -0.793 1 1 989 . 4 1 1 A 106 106 SER CB C 106 64.170 62.777 1.393 1 1 990 . 4 1 1 A 106 106 SER N N 106 114.800 120.017 -5.217 1 1 991 . 4 1 1 A 107 107 LEU H H 107 8.770 8.849 -0.079 1 1 992 . 4 1 1 A 107 107 LEU HA H 107 4.710 4.218 0.492 1 1 1001 . 4 1 1 A 107 107 LEU C C 107 178.280 179.119 -0.839 1 1 1002 . 4 1 1 A 107 107 LEU CA C 107 55.280 57.096 -1.816 1 1 1003 . 4 1 1 A 107 107 LEU CB C 107 43.410 41.804 1.606 1 1 1007 . 4 1 1 A 107 107 LEU N N 107 127.210 127.542 -0.332 1 1 1008 . 4 1 1 A 108 108 THR H H 108 8.210 7.824 0.386 1 1 1009 . 4 1 1 A 108 108 THR HA H 108 4.400 4.295 0.105 1 1 1015 . 4 1 1 A 108 108 THR C C 108 176.130 175.713 0.417 1 1 1016 . 4 1 1 A 108 108 THR CA C 108 62.050 63.353 -1.303 1 1 1017 . 4 1 1 A 108 108 THR CB C 108 70.910 70.309 0.601 1 1 1019 . 4 1 1 A 108 108 THR N N 108 108.810 111.042 -2.232 1 1 1020 . 4 1 1 A 109 109 GLY H H 109 8.250 7.685 0.565 1 1 1021 . 4 1 1 A 109 109 GLY HA2 H 109 3.780 4.068 -0.288 1 1 1022 . 4 1 1 A 109 109 GLY HA3 H 109 4.290 4.082 0.208 1 1 1023 . 4 1 1 A 109 109 GLY C C 109 173.180 174.433 -1.253 1 1 1024 . 4 1 1 A 109 109 GLY CA C 109 45.340 45.134 0.206 1 1 1025 . 4 1 1 A 109 109 GLY N N 109 110.160 110.927 -0.767 1 1 1026 . 4 1 1 A 110 110 GLU H H 110 7.960 7.630 0.330 1 1 1027 . 4 1 1 A 110 110 GLU HA H 110 4.760 4.552 0.208 1 1 1032 . 4 1 1 A 110 110 GLU CA C 110 53.450 54.417 -0.967 1 1 1033 . 4 1 1 A 110 110 GLU CB C 110 30.020 30.413 -0.393 1 1 1035 . 4 1 1 A 110 110 GLU N N 110 119.720 120.329 -0.609 1 1 1036 . 4 1 1 A 111 111 PRO HA H 111 3.250 3.999 -0.749 1 1 1043 . 4 1 1 A 111 111 PRO C C 111 176.710 176.472 0.238 1 1 1044 . 4 1 1 A 111 111 PRO CA C 111 62.240 62.559 -0.319 1 1 1045 . 4 1 1 A 111 111 PRO CB C 111 31.990 31.115 0.875 1 1 1048 . 4 1 1 A 112 112 LEU H H 112 8.840 8.129 0.711 1 1 1049 . 4 1 1 A 112 112 LEU HA H 112 4.290 4.239 0.051 1 1 1059 . 4 1 1 A 112 112 LEU CA C 112 52.220 53.721 -1.501 1 1 1060 . 4 1 1 A 112 112 LEU CB C 112 41.090 42.206 -1.116 1 1 1063 . 4 1 1 A 112 112 LEU N N 112 122.420 123.717 -1.297 1 1 1064 . 4 1 1 A 113 113 PRO HA H 113 4.380 4.444 -0.064 1 1 1071 . 4 1 1 A 113 113 PRO C C 113 176.100 176.121 -0.021 1 1 1072 . 4 1 1 A 113 113 PRO CA C 113 61.930 62.506 -0.576 1 1 1073 . 4 1 1 A 113 113 PRO CB C 113 32.470 31.882 0.588 1 1 1076 . 4 1 1 A 114 114 ALA H H 114 8.070 8.168 -0.098 1 1 1077 . 4 1 1 A 114 114 ALA HA H 114 4.550 4.450 0.100 1 1 1081 . 4 1 1 A 114 114 ALA C C 114 177.490 176.967 0.523 1 1 1082 . 4 1 1 A 114 114 ALA CA C 114 51.340 51.059 0.281 1 1 1083 . 4 1 1 A 114 114 ALA CB C 114 19.940 20.885 -0.945 1 1 1084 . 4 1 1 A 114 114 ALA N N 114 121.460 123.762 -2.302 1 1 1085 . 4 1 1 A 115 115 LYS H H 115 9.000 8.464 0.536 1 1 1086 . 4 1 1 A 115 115 LYS HA H 115 3.930 3.889 0.041 1 1 1095 . 4 1 1 A 115 115 LYS C C 115 175.740 175.355 0.385 1 1 1096 . 4 1 1 A 115 115 LYS CA C 115 57.580 57.427 0.153 1 1 1097 . 4 1 1 A 115 115 LYS CB C 115 29.510 30.262 -0.752 1 1 1101 . 4 1 1 A 115 115 LYS N N 115 112.560 115.438 -2.878 1 1 1102 . 4 1 1 A 116 116 GLU H H 116 7.620 7.645 -0.025 1 1 1103 . 4 1 1 A 116 116 GLU HA H 116 4.550 4.924 -0.374 1 1 1108 . 4 1 1 A 116 116 GLU C C 116 176.110 175.190 0.920 1 1 1109 . 4 1 1 A 116 116 GLU CA C 116 54.570 54.282 0.288 1 1 1110 . 4 1 1 A 116 116 GLU CB C 116 33.680 33.386 0.294 1 1 1112 . 4 1 1 A 116 116 GLU N N 116 115.710 117.481 -1.771 1 1 1113 . 4 1 1 A 117 117 VAL H H 117 8.770 8.842 -0.072 1 1 1114 . 4 1 1 A 117 117 VAL HA H 117 3.200 4.061 -0.861 1 1 1122 . 4 1 1 A 117 117 VAL C C 117 175.740 175.582 0.158 1 1 1123 . 4 1 1 A 117 117 VAL CA C 117 65.340 62.981 2.359 1 1 1124 . 4 1 1 A 117 117 VAL CB C 117 31.290 31.031 0.259 1 1 1127 . 4 1 1 A 117 117 VAL N N 117 124.450 120.461 3.989 1 1 1128 . 4 1 1 A 118 118 LEU H H 118 8.550 8.868 -0.318 1 1 1129 . 4 1 1 A 118 118 LEU HA H 118 4.540 4.327 0.213 1 1 1139 . 4 1 1 A 118 118 LEU C C 118 176.210 176.753 -0.543 1 1 1140 . 4 1 1 A 118 118 LEU CA C 118 55.510 55.802 -0.292 1 1 1141 . 4 1 1 A 118 118 LEU CB C 118 44.600 42.226 2.374 1 1 1145 . 4 1 1 A 118 118 LEU N N 118 128.440 128.848 -0.408 1 1 1146 . 4 1 1 A 119 119 ALA H H 119 7.970 7.485 0.485 1 1 1147 . 4 1 1 A 119 119 ALA HA H 119 4.740 4.787 -0.047 1 1 1151 . 4 1 1 A 119 119 ALA C C 119 174.570 175.396 -0.826 1 1 1152 . 4 1 1 A 119 119 ALA CA C 119 50.770 51.791 -1.021 1 1 1153 . 4 1 1 A 119 119 ALA CB C 119 22.450 22.103 0.347 1 1 1154 . 4 1 1 A 119 119 ALA N N 119 118.100 116.908 1.192 1 1 1155 . 4 1 1 A 120 120 LYS H H 120 8.760 9.164 -0.404 1 1 1156 . 4 1 1 A 120 120 LYS HA H 120 5.240 5.793 -0.553 1 1 1165 . 4 1 1 A 120 120 LYS C C 120 175.340 174.513 0.827 1 1 1166 . 4 1 1 A 120 120 LYS CA C 120 54.220 54.330 -0.110 1 1 1167 . 4 1 1 A 120 120 LYS CB C 120 34.340 36.588 -2.248 1 1 1171 . 4 1 1 A 120 120 LYS N N 120 120.010 120.378 -0.368 1 1 1172 . 4 1 1 A 121 121 VAL H H 121 9.410 8.930 0.480 1 1 1173 . 4 1 1 A 121 121 VAL HA H 121 4.230 4.986 -0.756 1 1 1181 . 4 1 1 A 121 121 VAL C C 121 173.980 173.755 0.225 1 1 1182 . 4 1 1 A 121 121 VAL CA C 121 62.370 59.685 2.685 1 1 1183 . 4 1 1 A 121 121 VAL CB C 121 32.410 36.137 -3.727 1 1 1186 . 4 1 1 A 121 121 VAL N N 121 124.960 119.475 5.485 1 1 1187 . 4 1 1 A 122 122 VAL H H 122 9.280 8.624 0.656 1 1 1188 . 4 1 1 A 122 122 VAL HA H 122 4.360 5.274 -0.914 1 1 1196 . 4 1 1 A 122 122 VAL C C 122 174.190 174.349 -0.159 1 1 1197 . 4 1 1 A 122 122 VAL CA C 122 62.760 60.738 2.022 1 1 1198 . 4 1 1 A 122 122 VAL CB C 122 32.020 33.381 -1.361 1 1 1201 . 4 1 1 A 122 122 VAL N N 122 128.990 123.912 5.078 1 1 1202 . 4 1 1 A 123 123 LEU H H 123 8.610 8.887 -0.277 1 1 1203 . 4 1 1 A 123 123 LEU HA H 123 4.900 4.644 0.256 1 1 1213 . 4 1 1 A 123 123 LEU C C 123 174.950 176.413 -1.463 1 1 1214 . 4 1 1 A 123 123 LEU CA C 123 52.050 53.883 -1.833 1 1 1215 . 4 1 1 A 123 123 LEU CB C 123 45.210 41.669 3.541 1 1 1219 . 4 1 1 A 123 123 LEU N N 123 127.200 128.672 -1.472 1 1 1220 . 4 1 1 A 124 124 ARG H H 124 9.540 8.711 0.829 1 1 1221 . 4 1 1 A 124 124 ARG HA H 124 4.900 4.351 0.549 1 1 1229 . 4 1 1 A 124 124 ARG C C 124 176.320 175.985 0.335 1 1 1230 . 4 1 1 A 124 124 ARG CA C 124 55.320 57.106 -1.786 1 1 1231 . 4 1 1 A 124 124 ARG CB C 124 31.750 30.718 1.032 1 1 1234 . 4 1 1 A 124 124 ARG N N 124 124.290 126.125 -1.835 1 1 1236 . 4 1 1 A 125 125 ALA H H 125 8.880 8.510 0.370 1 1 1237 . 4 1 1 A 125 125 ALA HA H 125 4.380 4.128 0.252 1 1 1241 . 4 1 1 A 125 125 ALA C C 125 177.290 177.744 -0.454 1 1 1242 . 4 1 1 A 125 125 ALA CA C 125 52.530 51.495 1.035 1 1 1243 . 4 1 1 A 125 125 ALA CB C 125 19.870 17.227 2.643 1 1 1244 . 4 1 1 A 125 125 ALA N N 125 130.790 129.722 1.068 1 1 1245 . 4 1 1 A 126 126 GLU H H 126 9.260 8.672 0.588 1 1 1246 . 4 1 1 A 126 126 GLU HA H 126 4.460 4.369 0.091 1 1 1251 . 4 1 1 A 126 126 GLU C C 126 176.120 176.047 0.073 1 1 1252 . 4 1 1 A 126 126 GLU CA C 126 56.940 57.054 -0.114 1 1 1253 . 4 1 1 A 126 126 GLU CB C 126 32.450 30.114 2.336 1 1 1255 . 4 1 1 A 126 126 GLU N N 126 125.740 123.551 2.189 1 1 1256 . 4 1 1 A 127 127 ALA H H 127 7.460 7.518 -0.058 1 1 1257 . 4 1 1 A 127 127 ALA HA H 127 4.360 4.606 -0.246 1 1 1261 . 4 1 1 A 127 127 ALA C C 127 173.400 175.609 -2.209 1 1 1262 . 4 1 1 A 127 127 ALA CA C 127 51.360 51.696 -0.336 1 1 1263 . 4 1 1 A 127 127 ALA CB C 127 22.180 21.887 0.293 1 1 1264 . 4 1 1 A 127 127 ALA N N 127 120.910 119.625 1.285 1 1 1265 . 4 1 1 A 128 128 LYS H H 128 7.940 8.749 -0.809 1 1 1266 . 4 1 1 A 128 128 LYS HA H 128 3.580 4.090 -0.510 1 1 1275 . 4 1 1 A 128 128 LYS C C 128 176.080 176.279 -0.199 1 1 1276 . 4 1 1 A 128 128 LYS CA C 128 56.860 57.153 -0.293 1 1 1277 . 4 1 1 A 128 128 LYS CB C 128 33.170 33.081 0.089 1 1 1281 . 4 1 1 A 128 128 LYS N N 128 116.520 124.459 -7.939 1 1 1282 . 4 1 1 A 129 129 ALA H H 129 8.590 8.497 0.093 1 1 1283 . 4 1 1 A 129 129 ALA HA H 129 4.390 4.678 -0.288 1 1 1287 . 4 1 1 A 129 129 ALA C C 129 174.970 176.421 -1.451 1 1 1288 . 4 1 1 A 129 129 ALA CA C 129 52.970 50.955 2.015 1 1 1289 . 4 1 1 A 129 129 ALA CB C 129 21.500 19.345 2.155 1 1 1290 . 4 1 1 A 129 129 ALA N N 129 124.710 128.600 -3.890 1 1 1291 . 4 1 1 A 130 130 GLU H H 130 8.660 8.289 0.371 1 1 1292 . 4 1 1 A 130 130 GLU HA H 130 4.660 3.946 0.714 1 1 1297 . 4 1 1 A 130 130 GLU C C 130 177.390 177.796 -0.406 1 1 1298 . 4 1 1 A 130 130 GLU CA C 130 55.070 58.455 -3.385 1 1 1299 . 4 1 1 A 130 130 GLU CB C 130 30.860 29.233 1.627 1 1 1301 . 4 1 1 A 130 130 GLU N N 130 123.180 122.776 0.404 1 1 1302 . 4 1 1 A 131 131 GLY H H 131 9.170 8.894 0.276 1 1 1303 . 4 1 1 A 131 131 GLY HA2 H 131 3.560 3.942 -0.382 1 1 1304 . 4 1 1 A 131 131 GLY HA3 H 131 3.750 3.951 -0.201 1 1 1305 . 4 1 1 A 131 131 GLY C C 131 174.550 174.436 0.114 1 1 1306 . 4 1 1 A 131 131 GLY CA C 131 47.660 46.141 1.519 1 1 1307 . 4 1 1 A 131 131 GLY N N 131 115.530 116.017 -0.487 1 1 1308 . 4 1 1 A 132 132 SER H H 132 8.430 8.290 0.140 1 1 1309 . 4 1 1 A 132 132 SER HA H 132 4.170 4.548 -0.378 1 1 1312 . 4 1 1 A 132 132 SER C C 132 175.350 173.812 1.538 1 1 1313 . 4 1 1 A 132 132 SER CA C 132 59.050 57.207 1.843 1 1 1314 . 4 1 1 A 132 132 SER CB C 132 64.880 61.784 3.096 1 1 1315 . 4 1 1 A 132 132 SER N N 132 115.930 116.813 -0.883 1 1 1316 . 4 1 1 A 133 133 ASN H H 133 8.850 9.097 -0.247 1 1 1317 . 4 1 1 A 133 133 ASN HA H 133 4.910 5.140 -0.230 1 1 1322 . 4 1 1 A 133 133 ASN C C 133 175.450 174.685 0.765 1 1 1323 . 4 1 1 A 133 133 ASN CA C 133 54.920 53.922 0.998 1 1 1324 . 4 1 1 A 133 133 ASN CB C 133 41.060 38.873 2.187 1 1 1325 . 4 1 1 A 133 133 ASN N N 133 125.590 126.280 -0.690 1 1 1327 . 4 1 1 A 134 134 LEU H H 134 9.070 9.858 -0.788 1 1 1328 . 4 1 1 A 134 134 LEU HA H 134 5.230 5.377 -0.147 1 1 1338 . 4 1 1 A 134 134 LEU C C 134 175.240 175.338 -0.098 1 1 1339 . 4 1 1 A 134 134 LEU CA C 134 53.470 53.354 0.116 1 1 1340 . 4 1 1 A 134 134 LEU CB C 134 45.090 44.685 0.405 1 1 1344 . 4 1 1 A 134 134 LEU N N 134 129.210 126.616 2.594 1 1 1345 . 4 1 1 A 135 135 SER H H 135 8.690 8.671 0.019 1 1 1346 . 4 1 1 A 135 135 SER HA H 135 5.280 5.446 -0.166 1 1 1349 . 4 1 1 A 135 135 SER C C 135 173.590 173.089 0.501 1 1 1350 . 4 1 1 A 135 135 SER CA C 135 56.220 56.634 -0.414 1 1 1351 . 4 1 1 A 135 135 SER CB C 135 66.510 64.770 1.740 1 1 1352 . 4 1 1 A 135 135 SER N N 135 113.020 118.966 -5.946 1 1 1353 . 4 1 1 A 136 136 VAL H H 136 8.940 8.885 0.055 1 1 1354 . 4 1 1 A 136 136 VAL HA H 136 5.500 4.518 0.982 1 1 1362 . 4 1 1 A 136 136 VAL C C 136 175.730 175.380 0.350 1 1 1363 . 4 1 1 A 136 136 VAL CA C 136 60.960 61.624 -0.664 1 1 1364 . 4 1 1 A 136 136 VAL CB C 136 33.630 31.551 2.079 1 1 1367 . 4 1 1 A 136 136 VAL N N 136 124.340 126.394 -2.054 1 1 1368 . 4 1 1 A 137 137 THR H H 137 9.240 8.510 0.730 1 1 1369 . 4 1 1 A 137 137 THR HA H 137 4.920 4.766 0.154 1 1 1374 . 4 1 1 A 137 137 THR C C 137 173.500 174.012 -0.512 1 1 1375 . 4 1 1 A 137 137 THR CA C 137 59.120 60.102 -0.982 1 1 1376 . 4 1 1 A 137 137 THR CB C 137 72.500 70.901 1.599 1 1 1378 . 4 1 1 A 137 137 THR N N 137 117.010 118.256 -1.246 1 1 1379 . 4 1 1 A 138 138 ASN H H 138 9.190 8.793 0.397 1 1 1380 . 4 1 1 A 138 138 ASN HA H 138 4.420 4.329 0.091 1 1 1385 . 4 1 1 A 138 138 ASN C C 138 175.550 174.571 0.979 1 1 1386 . 4 1 1 A 138 138 ASN CA C 138 54.350 54.287 0.063 1 1 1387 . 4 1 1 A 138 138 ASN CB C 138 37.380 36.780 0.600 1 1 1388 . 4 1 1 A 138 138 ASN N N 138 115.270 118.556 -3.286 1 1 1390 . 4 1 1 A 139 139 SER H H 139 8.560 7.857 0.703 1 1 1391 . 4 1 1 A 139 139 SER HA H 139 5.800 4.419 1.381 1 1 1394 . 4 1 1 A 139 139 SER C C 139 175.750 174.239 1.511 1 1 1395 . 4 1 1 A 139 139 SER CA C 139 56.020 58.068 -2.048 1 1 1396 . 4 1 1 A 139 139 SER CB C 139 65.320 62.856 2.464 1 1 1397 . 4 1 1 A 139 139 SER N N 139 112.360 113.922 -1.562 1 1 1398 . 4 1 1 A 140 140 SER H H 140 9.900 8.342 1.558 1 1 1399 . 4 1 1 A 140 140 SER HA H 140 5.360 5.235 0.125 1 1 1402 . 4 1 1 A 140 140 SER C C 140 172.620 173.915 -1.295 1 1 1403 . 4 1 1 A 140 140 SER CA C 140 57.400 56.209 1.191 1 1 1404 . 4 1 1 A 140 140 SER CB C 140 66.550 65.777 0.773 1 1 1405 . 4 1 1 A 140 140 SER N N 140 119.130 118.581 0.549 1 1 1406 . 4 1 1 A 141 141 VAL H H 141 9.030 8.674 0.356 1 1 1407 . 4 1 1 A 141 141 VAL HA H 141 5.520 5.132 0.388 1 1 1415 . 4 1 1 A 141 141 VAL C C 141 174.750 175.157 -0.407 1 1 1416 . 4 1 1 A 141 141 VAL CA C 141 58.310 59.627 -1.317 1 1 1417 . 4 1 1 A 141 141 VAL CB C 141 35.030 36.526 -1.496 1 1 1420 . 4 1 1 A 141 141 VAL N N 141 111.410 114.518 -3.108 1 1 1421 . 4 1 1 A 142 142 GLY H H 142 8.790 8.654 0.136 1 1 1422 . 4 1 1 A 142 142 GLY HA2 H 142 3.600 4.270 -0.670 1 1 1423 . 4 1 1 A 142 142 GLY HA3 H 142 5.310 4.301 1.009 1 1 1424 . 4 1 1 A 142 142 GLY C C 142 174.180 174.517 -0.337 1 1 1425 . 4 1 1 A 142 142 GLY CA C 142 44.110 45.367 -1.257 1 1 1426 . 4 1 1 A 142 142 GLY N N 142 109.330 109.652 -0.322 1 1 1427 . 4 1 1 A 143 143 ASP H H 143 8.840 8.813 0.027 1 1 1428 . 4 1 1 A 143 143 ASP HA H 143 5.790 5.313 0.477 1 1 1431 . 4 1 1 A 143 143 ASP C C 143 178.860 177.054 1.806 1 1 1432 . 4 1 1 A 143 143 ASP CA C 143 53.040 53.437 -0.397 1 1 1433 . 4 1 1 A 143 143 ASP CB C 143 43.660 42.121 1.539 1 1 1434 . 4 1 1 A 143 143 ASP N N 143 125.390 125.179 0.211 1 1 1435 . 4 1 1 A 144 144 GLY H H 144 9.150 8.851 0.299 1 1 1436 . 4 1 1 A 144 144 GLY HA2 H 144 3.450 3.808 -0.358 1 1 1437 . 4 1 1 A 144 144 GLY HA3 H 144 3.720 3.881 -0.161 1 1 1438 . 4 1 1 A 144 144 GLY C C 144 174.770 175.832 -1.062 1 1 1439 . 4 1 1 A 144 144 GLY CA C 144 46.930 47.609 -0.679 1 1 1440 . 4 1 1 A 144 144 GLY N N 144 106.470 107.876 -1.406 1 1 1441 . 4 1 1 A 145 145 GLU H H 145 8.470 7.924 0.546 1 1 1442 . 4 1 1 A 145 145 GLU HA H 145 4.460 4.244 0.216 1 1 1447 . 4 1 1 A 145 145 GLU C C 145 176.520 176.408 0.112 1 1 1448 . 4 1 1 A 145 145 GLU CA C 145 55.330 56.869 -1.539 1 1 1449 . 4 1 1 A 145 145 GLU CB C 145 30.620 29.828 0.792 1 1 1451 . 4 1 1 A 145 145 GLU N N 145 119.170 121.169 -1.999 1 1 1452 . 4 1 1 A 146 146 GLY H H 146 7.950 8.231 -0.281 1 1 1453 . 4 1 1 A 146 146 GLY HA2 H 146 3.630 4.004 -0.374 1 1 1454 . 4 1 1 A 146 146 GLY HA3 H 146 4.130 4.016 0.114 1 1 1455 . 4 1 1 A 146 146 GLY C C 146 174.350 174.684 -0.334 1 1 1456 . 4 1 1 A 146 146 GLY CA C 146 45.330 44.976 0.354 1 1 1457 . 4 1 1 A 146 146 GLY N N 146 108.130 106.727 1.403 1 1 1458 . 4 1 1 A 147 147 LEU H H 147 8.440 7.792 0.648 1 1 1459 . 4 1 1 A 147 147 LEU HA H 147 4.340 4.412 -0.072 1 1 1469 . 4 1 1 A 147 147 LEU C C 147 175.950 175.385 0.565 1 1 1470 . 4 1 1 A 147 147 LEU CA C 147 54.860 54.729 0.131 1 1 1471 . 4 1 1 A 147 147 LEU CB C 147 41.590 42.381 -0.791 1 1 1475 . 4 1 1 A 147 147 LEU N N 147 124.000 122.652 1.348 1 1 1476 . 4 1 1 A 148 148 VAL H H 148 7.780 8.180 -0.400 1 1 1477 . 4 1 1 A 148 148 VAL HA H 148 4.830 4.820 0.010 1 1 1485 . 4 1 1 A 148 148 VAL C C 148 175.740 175.001 0.739 1 1 1486 . 4 1 1 A 148 148 VAL CA C 148 61.140 60.659 0.481 1 1 1487 . 4 1 1 A 148 148 VAL CB C 148 33.640 34.155 -0.515 1 1 1490 . 4 1 1 A 148 148 VAL N N 148 120.440 119.755 0.685 1 1 1491 . 4 1 1 A 149 149 HIS H H 149 9.170 8.930 0.240 1 1 1492 . 4 1 1 A 149 149 HIS HA H 149 4.950 4.867 0.083 1 1 1496 . 4 1 1 A 149 149 HIS C C 149 174.780 174.886 -0.106 1 1 1497 . 4 1 1 A 149 149 HIS CA C 149 53.900 55.115 -1.215 1 1 1498 . 4 1 1 A 149 149 HIS CB C 149 32.200 28.724 3.476 1 1 1499 . 4 1 1 A 149 149 HIS N N 149 124.700 126.281 -1.581 1 1 1500 . 4 1 1 A 150 150 GLU H H 150 9.060 8.476 0.584 1 1 1501 . 4 1 1 A 150 150 GLU HA H 150 4.420 4.104 0.316 1 1 1506 . 4 1 1 A 150 150 GLU C C 150 176.520 176.718 -0.198 1 1 1507 . 4 1 1 A 150 150 GLU CA C 150 57.630 57.063 0.567 1 1 1508 . 4 1 1 A 150 150 GLU CB C 150 30.370 29.815 0.555 1 1 1510 . 4 1 1 A 150 150 GLU N N 150 125.540 123.914 1.626 1 1 1511 . 4 1 1 A 151 151 ILE H H 151 8.150 8.169 -0.019 1 1 1512 . 4 1 1 A 151 151 ILE HA H 151 4.780 4.463 0.317 1 1 1522 . 4 1 1 A 151 151 ILE C C 151 174.570 176.197 -1.627 1 1 1523 . 4 1 1 A 151 151 ILE CA C 151 59.390 59.726 -0.336 1 1 1524 . 4 1 1 A 151 151 ILE CB C 151 42.040 39.951 2.089 1 1 1528 . 4 1 1 A 151 151 ILE N N 151 115.880 123.185 -7.305 1 1 1529 . 4 1 1 A 152 152 ALA H H 152 8.010 8.800 -0.790 1 1 1530 . 4 1 1 A 152 152 ALA HA H 152 4.310 4.341 -0.031 1 1 1534 . 4 1 1 A 152 152 ALA C C 152 177.500 176.601 0.899 1 1 1535 . 4 1 1 A 152 152 ALA CA C 152 53.680 51.706 1.974 1 1 1536 . 4 1 1 A 152 152 ALA CB C 152 20.050 19.659 0.391 1 1 1537 . 4 1 1 A 152 152 ALA N N 152 126.640 124.923 1.717 1 1 1538 . 4 1 1 A 153 153 GLY H H 153 8.340 8.331 0.009 1 1 1539 . 4 1 1 A 153 153 GLY HA2 H 153 4.050 4.297 -0.247 1 1 1540 . 4 1 1 A 153 153 GLY HA3 H 153 4.140 4.298 -0.158 1 1 1541 . 4 1 1 A 153 153 GLY C C 153 173.140 171.641 1.499 1 1 1542 . 4 1 1 A 153 153 GLY CA C 153 44.130 45.747 -1.617 1 1 1543 . 4 1 1 A 153 153 GLY N N 153 107.490 105.474 2.016 1 1 1544 . 4 1 1 A 154 154 THR H H 154 7.380 7.895 -0.515 1 1 1545 . 4 1 1 A 154 154 THR HA H 154 4.700 5.072 -0.372 1 1 1550 . 4 1 1 A 154 154 THR C C 154 171.120 173.490 -2.370 1 1 1551 . 4 1 1 A 154 154 THR CA C 154 60.830 60.880 -0.050 1 1 1552 . 4 1 1 A 154 154 THR CB C 154 68.850 72.783 -3.933 1 1 1554 . 4 1 1 A 154 154 THR N N 154 109.340 114.035 -4.695 1 1 1555 . 4 1 1 A 155 155 GLU H H 155 8.020 8.748 -0.728 1 1 1556 . 4 1 1 A 155 155 GLU HA H 155 5.370 5.569 -0.199 1 1 1561 . 4 1 1 A 155 155 GLU C C 155 174.240 174.434 -0.194 1 1 1562 . 4 1 1 A 155 155 GLU CA C 155 54.830 54.092 0.738 1 1 1563 . 4 1 1 A 155 155 GLU CB C 155 33.620 33.596 0.024 1 1 1565 . 4 1 1 A 155 155 GLU N N 155 118.690 121.067 -2.377 1 1 1566 . 4 1 1 A 156 156 LYS H H 156 9.230 9.178 0.052 1 1 1567 . 4 1 1 A 156 156 LYS HA H 156 4.650 4.932 -0.282 1 1 1576 . 4 1 1 A 156 156 LYS C C 156 174.000 174.605 -0.605 1 1 1577 . 4 1 1 A 156 156 LYS CA C 156 55.840 55.266 0.574 1 1 1578 . 4 1 1 A 156 156 LYS CB C 156 37.550 36.582 0.968 1 1 1582 . 4 1 1 A 156 156 LYS N N 156 121.940 121.007 0.933 1 1 1583 . 4 1 1 A 157 157 THR H H 157 8.160 8.653 -0.493 1 1 1584 . 4 1 1 A 157 157 THR HA H 157 5.440 5.098 0.342 1 1 1589 . 4 1 1 A 157 157 THR C C 157 174.360 173.445 0.915 1 1 1590 . 4 1 1 A 157 157 THR CA C 157 60.410 60.735 -0.325 1 1 1591 . 4 1 1 A 157 157 THR CB C 157 71.500 71.330 0.170 1 1 1593 . 4 1 1 A 157 157 THR N N 157 113.240 112.942 0.298 1 1 1594 . 4 1 1 A 158 158 VAL H H 158 9.120 9.136 -0.016 1 1 1595 . 4 1 1 A 158 158 VAL HA H 158 4.580 5.348 -0.768 1 1 1603 . 4 1 1 A 158 158 VAL C C 158 172.800 174.598 -1.798 1 1 1604 . 4 1 1 A 158 158 VAL CA C 158 59.980 60.023 -0.043 1 1 1605 . 4 1 1 A 158 158 VAL CB C 158 36.290 34.575 1.715 1 1 1608 . 4 1 1 A 158 158 VAL N N 158 121.710 121.564 0.146 1 1 1609 . 4 1 1 A 159 159 ASN H H 159 8.240 8.621 -0.381 1 1 1610 . 4 1 1 A 159 159 ASN HA H 159 5.420 5.021 0.399 1 1 1615 . 4 1 1 A 159 159 ASN C C 159 173.800 174.153 -0.353 1 1 1616 . 4 1 1 A 159 159 ASN CA C 159 51.740 52.547 -0.807 1 1 1617 . 4 1 1 A 159 159 ASN CB C 159 40.380 39.260 1.120 1 1 1618 . 4 1 1 A 159 159 ASN N N 159 122.730 124.305 -1.575 1 1 1620 . 4 1 1 A 160 160 ILE H H 160 9.160 8.580 0.580 1 1 1621 . 4 1 1 A 160 160 ILE HA H 160 5.130 4.812 0.318 1 1 1631 . 4 1 1 A 160 160 ILE C C 160 177.320 175.615 1.705 1 1 1632 . 4 1 1 A 160 160 ILE CA C 160 60.640 60.836 -0.196 1 1 1633 . 4 1 1 A 160 160 ILE CB C 160 38.520 37.821 0.699 1 1 1637 . 4 1 1 A 160 160 ILE N N 160 123.690 125.727 -2.037 1 1 1638 . 4 1 1 A 161 161 ILE H H 161 8.780 9.021 -0.241 1 1 1639 . 4 1 1 A 161 161 ILE HA H 161 4.590 4.557 0.033 1 1 1649 . 4 1 1 A 161 161 ILE C C 161 174.960 175.802 -0.842 1 1 1650 . 4 1 1 A 161 161 ILE CA C 161 59.320 60.510 -1.190 1 1 1651 . 4 1 1 A 161 161 ILE CB C 161 41.030 39.562 1.468 1 1 1655 . 4 1 1 A 161 161 ILE N N 161 122.490 129.224 -6.734 1 1 1656 . 4 1 1 A 162 162 GLU H H 162 8.620 8.754 -0.134 1 1 1657 . 4 1 1 A 162 162 GLU HA H 162 4.290 4.198 0.092 1 1 1662 . 4 1 1 A 162 162 GLU C C 162 176.660 176.718 -0.058 1 1 1663 . 4 1 1 A 162 162 GLU CA C 162 56.470 57.948 -1.478 1 1 1664 . 4 1 1 A 162 162 GLU CB C 162 31.150 30.592 0.558 1 1 1666 . 4 1 1 A 162 162 GLU N N 162 120.520 126.509 -5.989 1 1 1667 . 4 1 1 A 163 163 GLY H H 163 8.480 8.198 0.282 1 1 1668 . 4 1 1 A 163 163 GLY HA2 H 163 3.910 4.114 -0.204 1 1 1669 . 4 1 1 A 163 163 GLY HA3 H 163 4.150 4.115 0.035 1 1 1670 . 4 1 1 A 163 163 GLY C C 163 174.000 173.959 0.041 1 1 1671 . 4 1 1 A 163 163 GLY CA C 163 45.270 46.070 -0.800 1 1 1672 . 4 1 1 A 163 163 GLY N N 163 110.210 112.888 -2.678 1 1 1673 . 4 1 1 A 164 164 THR H H 164 8.170 8.030 0.140 1 1 1674 . 4 1 1 A 164 164 THR HA H 164 4.410 4.606 -0.196 1 1 1679 . 4 1 1 A 164 164 THR C C 164 174.100 173.080 1.020 1 1 1680 . 4 1 1 A 164 164 THR CA C 164 61.620 59.907 1.713 1 1 1681 . 4 1 1 A 164 164 THR CB C 164 70.060 70.222 -0.162 1 1 1683 . 4 1 1 A 164 164 THR N N 164 113.480 116.721 -3.241 1 1 1 . 5 1 1 A 13 13 GLY H H 13 8.350 8.240 0.110 1 1 2 . 5 1 1 A 13 13 GLY HA2 H 13 3.920 3.921 -0.001 1 1 3 . 5 1 1 A 13 13 GLY HA3 H 13 3.920 3.933 -0.013 1 1 4 . 5 1 1 A 13 13 GLY CA C 13 45.290 45.984 -0.694 1 1 5 . 5 1 1 A 13 13 GLY N N 13 110.450 108.172 2.278 1 1 6 . 5 1 1 A 14 14 LEU H H 14 8.050 8.220 -0.170 1 1 7 . 5 1 1 A 14 14 LEU N N 14 121.500 120.136 1.364 1 1 8 . 5 1 1 A 15 15 VAL H H 15 8.070 7.359 0.711 1 1 9 . 5 1 1 A 15 15 VAL N N 15 122.390 117.364 5.026 1 1 10 . 5 1 1 A 16 16 PRO HA H 16 4.360 4.442 -0.082 1 1 17 . 5 1 1 A 16 16 PRO CA C 16 62.770 63.276 -0.506 1 1 18 . 5 1 1 A 16 16 PRO CB C 16 32.020 32.450 -0.430 1 1 21 . 5 1 1 A 21 21 MET H H 21 8.180 8.470 -0.290 1 1 22 . 5 1 1 A 21 21 MET N N 21 121.310 122.406 -1.096 1 1 23 . 5 1 1 A 22 22 ALA H H 22 8.290 7.820 0.470 1 1 24 . 5 1 1 A 22 22 ALA N N 22 124.800 121.479 3.321 1 1 25 . 5 1 1 A 23 23 SER H H 23 8.210 8.690 -0.480 1 1 26 . 5 1 1 A 23 23 SER N N 23 114.830 114.467 0.363 1 1 27 . 5 1 1 A 24 24 LYS H H 24 8.250 7.389 0.861 1 1 28 . 5 1 1 A 24 24 LYS N N 24 122.980 123.822 -0.842 1 1 29 . 5 1 1 A 25 25 LEU H H 25 8.140 9.081 -0.941 1 1 30 . 5 1 1 A 25 25 LEU HA H 25 4.290 5.168 -0.878 1 1 40 . 5 1 1 A 25 25 LEU C C 25 177.410 175.901 1.509 1 1 41 . 5 1 1 A 25 25 LEU CA C 25 55.430 53.257 2.173 1 1 42 . 5 1 1 A 25 25 LEU CB C 25 42.350 45.084 -2.734 1 1 46 . 5 1 1 A 25 25 LEU N N 25 122.580 127.592 -5.012 1 1 47 . 5 1 1 A 26 26 LYS H H 26 8.200 8.704 -0.504 1 1 48 . 5 1 1 A 26 26 LYS HA H 26 4.260 4.643 -0.383 1 1 57 . 5 1 1 A 26 26 LYS C C 26 176.520 175.965 0.555 1 1 58 . 5 1 1 A 26 26 LYS CA C 26 56.700 54.951 1.749 1 1 59 . 5 1 1 A 26 26 LYS CB C 26 33.060 32.821 0.239 1 1 63 . 5 1 1 A 26 26 LYS N N 26 121.800 121.749 0.051 1 1 64 . 5 1 1 A 27 27 GLU H H 27 8.380 8.513 -0.133 1 1 65 . 5 1 1 A 27 27 GLU HA H 27 4.240 4.374 -0.134 1 1 70 . 5 1 1 A 27 27 GLU C C 27 176.130 174.282 1.848 1 1 71 . 5 1 1 A 27 27 GLU CA C 27 56.700 56.491 0.209 1 1 72 . 5 1 1 A 27 27 GLU CB C 27 30.370 28.742 1.628 1 1 74 . 5 1 1 A 27 27 GLU N N 27 121.700 123.415 -1.715 1 1 75 . 5 1 1 A 28 28 ALA H H 28 8.230 8.593 -0.363 1 1 76 . 5 1 1 A 28 28 ALA HA H 28 4.280 5.409 -1.129 1 1 80 . 5 1 1 A 28 28 ALA C C 28 177.090 176.027 1.063 1 1 81 . 5 1 1 A 28 28 ALA CA C 28 52.530 50.174 2.356 1 1 82 . 5 1 1 A 28 28 ALA CB C 28 19.360 23.492 -4.132 1 1 83 . 5 1 1 A 28 28 ALA N N 28 124.640 125.267 -0.627 1 1 84 . 5 1 1 A 29 29 ALA H H 29 8.150 8.512 -0.362 1 1 85 . 5 1 1 A 29 29 ALA HA H 29 4.320 4.837 -0.517 1 1 89 . 5 1 1 A 29 29 ALA C C 29 177.120 175.736 1.384 1 1 90 . 5 1 1 A 29 29 ALA CA C 29 52.040 51.888 0.152 1 1 91 . 5 1 1 A 29 29 ALA CB C 29 19.430 18.751 0.679 1 1 92 . 5 1 1 A 29 29 ALA N N 29 123.430 119.628 3.802 1 1 93 . 5 1 1 A 30 30 GLU H H 30 8.310 8.844 -0.534 1 1 94 . 5 1 1 A 30 30 GLU HA H 30 4.220 4.884 -0.664 1 1 99 . 5 1 1 A 30 30 GLU C C 30 176.310 175.753 0.557 1 1 100 . 5 1 1 A 30 30 GLU CA C 30 56.630 55.599 1.031 1 1 101 . 5 1 1 A 30 30 GLU CB C 30 30.320 30.931 -0.611 1 1 103 . 5 1 1 A 30 30 GLU N N 30 120.630 122.735 -2.105 1 1 104 . 5 1 1 A 31 31 VAL H H 31 8.630 8.932 -0.302 1 1 105 . 5 1 1 A 31 31 VAL HA H 31 4.430 4.980 -0.550 1 1 113 . 5 1 1 A 31 31 VAL C C 31 176.510 176.659 -0.149 1 1 114 . 5 1 1 A 31 31 VAL CA C 31 62.360 63.127 -0.767 1 1 115 . 5 1 1 A 31 31 VAL CB C 31 32.370 31.833 0.537 1 1 118 . 5 1 1 A 31 31 VAL N N 31 127.110 125.649 1.461 1 1 119 . 5 1 1 A 32 32 THR H H 32 7.640 8.774 -1.134 1 1 120 . 5 1 1 A 32 32 THR HA H 32 4.870 3.919 0.951 1 1 125 . 5 1 1 A 32 32 THR C C 32 172.220 174.790 -2.570 1 1 126 . 5 1 1 A 32 32 THR CA C 32 59.510 64.855 -5.345 1 1 127 . 5 1 1 A 32 32 THR CB C 32 71.630 69.882 1.748 1 1 129 . 5 1 1 A 32 32 THR N N 32 118.860 121.188 -2.328 1 1 130 . 5 1 1 A 33 33 GLY H H 33 8.350 7.960 0.390 1 1 131 . 5 1 1 A 33 33 GLY HA2 H 33 4.160 3.975 0.185 1 1 132 . 5 1 1 A 33 33 GLY HA3 H 33 4.250 3.976 0.274 1 1 133 . 5 1 1 A 33 33 GLY C C 33 172.820 173.079 -0.259 1 1 134 . 5 1 1 A 33 33 GLY CA C 33 46.680 45.715 0.965 1 1 135 . 5 1 1 A 33 33 GLY N N 33 106.720 109.167 -2.447 1 1 136 . 5 1 1 A 34 34 SER H H 34 8.810 8.151 0.659 1 1 137 . 5 1 1 A 34 34 SER HA H 34 5.390 4.986 0.404 1 1 140 . 5 1 1 A 34 34 SER C C 34 173.780 172.577 1.203 1 1 141 . 5 1 1 A 34 34 SER CA C 34 57.380 57.441 -0.061 1 1 142 . 5 1 1 A 34 34 SER CB C 34 65.730 65.769 -0.039 1 1 143 . 5 1 1 A 34 34 SER N N 34 112.690 120.040 -7.350 1 1 144 . 5 1 1 A 35 35 VAL H H 35 8.470 8.707 -0.237 1 1 145 . 5 1 1 A 35 35 VAL HA H 35 4.120 5.019 -0.899 1 1 153 . 5 1 1 A 35 35 VAL C C 35 174.750 174.604 0.146 1 1 154 . 5 1 1 A 35 35 VAL CA C 35 62.310 59.897 2.413 1 1 155 . 5 1 1 A 35 35 VAL CB C 35 34.550 33.454 1.096 1 1 158 . 5 1 1 A 35 35 VAL N N 35 123.150 120.352 2.798 1 1 159 . 5 1 1 A 36 36 SER H H 36 8.240 8.742 -0.502 1 1 160 . 5 1 1 A 36 36 SER HA H 36 4.690 5.038 -0.348 1 1 163 . 5 1 1 A 36 36 SER C C 36 171.860 172.648 -0.788 1 1 164 . 5 1 1 A 36 36 SER CA C 36 56.020 57.824 -1.804 1 1 165 . 5 1 1 A 36 36 SER CB C 36 66.050 63.718 2.332 1 1 166 . 5 1 1 A 36 36 SER N N 36 118.760 121.230 -2.470 1 1 167 . 5 1 1 A 37 37 LEU H H 37 8.310 9.056 -0.746 1 1 168 . 5 1 1 A 37 37 LEU HA H 37 4.870 4.997 -0.127 1 1 178 . 5 1 1 A 37 37 LEU C C 37 174.190 175.297 -1.107 1 1 179 . 5 1 1 A 37 37 LEU CA C 37 53.870 53.789 0.081 1 1 180 . 5 1 1 A 37 37 LEU CB C 37 47.000 44.013 2.987 1 1 184 . 5 1 1 A 37 37 LEU N N 37 124.790 129.556 -4.766 1 1 185 . 5 1 1 A 38 38 GLU H H 38 9.270 8.874 0.396 1 1 186 . 5 1 1 A 38 38 GLU HA H 38 4.650 4.971 -0.321 1 1 191 . 5 1 1 A 38 38 GLU C C 38 173.970 175.076 -1.106 1 1 192 . 5 1 1 A 38 38 GLU CA C 38 54.410 55.801 -1.391 1 1 193 . 5 1 1 A 38 38 GLU CB C 38 32.460 32.069 0.391 1 1 195 . 5 1 1 A 38 38 GLU N N 38 126.550 127.677 -1.127 1 1 196 . 5 1 1 A 39 39 ALA H H 39 8.120 8.624 -0.504 1 1 197 . 5 1 1 A 39 39 ALA HA H 39 4.600 4.843 -0.243 1 1 201 . 5 1 1 A 39 39 ALA C C 39 175.930 177.217 -1.287 1 1 202 . 5 1 1 A 39 39 ALA CA C 39 51.570 50.382 1.188 1 1 203 . 5 1 1 A 39 39 ALA CB C 39 21.780 22.539 -0.759 1 1 204 . 5 1 1 A 39 39 ALA N N 39 124.410 129.448 -5.038 1 1 205 . 5 1 1 A 40 40 LEU H H 40 7.860 9.012 -1.152 1 1 206 . 5 1 1 A 40 40 LEU HA H 40 4.230 3.967 0.263 1 1 216 . 5 1 1 A 40 40 LEU C C 40 175.940 176.661 -0.721 1 1 217 . 5 1 1 A 40 40 LEU CA C 40 55.360 57.303 -1.943 1 1 218 . 5 1 1 A 40 40 LEU CB C 40 42.990 42.177 0.813 1 1 222 . 5 1 1 A 40 40 LEU N N 40 120.640 122.005 -1.365 1 1 223 . 5 1 1 A 41 41 GLU H H 41 8.210 7.879 0.331 1 1 224 . 5 1 1 A 41 41 GLU HA H 41 4.240 4.020 0.220 1 1 229 . 5 1 1 A 41 41 GLU C C 41 176.920 174.797 2.123 1 1 230 . 5 1 1 A 41 41 GLU CA C 41 58.090 57.759 0.331 1 1 231 . 5 1 1 A 41 41 GLU CB C 41 30.530 27.207 3.323 1 1 233 . 5 1 1 A 41 41 GLU N N 41 114.680 116.336 -1.656 1 1 234 . 5 1 1 A 42 42 GLU H H 42 7.490 7.753 -0.263 1 1 235 . 5 1 1 A 42 42 GLU HA H 42 5.680 4.800 0.880 1 1 240 . 5 1 1 A 42 42 GLU C C 42 173.790 174.161 -0.371 1 1 241 . 5 1 1 A 42 42 GLU CA C 42 54.360 56.234 -1.874 1 1 242 . 5 1 1 A 42 42 GLU CB C 42 33.850 33.220 0.630 1 1 244 . 5 1 1 A 42 42 GLU N N 42 116.670 118.243 -1.573 1 1 245 . 5 1 1 A 43 43 VAL H H 43 8.550 8.856 -0.306 1 1 246 . 5 1 1 A 43 43 VAL HA H 43 4.550 4.655 -0.105 1 1 254 . 5 1 1 A 43 43 VAL C C 43 172.220 173.745 -1.525 1 1 255 . 5 1 1 A 43 43 VAL CA C 43 59.470 60.422 -0.952 1 1 256 . 5 1 1 A 43 43 VAL CB C 43 35.470 34.627 0.843 1 1 259 . 5 1 1 A 43 43 VAL N N 43 120.030 125.256 -5.226 1 1 260 . 5 1 1 A 44 44 GLN H H 44 8.470 8.610 -0.140 1 1 261 . 5 1 1 A 44 44 GLN HA H 44 4.890 4.505 0.385 1 1 268 . 5 1 1 A 44 44 GLN C C 44 176.130 176.042 0.088 1 1 269 . 5 1 1 A 44 44 GLN CA C 44 54.360 55.603 -1.243 1 1 270 . 5 1 1 A 44 44 GLN CB C 44 30.610 29.354 1.256 1 1 272 . 5 1 1 A 44 44 GLN N N 44 124.690 130.138 -5.448 1 1 274 . 5 1 1 A 45 45 VAL H H 45 8.130 8.560 -0.430 1 1 275 . 5 1 1 A 45 45 VAL HA H 45 3.030 3.959 -0.929 1 1 283 . 5 1 1 A 45 45 VAL C C 45 176.710 177.223 -0.513 1 1 284 . 5 1 1 A 45 45 VAL CA C 45 65.810 64.758 1.052 1 1 285 . 5 1 1 A 45 45 VAL CB C 45 31.960 31.456 0.504 1 1 288 . 5 1 1 A 45 45 VAL N N 45 120.450 126.948 -6.498 1 1 289 . 5 1 1 A 46 46 GLY H H 46 8.950 9.990 -1.040 1 1 290 . 5 1 1 A 46 46 GLY HA2 H 46 3.590 4.021 -0.431 1 1 291 . 5 1 1 A 46 46 GLY HA3 H 46 4.410 4.021 0.389 1 1 292 . 5 1 1 A 46 46 GLY C C 46 174.390 174.013 0.377 1 1 293 . 5 1 1 A 46 46 GLY CA C 46 44.730 44.957 -0.227 1 1 294 . 5 1 1 A 46 46 GLY N N 46 116.490 115.190 1.300 1 1 295 . 5 1 1 A 47 47 GLU H H 47 8.260 7.915 0.345 1 1 296 . 5 1 1 A 47 47 GLU HA H 47 4.460 4.688 -0.228 1 1 301 . 5 1 1 A 47 47 GLU C C 47 174.780 175.342 -0.562 1 1 302 . 5 1 1 A 47 47 GLU CA C 47 54.830 55.235 -0.405 1 1 303 . 5 1 1 A 47 47 GLU CB C 47 31.140 31.680 -0.540 1 1 305 . 5 1 1 A 47 47 GLU N N 47 120.520 121.507 -0.987 1 1 306 . 5 1 1 A 48 48 ASN H H 48 8.440 8.716 -0.276 1 1 307 . 5 1 1 A 48 48 ASN HA H 48 5.380 5.494 -0.114 1 1 312 . 5 1 1 A 48 48 ASN C C 48 174.770 174.098 0.672 1 1 313 . 5 1 1 A 48 48 ASN CA C 48 51.570 51.962 -0.392 1 1 314 . 5 1 1 A 48 48 ASN CB C 48 39.010 41.643 -2.633 1 1 315 . 5 1 1 A 48 48 ASN N N 48 117.180 120.203 -3.023 1 1 317 . 5 1 1 A 49 49 LEU H H 49 9.810 8.786 1.024 1 1 318 . 5 1 1 A 49 49 LEU HA H 49 4.510 5.130 -0.620 1 1 328 . 5 1 1 A 49 49 LEU C C 49 174.560 174.486 0.074 1 1 329 . 5 1 1 A 49 49 LEU CA C 49 53.460 53.596 -0.136 1 1 330 . 5 1 1 A 49 49 LEU CB C 49 45.520 46.811 -1.291 1 1 333 . 5 1 1 A 49 49 LEU N N 49 125.620 123.549 2.071 1 1 334 . 5 1 1 A 50 50 GLU H H 50 8.750 8.909 -0.159 1 1 335 . 5 1 1 A 50 50 GLU HA H 50 4.360 4.897 -0.537 1 1 340 . 5 1 1 A 50 50 GLU C C 50 175.340 174.758 0.582 1 1 341 . 5 1 1 A 50 50 GLU CA C 50 55.550 55.318 0.232 1 1 342 . 5 1 1 A 50 50 GLU CB C 50 29.890 31.007 -1.117 1 1 344 . 5 1 1 A 50 50 GLU N N 50 125.420 124.952 0.468 1 1 345 . 5 1 1 A 51 51 VAL H H 51 9.230 8.476 0.754 1 1 346 . 5 1 1 A 51 51 VAL HA H 51 4.190 4.789 -0.599 1 1 354 . 5 1 1 A 51 51 VAL C C 51 175.310 174.666 0.644 1 1 355 . 5 1 1 A 51 51 VAL CA C 51 62.520 61.230 1.290 1 1 356 . 5 1 1 A 51 51 VAL CB C 51 31.470 33.513 -2.043 1 1 359 . 5 1 1 A 51 51 VAL N N 51 129.810 125.596 4.214 1 1 360 . 5 1 1 A 52 52 GLY H H 52 9.410 9.054 0.356 1 1 361 . 5 1 1 A 52 52 GLY HA2 H 52 3.460 4.013 -0.553 1 1 362 . 5 1 1 A 52 52 GLY HA3 H 52 4.680 4.063 0.617 1 1 363 . 5 1 1 A 52 52 GLY C C 52 173.000 172.880 0.120 1 1 364 . 5 1 1 A 52 52 GLY CA C 52 46.470 46.454 0.016 1 1 365 . 5 1 1 A 52 52 GLY N N 52 116.600 116.714 -0.114 1 1 366 . 5 1 1 A 53 53 VAL H H 53 9.130 8.388 0.742 1 1 367 . 5 1 1 A 53 53 VAL HA H 53 4.840 4.822 0.018 1 1 375 . 5 1 1 A 53 53 VAL C C 53 175.470 175.594 -0.124 1 1 376 . 5 1 1 A 53 53 VAL CA C 53 61.350 61.299 0.051 1 1 377 . 5 1 1 A 53 53 VAL CB C 53 34.300 31.465 2.835 1 1 380 . 5 1 1 A 53 53 VAL N N 53 129.050 126.247 2.803 1 1 381 . 5 1 1 A 54 54 GLY H H 54 8.420 8.576 -0.156 1 1 382 . 5 1 1 A 54 54 GLY HA2 H 54 3.850 3.647 0.203 1 1 383 . 5 1 1 A 54 54 GLY HA3 H 54 3.850 3.868 -0.018 1 1 384 . 5 1 1 A 54 54 GLY C C 54 173.310 173.248 0.062 1 1 385 . 5 1 1 A 54 54 GLY CA C 54 45.180 44.185 0.995 1 1 386 . 5 1 1 A 54 54 GLY N N 54 116.890 115.264 1.626 1 1 387 . 5 1 1 A 55 55 ILE H H 55 10.190 8.070 2.120 1 1 388 . 5 1 1 A 55 55 ILE HA H 55 4.010 4.831 -0.821 1 1 398 . 5 1 1 A 55 55 ILE C C 55 174.380 175.400 -1.020 1 1 399 . 5 1 1 A 55 55 ILE CA C 55 61.350 59.959 1.391 1 1 400 . 5 1 1 A 55 55 ILE CB C 55 40.840 40.306 0.534 1 1 404 . 5 1 1 A 55 55 ILE N N 55 129.330 121.137 8.193 1 1 405 . 5 1 1 A 56 56 ASP H H 56 8.810 9.216 -0.406 1 1 406 . 5 1 1 A 56 56 ASP HA H 56 4.440 5.085 -0.645 1 1 409 . 5 1 1 A 56 56 ASP C C 56 175.530 175.465 0.065 1 1 410 . 5 1 1 A 56 56 ASP CA C 56 56.460 55.140 1.320 1 1 411 . 5 1 1 A 56 56 ASP CB C 56 42.720 43.223 -0.503 1 1 412 . 5 1 1 A 56 56 ASP N N 56 128.310 127.993 0.317 1 1 413 . 5 1 1 A 57 57 GLU H H 57 7.270 7.489 -0.219 1 1 414 . 5 1 1 A 57 57 GLU HA H 57 4.290 4.915 -0.625 1 1 419 . 5 1 1 A 57 57 GLU C C 57 173.370 174.452 -1.082 1 1 420 . 5 1 1 A 57 57 GLU CA C 57 54.840 55.565 -0.725 1 1 421 . 5 1 1 A 57 57 GLU CB C 57 33.190 33.809 -0.619 1 1 423 . 5 1 1 A 57 57 GLU N N 57 112.810 116.230 -3.420 1 1 424 . 5 1 1 A 58 58 LEU H H 58 8.370 8.500 -0.130 1 1 425 . 5 1 1 A 58 58 LEU HA H 58 4.830 4.680 0.150 1 1 434 . 5 1 1 A 58 58 LEU C C 58 174.180 174.693 -0.513 1 1 435 . 5 1 1 A 58 58 LEU CA C 58 55.320 54.976 0.344 1 1 436 . 5 1 1 A 58 58 LEU CB C 58 44.300 43.123 1.177 1 1 439 . 5 1 1 A 58 58 LEU N N 58 123.130 124.897 -1.767 1 1 440 . 5 1 1 A 59 59 VAL H H 59 9.120 8.773 0.347 1 1 441 . 5 1 1 A 59 59 VAL HA H 59 4.240 4.670 -0.430 1 1 449 . 5 1 1 A 59 59 VAL C C 59 174.960 175.603 -0.643 1 1 450 . 5 1 1 A 59 59 VAL CA C 59 61.760 59.425 2.335 1 1 451 . 5 1 1 A 59 59 VAL CB C 59 33.760 33.994 -0.234 1 1 454 . 5 1 1 A 59 59 VAL N N 59 127.930 125.648 2.282 1 1 455 . 5 1 1 A 60 60 ASN H H 60 8.770 8.768 0.002 1 1 456 . 5 1 1 A 60 60 ASN HA H 60 4.250 4.340 -0.090 1 1 461 . 5 1 1 A 60 60 ASN C C 60 172.810 173.999 -1.189 1 1 462 . 5 1 1 A 60 60 ASN CA C 60 54.830 54.742 0.088 1 1 463 . 5 1 1 A 60 60 ASN CB C 60 36.030 36.969 -0.939 1 1 464 . 5 1 1 A 60 60 ASN N N 60 115.500 121.674 -6.174 1 1 466 . 5 1 1 A 61 61 ALA H H 61 7.330 7.308 0.022 1 1 467 . 5 1 1 A 61 61 ALA HA H 61 4.520 4.667 -0.147 1 1 471 . 5 1 1 A 61 61 ALA C C 61 174.580 175.050 -0.470 1 1 472 . 5 1 1 A 61 61 ALA CA C 61 51.560 50.896 0.664 1 1 473 . 5 1 1 A 61 61 ALA CB C 61 22.870 23.509 -0.639 1 1 474 . 5 1 1 A 61 61 ALA N N 61 115.640 118.884 -3.244 1 1 475 . 5 1 1 A 62 62 GLU H H 62 7.900 9.017 -1.117 1 1 476 . 5 1 1 A 62 62 GLU HA H 62 4.310 4.918 -0.608 1 1 481 . 5 1 1 A 62 62 GLU C C 62 173.790 175.428 -1.638 1 1 482 . 5 1 1 A 62 62 GLU CA C 62 55.080 55.108 -0.028 1 1 483 . 5 1 1 A 62 62 GLU CB C 62 32.610 30.498 2.112 1 1 485 . 5 1 1 A 62 62 GLU N N 62 117.400 118.725 -1.325 1 1 486 . 5 1 1 A 63 63 ALA H H 63 8.910 8.852 0.058 1 1 487 . 5 1 1 A 63 63 ALA HA H 63 4.690 4.585 0.105 1 1 491 . 5 1 1 A 63 63 ALA C C 63 175.720 176.950 -1.230 1 1 492 . 5 1 1 A 63 63 ALA CA C 63 50.600 53.370 -2.770 1 1 493 . 5 1 1 A 63 63 ALA CB C 63 20.660 19.166 1.494 1 1 494 . 5 1 1 A 63 63 ALA N N 63 122.480 130.191 -7.711 1 1 495 . 5 1 1 A 64 64 PHE H H 64 9.220 9.206 0.014 1 1 496 . 5 1 1 A 64 64 PHE HA H 64 4.320 4.784 -0.464 1 1 501 . 5 1 1 A 64 64 PHE C C 64 174.380 175.839 -1.459 1 1 502 . 5 1 1 A 64 64 PHE CA C 64 59.770 58.944 0.826 1 1 503 . 5 1 1 A 64 64 PHE CB C 64 40.830 41.275 -0.445 1 1 504 . 5 1 1 A 64 64 PHE N N 64 120.870 122.761 -1.891 1 1 505 . 5 1 1 A 65 65 ALA H H 65 8.150 7.967 0.183 1 1 506 . 5 1 1 A 65 65 ALA HA H 65 5.280 4.842 0.438 1 1 510 . 5 1 1 A 65 65 ALA C C 65 175.950 175.676 0.274 1 1 511 . 5 1 1 A 65 65 ALA CA C 65 51.120 50.960 0.160 1 1 512 . 5 1 1 A 65 65 ALA CB C 65 22.850 21.790 1.060 1 1 513 . 5 1 1 A 65 65 ALA N N 65 122.350 119.661 2.689 1 1 514 . 5 1 1 A 66 66 TYR H H 66 9.260 9.276 -0.016 1 1 515 . 5 1 1 A 66 66 TYR HA H 66 5.710 4.998 0.712 1 1 520 . 5 1 1 A 66 66 TYR C C 66 175.690 174.482 1.208 1 1 521 . 5 1 1 A 66 66 TYR CA C 66 54.390 58.794 -4.404 1 1 522 . 5 1 1 A 66 66 TYR CB C 66 41.560 40.019 1.541 1 1 523 . 5 1 1 A 66 66 TYR N N 66 124.350 126.484 -2.134 1 1 524 . 5 1 1 A 67 67 ASP H H 67 9.070 8.411 0.659 1 1 525 . 5 1 1 A 67 67 ASP HA H 67 5.630 5.406 0.224 1 1 528 . 5 1 1 A 67 67 ASP C C 67 174.300 174.586 -0.286 1 1 529 . 5 1 1 A 67 67 ASP CA C 67 51.590 53.347 -1.757 1 1 530 . 5 1 1 A 67 67 ASP CB C 67 44.380 43.233 1.147 1 1 531 . 5 1 1 A 67 67 ASP N N 67 130.490 125.405 5.085 1 1 532 . 5 1 1 A 68 68 PHE H H 68 8.670 8.492 0.178 1 1 533 . 5 1 1 A 68 68 PHE HA H 68 4.890 5.272 -0.382 1 1 538 . 5 1 1 A 68 68 PHE C C 68 172.220 172.849 -0.629 1 1 539 . 5 1 1 A 68 68 PHE CA C 68 57.360 55.670 1.690 1 1 540 . 5 1 1 A 68 68 PHE CB C 68 40.360 42.495 -2.135 1 1 541 . 5 1 1 A 68 68 PHE N N 68 118.200 118.436 -0.236 1 1 542 . 5 1 1 A 69 69 THR H H 69 8.390 9.242 -0.852 1 1 543 . 5 1 1 A 69 69 THR HA H 69 5.170 5.310 -0.140 1 1 548 . 5 1 1 A 69 69 THR C C 69 172.620 173.277 -0.657 1 1 549 . 5 1 1 A 69 69 THR CA C 69 61.370 61.272 0.098 1 1 550 . 5 1 1 A 69 69 THR CB C 69 64.880 70.988 -6.108 1 1 552 . 5 1 1 A 69 69 THR N N 69 115.810 112.703 3.107 1 1 553 . 5 1 1 A 70 70 LEU H H 70 9.560 9.002 0.558 1 1 554 . 5 1 1 A 70 70 LEU HA H 70 5.270 5.082 0.188 1 1 564 . 5 1 1 A 70 70 LEU C C 70 173.800 175.452 -1.652 1 1 565 . 5 1 1 A 70 70 LEU CA C 70 53.460 54.090 -0.630 1 1 566 . 5 1 1 A 70 70 LEU CB C 70 45.040 43.098 1.942 1 1 570 . 5 1 1 A 70 70 LEU N N 70 129.220 129.021 0.199 1 1 571 . 5 1 1 A 71 71 ASN H H 71 9.590 8.542 1.048 1 1 572 . 5 1 1 A 71 71 ASN HA H 71 5.880 5.712 0.168 1 1 577 . 5 1 1 A 71 71 ASN C C 71 177.970 174.545 3.425 1 1 578 . 5 1 1 A 71 71 ASN CA C 71 52.060 51.935 0.125 1 1 579 . 5 1 1 A 71 71 ASN CB C 71 41.020 39.684 1.336 1 1 580 . 5 1 1 A 71 71 ASN N N 71 125.970 125.496 0.474 1 1 582 . 5 1 1 A 72 72 TYR H H 72 8.740 8.983 -0.243 1 1 583 . 5 1 1 A 72 72 TYR HA H 72 5.110 5.409 -0.299 1 1 588 . 5 1 1 A 72 72 TYR C C 72 177.720 174.480 3.240 1 1 589 . 5 1 1 A 72 72 TYR CA C 72 55.310 55.452 -0.142 1 1 590 . 5 1 1 A 72 72 TYR CB C 72 41.510 41.318 0.192 1 1 591 . 5 1 1 A 72 72 TYR N N 72 119.640 119.339 0.301 1 1 592 . 5 1 1 A 73 73 ASP H H 73 9.780 9.026 0.754 1 1 593 . 5 1 1 A 73 73 ASP HA H 73 4.680 4.938 -0.258 1 1 596 . 5 1 1 A 73 73 ASP C C 73 177.290 176.329 0.961 1 1 597 . 5 1 1 A 73 73 ASP CA C 73 53.650 53.199 0.451 1 1 598 . 5 1 1 A 73 73 ASP CB C 73 40.900 41.573 -0.673 1 1 599 . 5 1 1 A 73 73 ASP N N 73 119.290 119.658 -0.368 1 1 600 . 5 1 1 A 74 74 GLU H H 74 9.430 8.600 0.830 1 1 601 . 5 1 1 A 74 74 GLU HA H 74 4.740 4.270 0.470 1 1 606 . 5 1 1 A 74 74 GLU C C 74 176.320 177.958 -1.638 1 1 607 . 5 1 1 A 74 74 GLU CA C 74 57.410 59.511 -2.101 1 1 608 . 5 1 1 A 74 74 GLU CB C 74 29.490 29.448 0.042 1 1 610 . 5 1 1 A 74 74 GLU N N 74 130.930 126.167 4.763 1 1 611 . 5 1 1 A 75 75 ASN H H 75 8.680 8.153 0.527 1 1 612 . 5 1 1 A 75 75 ASN HA H 75 4.600 4.507 0.093 1 1 617 . 5 1 1 A 75 75 ASN C C 75 175.340 176.946 -1.606 1 1 618 . 5 1 1 A 75 75 ASN CA C 75 54.620 55.951 -1.331 1 1 619 . 5 1 1 A 75 75 ASN CB C 75 38.770 38.489 0.281 1 1 620 . 5 1 1 A 75 75 ASN N N 75 115.040 117.384 -2.344 1 1 622 . 5 1 1 A 76 76 ALA H H 76 7.740 7.537 0.203 1 1 623 . 5 1 1 A 76 76 ALA HA H 76 4.310 4.497 -0.187 1 1 627 . 5 1 1 A 76 76 ALA C C 76 175.550 176.993 -1.443 1 1 628 . 5 1 1 A 76 76 ALA CA C 76 53.260 52.986 0.274 1 1 629 . 5 1 1 A 76 76 ALA CB C 76 21.450 21.479 -0.029 1 1 630 . 5 1 1 A 76 76 ALA N N 76 122.200 119.640 2.560 1 1 631 . 5 1 1 A 77 77 PHE H H 77 8.070 8.614 -0.544 1 1 632 . 5 1 1 A 77 77 PHE HA H 77 5.650 4.860 0.790 1 1 637 . 5 1 1 A 77 77 PHE C C 77 174.570 175.306 -0.736 1 1 638 . 5 1 1 A 77 77 PHE CA C 77 56.360 57.390 -1.030 1 1 639 . 5 1 1 A 77 77 PHE CB C 77 46.080 40.725 5.355 1 1 640 . 5 1 1 A 77 77 PHE N N 77 114.160 115.173 -1.013 1 1 641 . 5 1 1 A 78 78 GLU H H 78 8.800 8.816 -0.016 1 1 642 . 5 1 1 A 78 78 GLU HA H 78 4.900 4.943 -0.043 1 1 647 . 5 1 1 A 78 78 GLU C C 78 175.950 174.658 1.292 1 1 648 . 5 1 1 A 78 78 GLU CA C 78 53.670 56.118 -2.448 1 1 649 . 5 1 1 A 78 78 GLU CB C 78 33.600 33.232 0.368 1 1 651 . 5 1 1 A 78 78 GLU N N 78 117.590 120.326 -2.736 1 1 652 . 5 1 1 A 79 79 TYR H H 79 8.770 9.854 -1.084 1 1 653 . 5 1 1 A 79 79 TYR HA H 79 4.250 4.230 0.020 1 1 658 . 5 1 1 A 79 79 TYR C C 79 174.580 174.942 -0.362 1 1 659 . 5 1 1 A 79 79 TYR CA C 79 59.250 59.552 -0.302 1 1 660 . 5 1 1 A 79 79 TYR CB C 79 38.310 39.299 -0.989 1 1 661 . 5 1 1 A 79 79 TYR N N 79 126.560 128.826 -2.266 1 1 662 . 5 1 1 A 80 80 VAL H H 80 8.220 8.390 -0.170 1 1 663 . 5 1 1 A 80 80 VAL HA H 80 3.690 3.902 -0.212 1 1 671 . 5 1 1 A 80 80 VAL C C 80 174.780 175.534 -0.754 1 1 672 . 5 1 1 A 80 80 VAL CA C 80 64.400 62.937 1.463 1 1 673 . 5 1 1 A 80 80 VAL CB C 80 33.510 33.213 0.297 1 1 676 . 5 1 1 A 80 80 VAL N N 80 129.460 124.858 4.602 1 1 677 . 5 1 1 A 81 81 GLU H H 81 6.920 7.519 -0.599 1 1 678 . 5 1 1 A 81 81 GLU HA H 81 4.260 4.592 -0.332 1 1 683 . 5 1 1 A 81 81 GLU C C 81 171.840 174.776 -2.936 1 1 684 . 5 1 1 A 81 81 GLU CA C 81 55.310 55.306 0.004 1 1 685 . 5 1 1 A 81 81 GLU CB C 81 30.520 32.837 -2.317 1 1 687 . 5 1 1 A 81 81 GLU N N 81 112.430 114.672 -2.242 1 1 688 . 5 1 1 A 82 82 ALA H H 82 8.310 8.661 -0.351 1 1 689 . 5 1 1 A 82 82 ALA HA H 82 5.650 5.101 0.549 1 1 693 . 5 1 1 A 82 82 ALA C C 82 176.110 177.037 -0.927 1 1 694 . 5 1 1 A 82 82 ALA CA C 82 50.620 51.846 -1.226 1 1 695 . 5 1 1 A 82 82 ALA CB C 82 21.770 19.887 1.883 1 1 696 . 5 1 1 A 82 82 ALA N N 82 121.240 124.937 -3.697 1 1 697 . 5 1 1 A 83 83 ILE H H 83 9.150 9.376 -0.226 1 1 698 . 5 1 1 A 83 83 ILE HA H 83 4.600 4.859 -0.259 1 1 708 . 5 1 1 A 83 83 ILE C C 83 174.810 175.400 -0.590 1 1 709 . 5 1 1 A 83 83 ILE CA C 83 60.060 59.288 0.772 1 1 710 . 5 1 1 A 83 83 ILE CB C 83 42.440 41.149 1.291 1 1 714 . 5 1 1 A 83 83 ILE N N 83 119.720 120.676 -0.956 1 1 715 . 5 1 1 A 84 84 SER H H 84 8.350 8.885 -0.535 1 1 716 . 5 1 1 A 84 84 SER HA H 84 4.660 4.941 -0.281 1 1 719 . 5 1 1 A 84 84 SER C C 84 177.550 172.510 5.040 1 1 720 . 5 1 1 A 84 84 SER CA C 84 57.330 55.605 1.725 1 1 721 . 5 1 1 A 84 84 SER CB C 84 66.490 65.287 1.203 1 1 722 . 5 1 1 A 84 84 SER N N 84 116.740 120.872 -4.132 1 1 723 . 5 1 1 A 85 85 ASP H H 85 8.740 8.498 0.242 1 1 724 . 5 1 1 A 85 85 ASP HA H 85 4.820 4.975 -0.155 1 1 727 . 5 1 1 A 85 85 ASP C C 85 176.090 176.037 0.053 1 1 728 . 5 1 1 A 85 85 ASP CA C 85 53.480 52.892 0.588 1 1 729 . 5 1 1 A 85 85 ASP CB C 85 42.480 42.440 0.040 1 1 730 . 5 1 1 A 85 85 ASP N N 85 120.960 120.934 0.026 1 1 731 . 5 1 1 A 86 86 ASP H H 86 8.380 8.562 -0.182 1 1 732 . 5 1 1 A 86 86 ASP HA H 86 4.450 4.804 -0.354 1 1 735 . 5 1 1 A 86 86 ASP C C 86 177.100 177.002 0.098 1 1 736 . 5 1 1 A 86 86 ASP CA C 86 56.240 53.252 2.988 1 1 737 . 5 1 1 A 86 86 ASP CB C 86 41.100 41.337 -0.237 1 1 738 . 5 1 1 A 86 86 ASP N N 86 117.710 121.451 -3.741 1 1 739 . 5 1 1 A 87 87 GLY H H 87 8.690 7.537 1.153 1 1 740 . 5 1 1 A 87 87 GLY HA2 H 87 3.870 4.026 -0.156 1 1 741 . 5 1 1 A 87 87 GLY HA3 H 87 4.090 4.029 0.061 1 1 742 . 5 1 1 A 87 87 GLY C C 87 173.800 174.093 -0.293 1 1 743 . 5 1 1 A 87 87 GLY CA C 87 45.770 45.716 0.054 1 1 744 . 5 1 1 A 87 87 GLY N N 87 108.540 107.462 1.078 1 1 745 . 5 1 1 A 88 88 VAL H H 88 7.910 7.508 0.402 1 1 746 . 5 1 1 A 88 88 VAL HA H 88 4.780 4.355 0.425 1 1 754 . 5 1 1 A 88 88 VAL C C 88 173.970 174.750 -0.780 1 1 755 . 5 1 1 A 88 88 VAL CA C 88 60.900 61.096 -0.196 1 1 756 . 5 1 1 A 88 88 VAL CB C 88 35.460 33.380 2.080 1 1 759 . 5 1 1 A 88 88 VAL N N 88 119.790 118.713 1.077 1 1 760 . 5 1 1 A 89 89 PHE H H 89 9.210 9.671 -0.461 1 1 761 . 5 1 1 A 89 89 PHE HA H 89 4.930 5.402 -0.472 1 1 766 . 5 1 1 A 89 89 PHE C C 89 173.970 173.585 0.385 1 1 767 . 5 1 1 A 89 89 PHE CA C 89 56.450 55.374 1.076 1 1 768 . 5 1 1 A 89 89 PHE CB C 89 41.120 42.367 -1.247 1 1 769 . 5 1 1 A 89 89 PHE N N 89 126.780 123.981 2.799 1 1 770 . 5 1 1 A 90 90 VAL H H 90 7.880 8.898 -1.018 1 1 771 . 5 1 1 A 90 90 VAL HA H 90 4.860 5.010 -0.150 1 1 779 . 5 1 1 A 90 90 VAL C C 90 173.190 175.144 -1.954 1 1 780 . 5 1 1 A 90 90 VAL CA C 90 59.750 61.083 -1.333 1 1 781 . 5 1 1 A 90 90 VAL CB C 90 34.770 34.196 0.574 1 1 784 . 5 1 1 A 90 90 VAL N N 90 124.990 127.040 -2.050 1 1 785 . 5 1 1 A 91 91 ASN H H 91 8.670 8.471 0.199 1 1 786 . 5 1 1 A 91 91 ASN HA H 91 4.730 5.315 -0.585 1 1 791 . 5 1 1 A 91 91 ASN C C 91 173.200 174.347 -1.147 1 1 792 . 5 1 1 A 91 91 ASN CA C 91 51.970 53.033 -1.063 1 1 793 . 5 1 1 A 91 91 ASN CB C 91 41.340 41.718 -0.378 1 1 794 . 5 1 1 A 91 91 ASN N N 91 124.860 125.590 -0.730 1 1 796 . 5 1 1 A 92 92 ALA H H 92 8.840 9.174 -0.334 1 1 797 . 5 1 1 A 92 92 ALA HA H 92 5.290 5.616 -0.326 1 1 801 . 5 1 1 A 92 92 ALA C C 92 176.330 176.209 0.121 1 1 802 . 5 1 1 A 92 92 ALA CA C 92 50.170 50.959 -0.789 1 1 803 . 5 1 1 A 92 92 ALA CB C 92 23.610 21.258 2.352 1 1 804 . 5 1 1 A 92 92 ALA N N 92 128.510 128.845 -0.335 1 1 805 . 5 1 1 A 93 93 LYS H H 93 8.670 9.433 -0.763 1 1 806 . 5 1 1 A 93 93 LYS HA H 93 4.460 4.884 -0.424 1 1 815 . 5 1 1 A 93 93 LYS C C 93 174.170 175.117 -0.947 1 1 816 . 5 1 1 A 93 93 LYS CA C 93 55.010 54.823 0.187 1 1 817 . 5 1 1 A 93 93 LYS CB C 93 36.430 35.674 0.756 1 1 821 . 5 1 1 A 93 93 LYS N N 93 121.300 121.822 -0.522 1 1 822 . 5 1 1 A 94 94 LYS H H 94 8.960 8.695 0.265 1 1 823 . 5 1 1 A 94 94 LYS HA H 94 4.460 4.095 0.365 1 1 832 . 5 1 1 A 94 94 LYS C C 94 176.330 176.894 -0.564 1 1 833 . 5 1 1 A 94 94 LYS CA C 94 56.720 56.619 0.101 1 1 834 . 5 1 1 A 94 94 LYS CB C 94 31.930 32.690 -0.760 1 1 837 . 5 1 1 A 94 94 LYS N N 94 127.060 127.194 -0.134 1 1 838 . 5 1 1 A 95 95 ILE H H 95 8.290 8.379 -0.089 1 1 839 . 5 1 1 A 95 95 ILE HA H 95 4.120 4.138 -0.018 1 1 849 . 5 1 1 A 95 95 ILE C C 95 175.740 175.058 0.682 1 1 850 . 5 1 1 A 95 95 ILE CA C 95 62.760 62.648 0.112 1 1 851 . 5 1 1 A 95 95 ILE CB C 95 38.890 39.198 -0.308 1 1 855 . 5 1 1 A 95 95 ILE N N 95 126.530 128.126 -1.596 1 1 856 . 5 1 1 A 96 96 GLU H H 96 8.030 7.413 0.617 1 1 857 . 5 1 1 A 96 96 GLU HA H 96 4.450 4.702 -0.252 1 1 862 . 5 1 1 A 96 96 GLU C C 96 174.380 175.002 -0.622 1 1 863 . 5 1 1 A 96 96 GLU CA C 96 54.320 54.962 -0.642 1 1 864 . 5 1 1 A 96 96 GLU CB C 96 32.770 33.574 -0.804 1 1 866 . 5 1 1 A 96 96 GLU N N 96 117.080 118.912 -1.832 1 1 867 . 5 1 1 A 97 97 ASP H H 97 8.730 8.742 -0.012 1 1 868 . 5 1 1 A 97 97 ASP HA H 97 4.360 4.462 -0.102 1 1 871 . 5 1 1 A 97 97 ASP C C 97 177.100 177.145 -0.045 1 1 872 . 5 1 1 A 97 97 ASP CA C 97 57.160 55.969 1.191 1 1 873 . 5 1 1 A 97 97 ASP CB C 97 39.920 40.212 -0.292 1 1 874 . 5 1 1 A 97 97 ASP N N 97 120.570 121.021 -0.451 1 1 875 . 5 1 1 A 98 98 GLY H H 98 8.760 8.487 0.273 1 1 876 . 5 1 1 A 98 98 GLY HA2 H 98 2.120 1.355 0.765 1 1 877 . 5 1 1 A 98 98 GLY HA3 H 98 3.910 3.340 0.570 1 1 878 . 5 1 1 A 98 98 GLY C C 98 174.000 172.928 1.072 1 1 879 . 5 1 1 A 98 98 GLY CA C 98 45.720 45.205 0.515 1 1 880 . 5 1 1 A 98 98 GLY N N 98 112.090 111.395 0.695 1 1 881 . 5 1 1 A 99 99 LYS H H 99 7.890 6.735 1.155 1 1 882 . 5 1 1 A 99 99 LYS HA H 99 5.330 5.088 0.242 1 1 891 . 5 1 1 A 99 99 LYS C C 99 174.750 174.336 0.414 1 1 892 . 5 1 1 A 99 99 LYS CA C 99 55.990 54.817 1.173 1 1 893 . 5 1 1 A 99 99 LYS CB C 99 37.840 35.407 2.433 1 1 897 . 5 1 1 A 99 99 LYS N N 99 118.050 114.819 3.231 1 1 898 . 5 1 1 A 100 100 VAL H H 100 8.980 8.524 0.456 1 1 899 . 5 1 1 A 100 100 VAL HA H 100 4.510 4.725 -0.215 1 1 907 . 5 1 1 A 100 100 VAL C C 100 174.760 173.822 0.938 1 1 908 . 5 1 1 A 100 100 VAL CA C 100 60.130 59.041 1.089 1 1 909 . 5 1 1 A 100 100 VAL CB C 100 35.240 35.772 -0.532 1 1 912 . 5 1 1 A 100 100 VAL N N 100 123.850 119.759 4.091 1 1 913 . 5 1 1 A 101 101 ARG H H 101 8.810 8.239 0.571 1 1 914 . 5 1 1 A 101 101 ARG HA H 101 4.850 4.592 0.258 1 1 921 . 5 1 1 A 101 101 ARG C C 101 174.770 174.430 0.340 1 1 922 . 5 1 1 A 101 101 ARG CA C 101 54.580 55.134 -0.554 1 1 923 . 5 1 1 A 101 101 ARG CB C 101 32.400 31.259 1.141 1 1 926 . 5 1 1 A 101 101 ARG N N 101 129.210 123.957 5.253 1 1 927 . 5 1 1 A 102 102 VAL H H 102 9.100 8.588 0.512 1 1 928 . 5 1 1 A 102 102 VAL HA H 102 4.120 4.439 -0.319 1 1 936 . 5 1 1 A 102 102 VAL C C 102 171.640 173.868 -2.228 1 1 937 . 5 1 1 A 102 102 VAL CA C 102 61.350 60.444 0.906 1 1 938 . 5 1 1 A 102 102 VAL CB C 102 32.530 32.954 -0.424 1 1 941 . 5 1 1 A 102 102 VAL N N 102 130.470 123.919 6.551 1 1 942 . 5 1 1 A 103 103 LEU H H 103 8.110 9.215 -1.105 1 1 943 . 5 1 1 A 103 103 LEU HA H 103 5.120 4.859 0.261 1 1 953 . 5 1 1 A 103 103 LEU C C 103 176.410 175.723 0.687 1 1 954 . 5 1 1 A 103 103 LEU CA C 103 53.380 54.073 -0.693 1 1 955 . 5 1 1 A 103 103 LEU CB C 103 43.680 40.991 2.689 1 1 959 . 5 1 1 A 103 103 LEU N N 103 125.560 130.239 -4.679 1 1 960 . 5 1 1 A 104 104 VAL H H 104 9.580 8.685 0.895 1 1 961 . 5 1 1 A 104 104 VAL HA H 104 5.260 5.371 -0.111 1 1 969 . 5 1 1 A 104 104 VAL C C 104 176.030 174.257 1.773 1 1 970 . 5 1 1 A 104 104 VAL CA C 104 60.220 59.907 0.313 1 1 971 . 5 1 1 A 104 104 VAL CB C 104 34.310 34.861 -0.551 1 1 974 . 5 1 1 A 104 104 VAL N N 104 125.790 126.024 -0.234 1 1 975 . 5 1 1 A 105 105 SER H H 105 9.340 9.042 0.298 1 1 976 . 5 1 1 A 105 105 SER HA H 105 5.300 5.077 0.223 1 1 979 . 5 1 1 A 105 105 SER C C 105 173.600 173.234 0.366 1 1 980 . 5 1 1 A 105 105 SER CA C 105 57.450 57.444 0.006 1 1 981 . 5 1 1 A 105 105 SER CB C 105 65.600 66.757 -1.157 1 1 982 . 5 1 1 A 105 105 SER N N 105 119.220 121.640 -2.420 1 1 983 . 5 1 1 A 106 106 SER H H 106 8.350 9.085 -0.735 1 1 984 . 5 1 1 A 106 106 SER HA H 106 4.720 4.418 0.302 1 1 987 . 5 1 1 A 106 106 SER C C 106 176.930 174.649 2.281 1 1 988 . 5 1 1 A 106 106 SER CA C 106 58.170 59.106 -0.936 1 1 989 . 5 1 1 A 106 106 SER CB C 106 64.170 62.706 1.464 1 1 990 . 5 1 1 A 106 106 SER N N 106 114.800 119.916 -5.116 1 1 991 . 5 1 1 A 107 107 LEU H H 107 8.770 8.976 -0.206 1 1 992 . 5 1 1 A 107 107 LEU HA H 107 4.710 4.225 0.485 1 1 1001 . 5 1 1 A 107 107 LEU C C 107 178.280 178.739 -0.459 1 1 1002 . 5 1 1 A 107 107 LEU CA C 107 55.280 57.093 -1.813 1 1 1003 . 5 1 1 A 107 107 LEU CB C 107 43.410 41.974 1.436 1 1 1007 . 5 1 1 A 107 107 LEU N N 107 127.210 128.066 -0.856 1 1 1008 . 5 1 1 A 108 108 THR H H 108 8.210 7.772 0.438 1 1 1009 . 5 1 1 A 108 108 THR HA H 108 4.400 4.276 0.124 1 1 1015 . 5 1 1 A 108 108 THR C C 108 176.130 175.657 0.473 1 1 1016 . 5 1 1 A 108 108 THR CA C 108 62.050 63.209 -1.159 1 1 1017 . 5 1 1 A 108 108 THR CB C 108 70.910 70.355 0.555 1 1 1019 . 5 1 1 A 108 108 THR N N 108 108.810 110.831 -2.021 1 1 1020 . 5 1 1 A 109 109 GLY H H 109 8.250 7.684 0.566 1 1 1021 . 5 1 1 A 109 109 GLY HA2 H 109 3.780 4.046 -0.266 1 1 1022 . 5 1 1 A 109 109 GLY HA3 H 109 4.290 4.053 0.237 1 1 1023 . 5 1 1 A 109 109 GLY C C 109 173.180 174.344 -1.164 1 1 1024 . 5 1 1 A 109 109 GLY CA C 109 45.340 45.109 0.231 1 1 1025 . 5 1 1 A 109 109 GLY N N 109 110.160 110.711 -0.551 1 1 1026 . 5 1 1 A 110 110 GLU H H 110 7.960 7.501 0.459 1 1 1027 . 5 1 1 A 110 110 GLU HA H 110 4.760 4.585 0.175 1 1 1032 . 5 1 1 A 110 110 GLU CA C 110 53.450 53.793 -0.343 1 1 1033 . 5 1 1 A 110 110 GLU CB C 110 30.020 29.435 0.585 1 1 1035 . 5 1 1 A 110 110 GLU N N 110 119.720 121.036 -1.316 1 1 1036 . 5 1 1 A 111 111 PRO HA H 111 3.250 4.041 -0.791 1 1 1043 . 5 1 1 A 111 111 PRO C C 111 176.710 176.802 -0.092 1 1 1044 . 5 1 1 A 111 111 PRO CA C 111 62.240 62.097 0.143 1 1 1045 . 5 1 1 A 111 111 PRO CB C 111 31.990 30.838 1.152 1 1 1048 . 5 1 1 A 112 112 LEU H H 112 8.840 8.008 0.832 1 1 1049 . 5 1 1 A 112 112 LEU HA H 112 4.290 4.288 0.002 1 1 1059 . 5 1 1 A 112 112 LEU CA C 112 52.220 53.399 -1.179 1 1 1060 . 5 1 1 A 112 112 LEU CB C 112 41.090 42.207 -1.117 1 1 1063 . 5 1 1 A 112 112 LEU N N 112 122.420 119.645 2.775 1 1 1064 . 5 1 1 A 113 113 PRO HA H 113 4.380 4.769 -0.389 1 1 1071 . 5 1 1 A 113 113 PRO C C 113 176.100 176.470 -0.370 1 1 1072 . 5 1 1 A 113 113 PRO CA C 113 61.930 62.179 -0.249 1 1 1073 . 5 1 1 A 113 113 PRO CB C 113 32.470 32.455 0.015 1 1 1076 . 5 1 1 A 114 114 ALA H H 114 8.070 8.210 -0.140 1 1 1077 . 5 1 1 A 114 114 ALA HA H 114 4.550 4.453 0.097 1 1 1081 . 5 1 1 A 114 114 ALA C C 114 177.490 177.167 0.323 1 1 1082 . 5 1 1 A 114 114 ALA CA C 114 51.340 51.558 -0.218 1 1 1083 . 5 1 1 A 114 114 ALA CB C 114 19.940 20.574 -0.634 1 1 1084 . 5 1 1 A 114 114 ALA N N 114 121.460 123.527 -2.067 1 1 1085 . 5 1 1 A 115 115 LYS H H 115 9.000 8.398 0.602 1 1 1086 . 5 1 1 A 115 115 LYS HA H 115 3.930 3.810 0.120 1 1 1095 . 5 1 1 A 115 115 LYS C C 115 175.740 175.058 0.682 1 1 1096 . 5 1 1 A 115 115 LYS CA C 115 57.580 57.439 0.141 1 1 1097 . 5 1 1 A 115 115 LYS CB C 115 29.510 30.173 -0.663 1 1 1101 . 5 1 1 A 115 115 LYS N N 115 112.560 115.783 -3.223 1 1 1102 . 5 1 1 A 116 116 GLU H H 116 7.620 7.648 -0.028 1 1 1103 . 5 1 1 A 116 116 GLU HA H 116 4.550 4.567 -0.017 1 1 1108 . 5 1 1 A 116 116 GLU C C 116 176.110 174.370 1.740 1 1 1109 . 5 1 1 A 116 116 GLU CA C 116 54.570 55.519 -0.949 1 1 1110 . 5 1 1 A 116 116 GLU CB C 116 33.680 33.329 0.351 1 1 1112 . 5 1 1 A 116 116 GLU N N 116 115.710 117.570 -1.860 1 1 1113 . 5 1 1 A 117 117 VAL H H 117 8.770 8.754 0.016 1 1 1114 . 5 1 1 A 117 117 VAL HA H 117 3.200 3.969 -0.769 1 1 1122 . 5 1 1 A 117 117 VAL C C 117 175.740 175.850 -0.110 1 1 1123 . 5 1 1 A 117 117 VAL CA C 117 65.340 63.588 1.752 1 1 1124 . 5 1 1 A 117 117 VAL CB C 117 31.290 30.919 0.371 1 1 1127 . 5 1 1 A 117 117 VAL N N 117 124.450 126.128 -1.678 1 1 1128 . 5 1 1 A 118 118 LEU H H 118 8.550 8.888 -0.338 1 1 1129 . 5 1 1 A 118 118 LEU HA H 118 4.540 4.343 0.197 1 1 1139 . 5 1 1 A 118 118 LEU C C 118 176.210 176.492 -0.282 1 1 1140 . 5 1 1 A 118 118 LEU CA C 118 55.510 55.814 -0.304 1 1 1141 . 5 1 1 A 118 118 LEU CB C 118 44.600 42.958 1.642 1 1 1145 . 5 1 1 A 118 118 LEU N N 118 128.440 129.894 -1.454 1 1 1146 . 5 1 1 A 119 119 ALA H H 119 7.970 7.489 0.481 1 1 1147 . 5 1 1 A 119 119 ALA HA H 119 4.740 4.772 -0.032 1 1 1151 . 5 1 1 A 119 119 ALA C C 119 174.570 175.395 -0.825 1 1 1152 . 5 1 1 A 119 119 ALA CA C 119 50.770 51.757 -0.987 1 1 1153 . 5 1 1 A 119 119 ALA CB C 119 22.450 22.218 0.232 1 1 1154 . 5 1 1 A 119 119 ALA N N 119 118.100 118.279 -0.179 1 1 1155 . 5 1 1 A 120 120 LYS H H 120 8.760 9.042 -0.282 1 1 1156 . 5 1 1 A 120 120 LYS HA H 120 5.240 5.505 -0.265 1 1 1165 . 5 1 1 A 120 120 LYS C C 120 175.340 175.201 0.139 1 1 1166 . 5 1 1 A 120 120 LYS CA C 120 54.220 54.606 -0.386 1 1 1167 . 5 1 1 A 120 120 LYS CB C 120 34.340 35.893 -1.553 1 1 1171 . 5 1 1 A 120 120 LYS N N 120 120.010 118.939 1.071 1 1 1172 . 5 1 1 A 121 121 VAL H H 121 9.410 8.297 1.113 1 1 1173 . 5 1 1 A 121 121 VAL HA H 121 4.230 4.974 -0.744 1 1 1181 . 5 1 1 A 121 121 VAL C C 121 173.980 174.719 -0.739 1 1 1182 . 5 1 1 A 121 121 VAL CA C 121 62.370 60.952 1.418 1 1 1183 . 5 1 1 A 121 121 VAL CB C 121 32.410 34.859 -2.449 1 1 1186 . 5 1 1 A 121 121 VAL N N 121 124.960 122.304 2.656 1 1 1187 . 5 1 1 A 122 122 VAL H H 122 9.280 9.131 0.149 1 1 1188 . 5 1 1 A 122 122 VAL HA H 122 4.360 4.838 -0.478 1 1 1196 . 5 1 1 A 122 122 VAL C C 122 174.190 174.866 -0.676 1 1 1197 . 5 1 1 A 122 122 VAL CA C 122 62.760 61.464 1.296 1 1 1198 . 5 1 1 A 122 122 VAL CB C 122 32.020 32.791 -0.771 1 1 1201 . 5 1 1 A 122 122 VAL N N 122 128.990 126.829 2.161 1 1 1202 . 5 1 1 A 123 123 LEU H H 123 8.610 8.762 -0.152 1 1 1203 . 5 1 1 A 123 123 LEU HA H 123 4.900 4.568 0.332 1 1 1213 . 5 1 1 A 123 123 LEU C C 123 174.950 175.971 -1.021 1 1 1214 . 5 1 1 A 123 123 LEU CA C 123 52.050 53.796 -1.746 1 1 1215 . 5 1 1 A 123 123 LEU CB C 123 45.210 41.279 3.931 1 1 1219 . 5 1 1 A 123 123 LEU N N 123 127.200 128.460 -1.260 1 1 1220 . 5 1 1 A 124 124 ARG H H 124 9.540 9.065 0.475 1 1 1221 . 5 1 1 A 124 124 ARG HA H 124 4.900 4.438 0.462 1 1 1229 . 5 1 1 A 124 124 ARG C C 124 176.320 175.758 0.562 1 1 1230 . 5 1 1 A 124 124 ARG CA C 124 55.320 56.826 -1.506 1 1 1231 . 5 1 1 A 124 124 ARG CB C 124 31.750 30.332 1.418 1 1 1234 . 5 1 1 A 124 124 ARG N N 124 124.290 125.956 -1.666 1 1 1236 . 5 1 1 A 125 125 ALA H H 125 8.880 8.578 0.302 1 1 1237 . 5 1 1 A 125 125 ALA HA H 125 4.380 4.078 0.302 1 1 1241 . 5 1 1 A 125 125 ALA C C 125 177.290 177.671 -0.381 1 1 1242 . 5 1 1 A 125 125 ALA CA C 125 52.530 51.424 1.106 1 1 1243 . 5 1 1 A 125 125 ALA CB C 125 19.870 17.411 2.459 1 1 1244 . 5 1 1 A 125 125 ALA N N 125 130.790 129.274 1.516 1 1 1245 . 5 1 1 A 126 126 GLU H H 126 9.260 8.734 0.526 1 1 1246 . 5 1 1 A 126 126 GLU HA H 126 4.460 4.366 0.094 1 1 1251 . 5 1 1 A 126 126 GLU C C 126 176.120 176.039 0.081 1 1 1252 . 5 1 1 A 126 126 GLU CA C 126 56.940 57.140 -0.200 1 1 1253 . 5 1 1 A 126 126 GLU CB C 126 32.450 30.123 2.327 1 1 1255 . 5 1 1 A 126 126 GLU N N 126 125.740 123.562 2.178 1 1 1256 . 5 1 1 A 127 127 ALA H H 127 7.460 7.503 -0.043 1 1 1257 . 5 1 1 A 127 127 ALA HA H 127 4.360 4.602 -0.242 1 1 1261 . 5 1 1 A 127 127 ALA C C 127 173.400 175.810 -2.410 1 1 1262 . 5 1 1 A 127 127 ALA CA C 127 51.360 51.688 -0.328 1 1 1263 . 5 1 1 A 127 127 ALA CB C 127 22.180 21.878 0.302 1 1 1264 . 5 1 1 A 127 127 ALA N N 127 120.910 119.627 1.283 1 1 1265 . 5 1 1 A 128 128 LYS H H 128 7.940 8.718 -0.778 1 1 1266 . 5 1 1 A 128 128 LYS HA H 128 3.580 4.110 -0.530 1 1 1275 . 5 1 1 A 128 128 LYS C C 128 176.080 175.763 0.317 1 1 1276 . 5 1 1 A 128 128 LYS CA C 128 56.860 57.190 -0.330 1 1 1277 . 5 1 1 A 128 128 LYS CB C 128 33.170 33.071 0.099 1 1 1281 . 5 1 1 A 128 128 LYS N N 128 116.520 124.630 -8.110 1 1 1282 . 5 1 1 A 129 129 ALA H H 129 8.590 8.593 -0.003 1 1 1283 . 5 1 1 A 129 129 ALA HA H 129 4.390 4.668 -0.278 1 1 1287 . 5 1 1 A 129 129 ALA C C 129 174.970 176.400 -1.430 1 1 1288 . 5 1 1 A 129 129 ALA CA C 129 52.970 50.947 2.023 1 1 1289 . 5 1 1 A 129 129 ALA CB C 129 21.500 19.315 2.185 1 1 1290 . 5 1 1 A 129 129 ALA N N 129 124.710 128.634 -3.924 1 1 1291 . 5 1 1 A 130 130 GLU H H 130 8.660 8.221 0.439 1 1 1292 . 5 1 1 A 130 130 GLU HA H 130 4.660 3.931 0.729 1 1 1297 . 5 1 1 A 130 130 GLU C C 130 177.390 177.701 -0.311 1 1 1298 . 5 1 1 A 130 130 GLU CA C 130 55.070 58.516 -3.446 1 1 1299 . 5 1 1 A 130 130 GLU CB C 130 30.860 29.223 1.637 1 1 1301 . 5 1 1 A 130 130 GLU N N 130 123.180 122.917 0.263 1 1 1302 . 5 1 1 A 131 131 GLY H H 131 9.170 9.057 0.113 1 1 1303 . 5 1 1 A 131 131 GLY HA2 H 131 3.560 3.989 -0.429 1 1 1304 . 5 1 1 A 131 131 GLY HA3 H 131 3.750 3.997 -0.247 1 1 1305 . 5 1 1 A 131 131 GLY C C 131 174.550 174.597 -0.047 1 1 1306 . 5 1 1 A 131 131 GLY CA C 131 47.660 45.832 1.828 1 1 1307 . 5 1 1 A 131 131 GLY N N 131 115.530 116.045 -0.515 1 1 1308 . 5 1 1 A 132 132 SER H H 132 8.430 8.169 0.261 1 1 1309 . 5 1 1 A 132 132 SER HA H 132 4.170 4.646 -0.476 1 1 1312 . 5 1 1 A 132 132 SER C C 132 175.350 174.202 1.148 1 1 1313 . 5 1 1 A 132 132 SER CA C 132 59.050 57.547 1.503 1 1 1314 . 5 1 1 A 132 132 SER CB C 132 64.880 61.938 2.942 1 1 1315 . 5 1 1 A 132 132 SER N N 132 115.930 118.789 -2.859 1 1 1316 . 5 1 1 A 133 133 ASN H H 133 8.850 9.083 -0.233 1 1 1317 . 5 1 1 A 133 133 ASN HA H 133 4.910 5.099 -0.189 1 1 1322 . 5 1 1 A 133 133 ASN C C 133 175.450 174.889 0.561 1 1 1323 . 5 1 1 A 133 133 ASN CA C 133 54.920 53.985 0.935 1 1 1324 . 5 1 1 A 133 133 ASN CB C 133 41.060 39.041 2.019 1 1 1325 . 5 1 1 A 133 133 ASN N N 133 125.590 122.749 2.841 1 1 1327 . 5 1 1 A 134 134 LEU H H 134 9.070 9.490 -0.420 1 1 1328 . 5 1 1 A 134 134 LEU HA H 134 5.230 5.150 0.080 1 1 1338 . 5 1 1 A 134 134 LEU C C 134 175.240 175.929 -0.689 1 1 1339 . 5 1 1 A 134 134 LEU CA C 134 53.470 53.367 0.103 1 1 1340 . 5 1 1 A 134 134 LEU CB C 134 45.090 45.322 -0.232 1 1 1344 . 5 1 1 A 134 134 LEU N N 134 129.210 126.704 2.506 1 1 1345 . 5 1 1 A 135 135 SER H H 135 8.690 8.381 0.309 1 1 1346 . 5 1 1 A 135 135 SER HA H 135 5.280 5.259 0.021 1 1 1349 . 5 1 1 A 135 135 SER C C 135 173.590 171.989 1.601 1 1 1350 . 5 1 1 A 135 135 SER CA C 135 56.220 56.975 -0.755 1 1 1351 . 5 1 1 A 135 135 SER CB C 135 66.510 65.687 0.823 1 1 1352 . 5 1 1 A 135 135 SER N N 135 113.020 117.286 -4.266 1 1 1353 . 5 1 1 A 136 136 VAL H H 136 8.940 8.704 0.236 1 1 1354 . 5 1 1 A 136 136 VAL HA H 136 5.500 4.734 0.766 1 1 1362 . 5 1 1 A 136 136 VAL C C 136 175.730 175.401 0.329 1 1 1363 . 5 1 1 A 136 136 VAL CA C 136 60.960 61.259 -0.299 1 1 1364 . 5 1 1 A 136 136 VAL CB C 136 33.630 32.836 0.794 1 1 1367 . 5 1 1 A 136 136 VAL N N 136 124.340 126.179 -1.839 1 1 1368 . 5 1 1 A 137 137 THR H H 137 9.240 8.543 0.697 1 1 1369 . 5 1 1 A 137 137 THR HA H 137 4.920 4.768 0.152 1 1 1374 . 5 1 1 A 137 137 THR C C 137 173.500 174.113 -0.613 1 1 1375 . 5 1 1 A 137 137 THR CA C 137 59.120 60.271 -1.151 1 1 1376 . 5 1 1 A 137 137 THR CB C 137 72.500 70.695 1.805 1 1 1378 . 5 1 1 A 137 137 THR N N 137 117.010 119.458 -2.448 1 1 1379 . 5 1 1 A 138 138 ASN H H 138 9.190 8.829 0.361 1 1 1380 . 5 1 1 A 138 138 ASN HA H 138 4.420 4.312 0.108 1 1 1385 . 5 1 1 A 138 138 ASN C C 138 175.550 174.258 1.292 1 1 1386 . 5 1 1 A 138 138 ASN CA C 138 54.350 54.240 0.110 1 1 1387 . 5 1 1 A 138 138 ASN CB C 138 37.380 36.672 0.708 1 1 1388 . 5 1 1 A 138 138 ASN N N 138 115.270 118.257 -2.987 1 1 1390 . 5 1 1 A 139 139 SER H H 139 8.560 7.888 0.672 1 1 1391 . 5 1 1 A 139 139 SER HA H 139 5.800 4.331 1.469 1 1 1394 . 5 1 1 A 139 139 SER C C 139 175.750 173.426 2.324 1 1 1395 . 5 1 1 A 139 139 SER CA C 139 56.020 58.400 -2.380 1 1 1396 . 5 1 1 A 139 139 SER CB C 139 65.320 61.699 3.621 1 1 1397 . 5 1 1 A 139 139 SER N N 139 112.360 115.988 -3.628 1 1 1398 . 5 1 1 A 140 140 SER H H 140 9.900 8.222 1.678 1 1 1399 . 5 1 1 A 140 140 SER HA H 140 5.360 5.298 0.062 1 1 1402 . 5 1 1 A 140 140 SER C C 140 172.620 173.737 -1.117 1 1 1403 . 5 1 1 A 140 140 SER CA C 140 57.400 55.775 1.625 1 1 1404 . 5 1 1 A 140 140 SER CB C 140 66.550 66.056 0.494 1 1 1405 . 5 1 1 A 140 140 SER N N 140 119.130 119.430 -0.300 1 1 1406 . 5 1 1 A 141 141 VAL H H 141 9.030 8.765 0.265 1 1 1407 . 5 1 1 A 141 141 VAL HA H 141 5.520 4.844 0.676 1 1 1415 . 5 1 1 A 141 141 VAL C C 141 174.750 175.022 -0.272 1 1 1416 . 5 1 1 A 141 141 VAL CA C 141 58.310 59.829 -1.519 1 1 1417 . 5 1 1 A 141 141 VAL CB C 141 35.030 35.155 -0.125 1 1 1420 . 5 1 1 A 141 141 VAL N N 141 111.410 115.539 -4.129 1 1 1421 . 5 1 1 A 142 142 GLY H H 142 8.790 9.134 -0.344 1 1 1422 . 5 1 1 A 142 142 GLY HA2 H 142 3.600 3.925 -0.325 1 1 1423 . 5 1 1 A 142 142 GLY HA3 H 142 5.310 3.949 1.361 1 1 1424 . 5 1 1 A 142 142 GLY C C 142 174.180 173.226 0.954 1 1 1425 . 5 1 1 A 142 142 GLY CA C 142 44.110 46.764 -2.654 1 1 1426 . 5 1 1 A 142 142 GLY N N 142 109.330 111.239 -1.909 1 1 1427 . 5 1 1 A 143 143 ASP H H 143 8.840 8.588 0.252 1 1 1428 . 5 1 1 A 143 143 ASP HA H 143 5.790 5.105 0.685 1 1 1431 . 5 1 1 A 143 143 ASP C C 143 178.860 177.814 1.046 1 1 1432 . 5 1 1 A 143 143 ASP CA C 143 53.040 54.938 -1.898 1 1 1433 . 5 1 1 A 143 143 ASP CB C 143 43.660 42.733 0.927 1 1 1434 . 5 1 1 A 143 143 ASP N N 143 125.390 126.048 -0.658 1 1 1435 . 5 1 1 A 144 144 GLY H H 144 9.150 8.156 0.994 1 1 1436 . 5 1 1 A 144 144 GLY HA2 H 144 3.450 3.310 0.140 1 1 1437 . 5 1 1 A 144 144 GLY HA3 H 144 3.720 3.379 0.341 1 1 1438 . 5 1 1 A 144 144 GLY C C 144 174.770 175.405 -0.635 1 1 1439 . 5 1 1 A 144 144 GLY CA C 144 46.930 47.005 -0.075 1 1 1440 . 5 1 1 A 144 144 GLY N N 144 106.470 110.735 -4.265 1 1 1441 . 5 1 1 A 145 145 GLU H H 145 8.470 7.750 0.720 1 1 1442 . 5 1 1 A 145 145 GLU HA H 145 4.460 4.217 0.243 1 1 1447 . 5 1 1 A 145 145 GLU C C 145 176.520 176.374 0.146 1 1 1448 . 5 1 1 A 145 145 GLU CA C 145 55.330 56.847 -1.517 1 1 1449 . 5 1 1 A 145 145 GLU CB C 145 30.620 29.913 0.707 1 1 1451 . 5 1 1 A 145 145 GLU N N 145 119.170 119.609 -0.439 1 1 1452 . 5 1 1 A 146 146 GLY H H 146 7.950 7.752 0.198 1 1 1453 . 5 1 1 A 146 146 GLY HA2 H 146 3.630 3.995 -0.365 1 1 1454 . 5 1 1 A 146 146 GLY HA3 H 146 4.130 4.001 0.129 1 1 1455 . 5 1 1 A 146 146 GLY C C 146 174.350 173.868 0.482 1 1 1456 . 5 1 1 A 146 146 GLY CA C 146 45.330 44.873 0.457 1 1 1457 . 5 1 1 A 146 146 GLY N N 146 108.130 106.525 1.605 1 1 1458 . 5 1 1 A 147 147 LEU H H 147 8.440 7.919 0.521 1 1 1459 . 5 1 1 A 147 147 LEU HA H 147 4.340 4.338 0.002 1 1 1469 . 5 1 1 A 147 147 LEU C C 147 175.950 175.269 0.681 1 1 1470 . 5 1 1 A 147 147 LEU CA C 147 54.860 54.041 0.819 1 1 1471 . 5 1 1 A 147 147 LEU CB C 147 41.590 42.980 -1.390 1 1 1475 . 5 1 1 A 147 147 LEU N N 147 124.000 122.898 1.102 1 1 1476 . 5 1 1 A 148 148 VAL H H 148 7.780 8.575 -0.795 1 1 1477 . 5 1 1 A 148 148 VAL HA H 148 4.830 4.331 0.499 1 1 1485 . 5 1 1 A 148 148 VAL C C 148 175.740 174.488 1.252 1 1 1486 . 5 1 1 A 148 148 VAL CA C 148 61.140 62.697 -1.557 1 1 1487 . 5 1 1 A 148 148 VAL CB C 148 33.640 32.661 0.979 1 1 1490 . 5 1 1 A 148 148 VAL N N 148 120.440 127.029 -6.589 1 1 1491 . 5 1 1 A 149 149 HIS H H 149 9.170 8.869 0.301 1 1 1492 . 5 1 1 A 149 149 HIS HA H 149 4.950 4.936 0.014 1 1 1496 . 5 1 1 A 149 149 HIS C C 149 174.780 174.425 0.355 1 1 1497 . 5 1 1 A 149 149 HIS CA C 149 53.900 54.431 -0.531 1 1 1498 . 5 1 1 A 149 149 HIS CB C 149 32.200 29.817 2.383 1 1 1499 . 5 1 1 A 149 149 HIS N N 149 124.700 127.117 -2.417 1 1 1500 . 5 1 1 A 150 150 GLU H H 150 9.060 8.704 0.356 1 1 1501 . 5 1 1 A 150 150 GLU HA H 150 4.420 4.224 0.196 1 1 1506 . 5 1 1 A 150 150 GLU C C 150 176.520 176.072 0.448 1 1 1507 . 5 1 1 A 150 150 GLU CA C 150 57.630 57.375 0.255 1 1 1508 . 5 1 1 A 150 150 GLU CB C 150 30.370 30.041 0.329 1 1 1510 . 5 1 1 A 150 150 GLU N N 150 125.540 125.102 0.438 1 1 1511 . 5 1 1 A 151 151 ILE H H 151 8.150 7.778 0.372 1 1 1512 . 5 1 1 A 151 151 ILE HA H 151 4.780 4.471 0.309 1 1 1522 . 5 1 1 A 151 151 ILE C C 151 174.570 176.286 -1.716 1 1 1523 . 5 1 1 A 151 151 ILE CA C 151 59.390 59.539 -0.149 1 1 1524 . 5 1 1 A 151 151 ILE CB C 151 42.040 39.228 2.812 1 1 1528 . 5 1 1 A 151 151 ILE N N 151 115.880 123.067 -7.187 1 1 1529 . 5 1 1 A 152 152 ALA H H 152 8.010 8.347 -0.337 1 1 1530 . 5 1 1 A 152 152 ALA HA H 152 4.310 4.432 -0.122 1 1 1534 . 5 1 1 A 152 152 ALA C C 152 177.500 176.827 0.673 1 1 1535 . 5 1 1 A 152 152 ALA CA C 152 53.680 51.738 1.942 1 1 1536 . 5 1 1 A 152 152 ALA CB C 152 20.050 19.913 0.137 1 1 1537 . 5 1 1 A 152 152 ALA N N 152 126.640 124.129 2.511 1 1 1538 . 5 1 1 A 153 153 GLY H H 153 8.340 8.379 -0.039 1 1 1539 . 5 1 1 A 153 153 GLY HA2 H 153 4.050 4.337 -0.287 1 1 1540 . 5 1 1 A 153 153 GLY HA3 H 153 4.140 4.341 -0.201 1 1 1541 . 5 1 1 A 153 153 GLY C C 153 173.140 171.798 1.342 1 1 1542 . 5 1 1 A 153 153 GLY CA C 153 44.130 45.624 -1.494 1 1 1543 . 5 1 1 A 153 153 GLY N N 153 107.490 105.416 2.074 1 1 1544 . 5 1 1 A 154 154 THR H H 154 7.380 8.462 -1.082 1 1 1545 . 5 1 1 A 154 154 THR HA H 154 4.700 5.060 -0.360 1 1 1550 . 5 1 1 A 154 154 THR C C 154 171.120 173.952 -2.832 1 1 1551 . 5 1 1 A 154 154 THR CA C 154 60.830 61.130 -0.300 1 1 1552 . 5 1 1 A 154 154 THR CB C 154 68.850 72.442 -3.592 1 1 1554 . 5 1 1 A 154 154 THR N N 154 109.340 114.252 -4.912 1 1 1555 . 5 1 1 A 155 155 GLU H H 155 8.020 8.697 -0.677 1 1 1556 . 5 1 1 A 155 155 GLU HA H 155 5.370 5.420 -0.050 1 1 1561 . 5 1 1 A 155 155 GLU C C 155 174.240 174.550 -0.310 1 1 1562 . 5 1 1 A 155 155 GLU CA C 155 54.830 54.755 0.075 1 1 1563 . 5 1 1 A 155 155 GLU CB C 155 33.620 32.997 0.623 1 1 1565 . 5 1 1 A 155 155 GLU N N 155 118.690 122.692 -4.002 1 1 1566 . 5 1 1 A 156 156 LYS H H 156 9.230 9.209 0.021 1 1 1567 . 5 1 1 A 156 156 LYS HA H 156 4.650 5.010 -0.360 1 1 1576 . 5 1 1 A 156 156 LYS C C 156 174.000 174.551 -0.551 1 1 1577 . 5 1 1 A 156 156 LYS CA C 156 55.840 55.163 0.677 1 1 1578 . 5 1 1 A 156 156 LYS CB C 156 37.550 36.528 1.022 1 1 1582 . 5 1 1 A 156 156 LYS N N 156 121.940 120.969 0.971 1 1 1583 . 5 1 1 A 157 157 THR H H 157 8.160 8.680 -0.520 1 1 1584 . 5 1 1 A 157 157 THR HA H 157 5.440 5.145 0.295 1 1 1589 . 5 1 1 A 157 157 THR C C 157 174.360 173.547 0.813 1 1 1590 . 5 1 1 A 157 157 THR CA C 157 60.410 60.720 -0.310 1 1 1591 . 5 1 1 A 157 157 THR CB C 157 71.500 71.178 0.322 1 1 1593 . 5 1 1 A 157 157 THR N N 157 113.240 112.911 0.329 1 1 1594 . 5 1 1 A 158 158 VAL H H 158 9.120 9.095 0.025 1 1 1595 . 5 1 1 A 158 158 VAL HA H 158 4.580 5.016 -0.436 1 1 1603 . 5 1 1 A 158 158 VAL C C 158 172.800 174.857 -2.057 1 1 1604 . 5 1 1 A 158 158 VAL CA C 158 59.980 60.299 -0.319 1 1 1605 . 5 1 1 A 158 158 VAL CB C 158 36.290 34.232 2.058 1 1 1608 . 5 1 1 A 158 158 VAL N N 158 121.710 122.102 -0.392 1 1 1609 . 5 1 1 A 159 159 ASN H H 159 8.240 8.605 -0.365 1 1 1610 . 5 1 1 A 159 159 ASN HA H 159 5.420 5.021 0.399 1 1 1615 . 5 1 1 A 159 159 ASN C C 159 173.800 174.031 -0.231 1 1 1616 . 5 1 1 A 159 159 ASN CA C 159 51.740 52.408 -0.668 1 1 1617 . 5 1 1 A 159 159 ASN CB C 159 40.380 39.203 1.177 1 1 1618 . 5 1 1 A 159 159 ASN N N 159 122.730 124.193 -1.463 1 1 1620 . 5 1 1 A 160 160 ILE H H 160 9.160 8.605 0.555 1 1 1621 . 5 1 1 A 160 160 ILE HA H 160 5.130 4.875 0.255 1 1 1631 . 5 1 1 A 160 160 ILE C C 160 177.320 175.607 1.713 1 1 1632 . 5 1 1 A 160 160 ILE CA C 160 60.640 61.014 -0.374 1 1 1633 . 5 1 1 A 160 160 ILE CB C 160 38.520 37.611 0.909 1 1 1637 . 5 1 1 A 160 160 ILE N N 160 123.690 125.849 -2.159 1 1 1638 . 5 1 1 A 161 161 ILE H H 161 8.780 9.080 -0.300 1 1 1639 . 5 1 1 A 161 161 ILE HA H 161 4.590 4.531 0.059 1 1 1649 . 5 1 1 A 161 161 ILE C C 161 174.960 175.746 -0.786 1 1 1650 . 5 1 1 A 161 161 ILE CA C 161 59.320 60.293 -0.973 1 1 1651 . 5 1 1 A 161 161 ILE CB C 161 41.030 39.762 1.268 1 1 1655 . 5 1 1 A 161 161 ILE N N 161 122.490 129.335 -6.845 1 1 1656 . 5 1 1 A 162 162 GLU H H 162 8.620 8.450 0.170 1 1 1657 . 5 1 1 A 162 162 GLU HA H 162 4.290 4.310 -0.020 1 1 1662 . 5 1 1 A 162 162 GLU C C 162 176.660 177.074 -0.414 1 1 1663 . 5 1 1 A 162 162 GLU CA C 162 56.470 57.429 -0.959 1 1 1664 . 5 1 1 A 162 162 GLU CB C 162 31.150 30.490 0.660 1 1 1666 . 5 1 1 A 162 162 GLU N N 162 120.520 126.668 -6.148 1 1 1667 . 5 1 1 A 163 163 GLY H H 163 8.480 8.336 0.144 1 1 1668 . 5 1 1 A 163 163 GLY HA2 H 163 3.910 4.118 -0.208 1 1 1669 . 5 1 1 A 163 163 GLY HA3 H 163 4.150 4.119 0.031 1 1 1670 . 5 1 1 A 163 163 GLY C C 163 174.000 173.627 0.373 1 1 1671 . 5 1 1 A 163 163 GLY CA C 163 45.270 44.299 0.971 1 1 1672 . 5 1 1 A 163 163 GLY N N 163 110.210 110.464 -0.254 1 1 1673 . 5 1 1 A 164 164 THR H H 164 8.170 8.490 -0.320 1 1 1674 . 5 1 1 A 164 164 THR HA H 164 4.410 4.435 -0.025 1 1 1679 . 5 1 1 A 164 164 THR C C 164 174.100 174.550 -0.450 1 1 1680 . 5 1 1 A 164 164 THR CA C 164 61.620 62.030 -0.410 1 1 1681 . 5 1 1 A 164 164 THR CB C 164 70.060 69.559 0.501 1 1 1683 . 5 1 1 A 164 164 THR N N 164 113.480 116.335 -2.855 1 1 1 . 6 1 1 A 13 13 GLY H H 13 8.350 8.350 0.000 1 1 2 . 6 1 1 A 13 13 GLY HA2 H 13 3.920 4.187 -0.267 1 1 3 . 6 1 1 A 13 13 GLY HA3 H 13 3.920 4.191 -0.271 1 1 4 . 6 1 1 A 13 13 GLY CA C 13 45.290 46.013 -0.723 1 1 5 . 6 1 1 A 13 13 GLY N N 13 110.450 109.258 1.192 1 1 6 . 6 1 1 A 14 14 LEU H H 14 8.050 8.508 -0.458 1 1 7 . 6 1 1 A 14 14 LEU N N 14 121.500 121.710 -0.210 1 1 8 . 6 1 1 A 15 15 VAL H H 15 8.070 7.868 0.202 1 1 9 . 6 1 1 A 15 15 VAL N N 15 122.390 119.130 3.260 1 1 10 . 6 1 1 A 16 16 PRO HA H 16 4.360 4.335 0.025 1 1 17 . 6 1 1 A 16 16 PRO CA C 16 62.770 65.276 -2.506 1 1 18 . 6 1 1 A 16 16 PRO CB C 16 32.020 31.730 0.290 1 1 21 . 6 1 1 A 21 21 MET H H 21 8.180 8.657 -0.477 1 1 22 . 6 1 1 A 21 21 MET N N 21 121.310 119.172 2.138 1 1 23 . 6 1 1 A 22 22 ALA H H 22 8.290 8.751 -0.461 1 1 24 . 6 1 1 A 22 22 ALA N N 22 124.800 126.700 -1.900 1 1 25 . 6 1 1 A 23 23 SER H H 23 8.210 8.808 -0.598 1 1 26 . 6 1 1 A 23 23 SER N N 23 114.830 122.267 -7.437 1 1 27 . 6 1 1 A 24 24 LYS H H 24 8.250 8.598 -0.348 1 1 28 . 6 1 1 A 24 24 LYS N N 24 122.980 120.418 2.562 1 1 29 . 6 1 1 A 25 25 LEU H H 25 8.140 8.518 -0.378 1 1 30 . 6 1 1 A 25 25 LEU HA H 25 4.290 4.790 -0.500 1 1 40 . 6 1 1 A 25 25 LEU C C 25 177.410 175.536 1.874 1 1 41 . 6 1 1 A 25 25 LEU CA C 25 55.430 53.609 1.821 1 1 42 . 6 1 1 A 25 25 LEU CB C 25 42.350 44.957 -2.607 1 1 46 . 6 1 1 A 25 25 LEU N N 25 122.580 119.295 3.285 1 1 47 . 6 1 1 A 26 26 LYS H H 26 8.200 8.632 -0.432 1 1 48 . 6 1 1 A 26 26 LYS HA H 26 4.260 3.826 0.434 1 1 57 . 6 1 1 A 26 26 LYS C C 26 176.520 175.719 0.801 1 1 58 . 6 1 1 A 26 26 LYS CA C 26 56.700 57.038 -0.338 1 1 59 . 6 1 1 A 26 26 LYS CB C 26 33.060 30.868 2.192 1 1 63 . 6 1 1 A 26 26 LYS N N 26 121.800 117.710 4.090 1 1 64 . 6 1 1 A 27 27 GLU H H 27 8.380 8.319 0.061 1 1 65 . 6 1 1 A 27 27 GLU HA H 27 4.240 4.464 -0.224 1 1 70 . 6 1 1 A 27 27 GLU C C 27 176.130 175.970 0.160 1 1 71 . 6 1 1 A 27 27 GLU CA C 27 56.700 56.315 0.385 1 1 72 . 6 1 1 A 27 27 GLU CB C 27 30.370 31.013 -0.643 1 1 74 . 6 1 1 A 27 27 GLU N N 27 121.700 120.064 1.636 1 1 75 . 6 1 1 A 28 28 ALA H H 28 8.230 8.470 -0.240 1 1 76 . 6 1 1 A 28 28 ALA HA H 28 4.280 4.644 -0.364 1 1 80 . 6 1 1 A 28 28 ALA C C 28 177.090 175.975 1.115 1 1 81 . 6 1 1 A 28 28 ALA CA C 28 52.530 50.963 1.567 1 1 82 . 6 1 1 A 28 28 ALA CB C 28 19.360 19.305 0.055 1 1 83 . 6 1 1 A 28 28 ALA N N 28 124.640 122.644 1.996 1 1 84 . 6 1 1 A 29 29 ALA H H 29 8.150 7.899 0.251 1 1 85 . 6 1 1 A 29 29 ALA HA H 29 4.320 4.825 -0.505 1 1 89 . 6 1 1 A 29 29 ALA C C 29 177.120 175.734 1.386 1 1 90 . 6 1 1 A 29 29 ALA CA C 29 52.040 51.968 0.072 1 1 91 . 6 1 1 A 29 29 ALA CB C 29 19.430 18.856 0.574 1 1 92 . 6 1 1 A 29 29 ALA N N 29 123.430 122.669 0.761 1 1 93 . 6 1 1 A 30 30 GLU H H 30 8.310 8.825 -0.515 1 1 94 . 6 1 1 A 30 30 GLU HA H 30 4.220 4.941 -0.721 1 1 99 . 6 1 1 A 30 30 GLU C C 30 176.310 176.066 0.244 1 1 100 . 6 1 1 A 30 30 GLU CA C 30 56.630 55.056 1.574 1 1 101 . 6 1 1 A 30 30 GLU CB C 30 30.320 31.619 -1.299 1 1 103 . 6 1 1 A 30 30 GLU N N 30 120.630 122.562 -1.932 1 1 104 . 6 1 1 A 31 31 VAL H H 31 8.630 8.929 -0.299 1 1 105 . 6 1 1 A 31 31 VAL HA H 31 4.430 4.505 -0.075 1 1 113 . 6 1 1 A 31 31 VAL C C 31 176.510 176.230 0.280 1 1 114 . 6 1 1 A 31 31 VAL CA C 31 62.360 63.439 -1.079 1 1 115 . 6 1 1 A 31 31 VAL CB C 31 32.370 31.862 0.508 1 1 118 . 6 1 1 A 31 31 VAL N N 31 127.110 126.131 0.979 1 1 119 . 6 1 1 A 32 32 THR H H 32 7.640 8.724 -1.084 1 1 120 . 6 1 1 A 32 32 THR HA H 32 4.870 3.987 0.883 1 1 125 . 6 1 1 A 32 32 THR C C 32 172.220 174.787 -2.567 1 1 126 . 6 1 1 A 32 32 THR CA C 32 59.510 64.978 -5.468 1 1 127 . 6 1 1 A 32 32 THR CB C 32 71.630 69.979 1.651 1 1 129 . 6 1 1 A 32 32 THR N N 32 118.860 120.687 -1.827 1 1 130 . 6 1 1 A 33 33 GLY H H 33 8.350 7.971 0.379 1 1 131 . 6 1 1 A 33 33 GLY HA2 H 33 4.160 4.040 0.120 1 1 132 . 6 1 1 A 33 33 GLY HA3 H 33 4.250 4.053 0.197 1 1 133 . 6 1 1 A 33 33 GLY C C 33 172.820 173.265 -0.445 1 1 134 . 6 1 1 A 33 33 GLY CA C 33 46.680 44.879 1.801 1 1 135 . 6 1 1 A 33 33 GLY N N 33 106.720 108.720 -2.000 1 1 136 . 6 1 1 A 34 34 SER H H 34 8.810 8.608 0.202 1 1 137 . 6 1 1 A 34 34 SER HA H 34 5.390 5.148 0.242 1 1 140 . 6 1 1 A 34 34 SER C C 34 173.780 172.959 0.821 1 1 141 . 6 1 1 A 34 34 SER CA C 34 57.380 57.524 -0.144 1 1 142 . 6 1 1 A 34 34 SER CB C 34 65.730 67.190 -1.460 1 1 143 . 6 1 1 A 34 34 SER N N 34 112.690 119.151 -6.461 1 1 144 . 6 1 1 A 35 35 VAL H H 35 8.470 8.736 -0.266 1 1 145 . 6 1 1 A 35 35 VAL HA H 35 4.120 4.890 -0.770 1 1 153 . 6 1 1 A 35 35 VAL C C 35 174.750 174.690 0.060 1 1 154 . 6 1 1 A 35 35 VAL CA C 35 62.310 60.109 2.201 1 1 155 . 6 1 1 A 35 35 VAL CB C 35 34.550 33.427 1.123 1 1 158 . 6 1 1 A 35 35 VAL N N 35 123.150 120.843 2.307 1 1 159 . 6 1 1 A 36 36 SER H H 36 8.240 8.629 -0.389 1 1 160 . 6 1 1 A 36 36 SER HA H 36 4.690 4.976 -0.286 1 1 163 . 6 1 1 A 36 36 SER C C 36 171.860 172.449 -0.589 1 1 164 . 6 1 1 A 36 36 SER CA C 36 56.020 57.933 -1.913 1 1 165 . 6 1 1 A 36 36 SER CB C 36 66.050 63.543 2.507 1 1 166 . 6 1 1 A 36 36 SER N N 36 118.760 121.474 -2.714 1 1 167 . 6 1 1 A 37 37 LEU H H 37 8.310 9.026 -0.716 1 1 168 . 6 1 1 A 37 37 LEU HA H 37 4.870 5.020 -0.150 1 1 178 . 6 1 1 A 37 37 LEU C C 37 174.190 174.754 -0.564 1 1 179 . 6 1 1 A 37 37 LEU CA C 37 53.870 53.379 0.491 1 1 180 . 6 1 1 A 37 37 LEU CB C 37 47.000 44.507 2.493 1 1 184 . 6 1 1 A 37 37 LEU N N 37 124.790 129.563 -4.773 1 1 185 . 6 1 1 A 38 38 GLU H H 38 9.270 9.052 0.218 1 1 186 . 6 1 1 A 38 38 GLU HA H 38 4.650 5.206 -0.556 1 1 191 . 6 1 1 A 38 38 GLU C C 38 173.970 175.521 -1.551 1 1 192 . 6 1 1 A 38 38 GLU CA C 38 54.410 54.617 -0.207 1 1 193 . 6 1 1 A 38 38 GLU CB C 38 32.460 32.602 -0.142 1 1 195 . 6 1 1 A 38 38 GLU N N 38 126.550 128.343 -1.793 1 1 196 . 6 1 1 A 39 39 ALA H H 39 8.120 8.483 -0.363 1 1 197 . 6 1 1 A 39 39 ALA HA H 39 4.600 4.755 -0.155 1 1 201 . 6 1 1 A 39 39 ALA C C 39 175.930 177.358 -1.428 1 1 202 . 6 1 1 A 39 39 ALA CA C 39 51.570 51.240 0.330 1 1 203 . 6 1 1 A 39 39 ALA CB C 39 21.780 22.809 -1.029 1 1 204 . 6 1 1 A 39 39 ALA N N 39 124.410 128.399 -3.989 1 1 205 . 6 1 1 A 40 40 LEU H H 40 7.860 8.937 -1.077 1 1 206 . 6 1 1 A 40 40 LEU HA H 40 4.230 4.017 0.213 1 1 216 . 6 1 1 A 40 40 LEU C C 40 175.940 176.533 -0.593 1 1 217 . 6 1 1 A 40 40 LEU CA C 40 55.360 57.980 -2.620 1 1 218 . 6 1 1 A 40 40 LEU CB C 40 42.990 42.845 0.145 1 1 222 . 6 1 1 A 40 40 LEU N N 40 120.640 122.378 -1.738 1 1 223 . 6 1 1 A 41 41 GLU H H 41 8.210 7.888 0.322 1 1 224 . 6 1 1 A 41 41 GLU HA H 41 4.240 4.205 0.035 1 1 229 . 6 1 1 A 41 41 GLU C C 41 176.920 174.776 2.144 1 1 230 . 6 1 1 A 41 41 GLU CA C 41 58.090 57.767 0.323 1 1 231 . 6 1 1 A 41 41 GLU CB C 41 30.530 27.087 3.443 1 1 233 . 6 1 1 A 41 41 GLU N N 41 114.680 117.558 -2.878 1 1 234 . 6 1 1 A 42 42 GLU H H 42 7.490 7.709 -0.219 1 1 235 . 6 1 1 A 42 42 GLU HA H 42 5.680 4.789 0.891 1 1 240 . 6 1 1 A 42 42 GLU C C 42 173.790 174.063 -0.273 1 1 241 . 6 1 1 A 42 42 GLU CA C 42 54.360 56.168 -1.808 1 1 242 . 6 1 1 A 42 42 GLU CB C 42 33.850 33.323 0.527 1 1 244 . 6 1 1 A 42 42 GLU N N 42 116.670 118.421 -1.751 1 1 245 . 6 1 1 A 43 43 VAL H H 43 8.550 8.543 0.007 1 1 246 . 6 1 1 A 43 43 VAL HA H 43 4.550 5.038 -0.488 1 1 254 . 6 1 1 A 43 43 VAL C C 43 172.220 173.127 -0.907 1 1 255 . 6 1 1 A 43 43 VAL CA C 43 59.470 59.348 0.122 1 1 256 . 6 1 1 A 43 43 VAL CB C 43 35.470 36.055 -0.585 1 1 259 . 6 1 1 A 43 43 VAL N N 43 120.030 124.212 -4.182 1 1 260 . 6 1 1 A 44 44 GLN H H 44 8.470 8.858 -0.388 1 1 261 . 6 1 1 A 44 44 GLN HA H 44 4.890 4.872 0.018 1 1 268 . 6 1 1 A 44 44 GLN C C 44 176.130 174.919 1.211 1 1 269 . 6 1 1 A 44 44 GLN CA C 44 54.360 54.018 0.342 1 1 270 . 6 1 1 A 44 44 GLN CB C 44 30.610 32.433 -1.823 1 1 272 . 6 1 1 A 44 44 GLN N N 44 124.690 125.795 -1.105 1 1 274 . 6 1 1 A 45 45 VAL H H 45 8.130 8.628 -0.498 1 1 275 . 6 1 1 A 45 45 VAL HA H 45 3.030 4.005 -0.975 1 1 283 . 6 1 1 A 45 45 VAL C C 45 176.710 177.281 -0.571 1 1 284 . 6 1 1 A 45 45 VAL CA C 45 65.810 64.682 1.128 1 1 285 . 6 1 1 A 45 45 VAL CB C 45 31.960 31.439 0.521 1 1 288 . 6 1 1 A 45 45 VAL N N 45 120.450 126.831 -6.381 1 1 289 . 6 1 1 A 46 46 GLY H H 46 8.950 10.025 -1.075 1 1 290 . 6 1 1 A 46 46 GLY HA2 H 46 3.590 4.010 -0.420 1 1 291 . 6 1 1 A 46 46 GLY HA3 H 46 4.410 4.012 0.398 1 1 292 . 6 1 1 A 46 46 GLY C C 46 174.390 173.686 0.704 1 1 293 . 6 1 1 A 46 46 GLY CA C 46 44.730 44.845 -0.115 1 1 294 . 6 1 1 A 46 46 GLY N N 46 116.490 115.086 1.404 1 1 295 . 6 1 1 A 47 47 GLU H H 47 8.260 7.885 0.375 1 1 296 . 6 1 1 A 47 47 GLU HA H 47 4.460 4.686 -0.226 1 1 301 . 6 1 1 A 47 47 GLU C C 47 174.780 174.976 -0.196 1 1 302 . 6 1 1 A 47 47 GLU CA C 47 54.830 55.203 -0.373 1 1 303 . 6 1 1 A 47 47 GLU CB C 47 31.140 31.862 -0.722 1 1 305 . 6 1 1 A 47 47 GLU N N 47 120.520 121.424 -0.904 1 1 306 . 6 1 1 A 48 48 ASN H H 48 8.440 8.813 -0.373 1 1 307 . 6 1 1 A 48 48 ASN HA H 48 5.380 5.442 -0.062 1 1 312 . 6 1 1 A 48 48 ASN C C 48 174.770 174.013 0.757 1 1 313 . 6 1 1 A 48 48 ASN CA C 48 51.570 51.787 -0.217 1 1 314 . 6 1 1 A 48 48 ASN CB C 48 39.010 42.095 -3.085 1 1 315 . 6 1 1 A 48 48 ASN N N 48 117.180 120.063 -2.883 1 1 317 . 6 1 1 A 49 49 LEU H H 49 9.810 8.172 1.638 1 1 318 . 6 1 1 A 49 49 LEU HA H 49 4.510 4.682 -0.172 1 1 328 . 6 1 1 A 49 49 LEU C C 49 174.560 175.288 -0.728 1 1 329 . 6 1 1 A 49 49 LEU CA C 49 53.460 54.804 -1.344 1 1 330 . 6 1 1 A 49 49 LEU CB C 49 45.520 43.433 2.087 1 1 333 . 6 1 1 A 49 49 LEU N N 49 125.620 126.042 -0.422 1 1 334 . 6 1 1 A 50 50 GLU H H 50 8.750 8.682 0.068 1 1 335 . 6 1 1 A 50 50 GLU HA H 50 4.360 4.846 -0.486 1 1 340 . 6 1 1 A 50 50 GLU C C 50 175.340 174.752 0.588 1 1 341 . 6 1 1 A 50 50 GLU CA C 50 55.550 55.660 -0.110 1 1 342 . 6 1 1 A 50 50 GLU CB C 50 29.890 31.537 -1.647 1 1 344 . 6 1 1 A 50 50 GLU N N 50 125.420 124.948 0.472 1 1 345 . 6 1 1 A 51 51 VAL H H 51 9.230 8.462 0.768 1 1 346 . 6 1 1 A 51 51 VAL HA H 51 4.190 4.787 -0.597 1 1 354 . 6 1 1 A 51 51 VAL C C 51 175.310 174.741 0.569 1 1 355 . 6 1 1 A 51 51 VAL CA C 51 62.520 61.214 1.306 1 1 356 . 6 1 1 A 51 51 VAL CB C 51 31.470 33.638 -2.168 1 1 359 . 6 1 1 A 51 51 VAL N N 51 129.810 127.445 2.365 1 1 360 . 6 1 1 A 52 52 GLY H H 52 9.410 9.026 0.384 1 1 361 . 6 1 1 A 52 52 GLY HA2 H 52 3.460 3.966 -0.506 1 1 362 . 6 1 1 A 52 52 GLY HA3 H 52 4.680 3.985 0.695 1 1 363 . 6 1 1 A 52 52 GLY C C 52 173.000 172.792 0.208 1 1 364 . 6 1 1 A 52 52 GLY CA C 52 46.470 46.475 -0.005 1 1 365 . 6 1 1 A 52 52 GLY N N 52 116.600 116.673 -0.073 1 1 366 . 6 1 1 A 53 53 VAL H H 53 9.130 8.172 0.958 1 1 367 . 6 1 1 A 53 53 VAL HA H 53 4.840 4.729 0.111 1 1 375 . 6 1 1 A 53 53 VAL C C 53 175.470 175.291 0.179 1 1 376 . 6 1 1 A 53 53 VAL CA C 53 61.350 61.160 0.190 1 1 377 . 6 1 1 A 53 53 VAL CB C 53 34.300 31.619 2.681 1 1 380 . 6 1 1 A 53 53 VAL N N 53 129.050 126.057 2.993 1 1 381 . 6 1 1 A 54 54 GLY H H 54 8.420 8.723 -0.303 1 1 382 . 6 1 1 A 54 54 GLY HA2 H 54 3.850 3.722 0.128 1 1 383 . 6 1 1 A 54 54 GLY HA3 H 54 3.850 3.878 -0.028 1 1 384 . 6 1 1 A 54 54 GLY C C 54 173.310 173.047 0.263 1 1 385 . 6 1 1 A 54 54 GLY CA C 54 45.180 44.186 0.994 1 1 386 . 6 1 1 A 54 54 GLY N N 54 116.890 115.438 1.452 1 1 387 . 6 1 1 A 55 55 ILE H H 55 10.190 8.023 2.167 1 1 388 . 6 1 1 A 55 55 ILE HA H 55 4.010 4.769 -0.759 1 1 398 . 6 1 1 A 55 55 ILE C C 55 174.380 175.059 -0.679 1 1 399 . 6 1 1 A 55 55 ILE CA C 55 61.350 59.546 1.804 1 1 400 . 6 1 1 A 55 55 ILE CB C 55 40.840 40.496 0.344 1 1 404 . 6 1 1 A 55 55 ILE N N 55 129.330 121.170 8.160 1 1 405 . 6 1 1 A 56 56 ASP H H 56 8.810 9.513 -0.703 1 1 406 . 6 1 1 A 56 56 ASP HA H 56 4.440 5.073 -0.633 1 1 409 . 6 1 1 A 56 56 ASP C C 56 175.530 176.050 -0.520 1 1 410 . 6 1 1 A 56 56 ASP CA C 56 56.460 55.932 0.528 1 1 411 . 6 1 1 A 56 56 ASP CB C 56 42.720 42.964 -0.244 1 1 412 . 6 1 1 A 56 56 ASP N N 56 128.310 127.178 1.132 1 1 413 . 6 1 1 A 57 57 GLU H H 57 7.270 7.444 -0.174 1 1 414 . 6 1 1 A 57 57 GLU HA H 57 4.290 4.843 -0.553 1 1 419 . 6 1 1 A 57 57 GLU C C 57 173.370 174.551 -1.181 1 1 420 . 6 1 1 A 57 57 GLU CA C 57 54.840 55.443 -0.603 1 1 421 . 6 1 1 A 57 57 GLU CB C 57 33.190 33.749 -0.559 1 1 423 . 6 1 1 A 57 57 GLU N N 57 112.810 116.466 -3.656 1 1 424 . 6 1 1 A 58 58 LEU H H 58 8.370 8.618 -0.248 1 1 425 . 6 1 1 A 58 58 LEU HA H 58 4.830 5.089 -0.259 1 1 434 . 6 1 1 A 58 58 LEU C C 58 174.180 175.066 -0.886 1 1 435 . 6 1 1 A 58 58 LEU CA C 58 55.320 53.363 1.957 1 1 436 . 6 1 1 A 58 58 LEU CB C 58 44.300 44.691 -0.391 1 1 439 . 6 1 1 A 58 58 LEU N N 58 123.130 121.153 1.977 1 1 440 . 6 1 1 A 59 59 VAL H H 59 9.120 8.726 0.394 1 1 441 . 6 1 1 A 59 59 VAL HA H 59 4.240 4.665 -0.425 1 1 449 . 6 1 1 A 59 59 VAL C C 59 174.960 175.422 -0.462 1 1 450 . 6 1 1 A 59 59 VAL CA C 59 61.760 60.013 1.747 1 1 451 . 6 1 1 A 59 59 VAL CB C 59 33.760 33.439 0.321 1 1 454 . 6 1 1 A 59 59 VAL N N 59 127.930 123.000 4.930 1 1 455 . 6 1 1 A 60 60 ASN H H 60 8.770 8.387 0.383 1 1 456 . 6 1 1 A 60 60 ASN HA H 60 4.250 4.789 -0.539 1 1 461 . 6 1 1 A 60 60 ASN C C 60 172.810 173.757 -0.947 1 1 462 . 6 1 1 A 60 60 ASN CA C 60 54.830 54.458 0.372 1 1 463 . 6 1 1 A 60 60 ASN CB C 60 36.030 36.528 -0.498 1 1 464 . 6 1 1 A 60 60 ASN N N 60 115.500 122.946 -7.446 1 1 466 . 6 1 1 A 61 61 ALA H H 61 7.330 7.362 -0.032 1 1 467 . 6 1 1 A 61 61 ALA HA H 61 4.520 4.565 -0.045 1 1 471 . 6 1 1 A 61 61 ALA C C 61 174.580 175.250 -0.670 1 1 472 . 6 1 1 A 61 61 ALA CA C 61 51.560 51.377 0.183 1 1 473 . 6 1 1 A 61 61 ALA CB C 61 22.870 22.496 0.374 1 1 474 . 6 1 1 A 61 61 ALA N N 61 115.640 118.360 -2.720 1 1 475 . 6 1 1 A 62 62 GLU H H 62 7.900 8.658 -0.758 1 1 476 . 6 1 1 A 62 62 GLU HA H 62 4.310 4.590 -0.280 1 1 481 . 6 1 1 A 62 62 GLU C C 62 173.790 175.454 -1.664 1 1 482 . 6 1 1 A 62 62 GLU CA C 62 55.080 54.877 0.203 1 1 483 . 6 1 1 A 62 62 GLU CB C 62 32.610 29.929 2.681 1 1 485 . 6 1 1 A 62 62 GLU N N 62 117.400 120.049 -2.649 1 1 486 . 6 1 1 A 63 63 ALA H H 63 8.910 8.649 0.261 1 1 487 . 6 1 1 A 63 63 ALA HA H 63 4.690 4.536 0.154 1 1 491 . 6 1 1 A 63 63 ALA C C 63 175.720 176.499 -0.779 1 1 492 . 6 1 1 A 63 63 ALA CA C 63 50.600 52.922 -2.322 1 1 493 . 6 1 1 A 63 63 ALA CB C 63 20.660 19.114 1.546 1 1 494 . 6 1 1 A 63 63 ALA N N 63 122.480 128.354 -5.874 1 1 495 . 6 1 1 A 64 64 PHE H H 64 9.220 9.762 -0.542 1 1 496 . 6 1 1 A 64 64 PHE HA H 64 4.320 4.676 -0.356 1 1 501 . 6 1 1 A 64 64 PHE C C 64 174.380 176.446 -2.066 1 1 502 . 6 1 1 A 64 64 PHE CA C 64 59.770 58.790 0.980 1 1 503 . 6 1 1 A 64 64 PHE CB C 64 40.830 40.813 0.017 1 1 504 . 6 1 1 A 64 64 PHE N N 64 120.870 123.270 -2.400 1 1 505 . 6 1 1 A 65 65 ALA H H 65 8.150 7.908 0.242 1 1 506 . 6 1 1 A 65 65 ALA HA H 65 5.280 4.905 0.375 1 1 510 . 6 1 1 A 65 65 ALA C C 65 175.950 175.191 0.759 1 1 511 . 6 1 1 A 65 65 ALA CA C 65 51.120 51.110 0.010 1 1 512 . 6 1 1 A 65 65 ALA CB C 65 22.850 21.536 1.314 1 1 513 . 6 1 1 A 65 65 ALA N N 65 122.350 120.596 1.754 1 1 514 . 6 1 1 A 66 66 TYR H H 66 9.260 9.337 -0.077 1 1 515 . 6 1 1 A 66 66 TYR HA H 66 5.710 5.303 0.407 1 1 520 . 6 1 1 A 66 66 TYR C C 66 175.690 174.094 1.596 1 1 521 . 6 1 1 A 66 66 TYR CA C 66 54.390 56.797 -2.407 1 1 522 . 6 1 1 A 66 66 TYR CB C 66 41.560 41.653 -0.093 1 1 523 . 6 1 1 A 66 66 TYR N N 66 124.350 126.703 -2.353 1 1 524 . 6 1 1 A 67 67 ASP H H 67 9.070 8.247 0.823 1 1 525 . 6 1 1 A 67 67 ASP HA H 67 5.630 5.451 0.179 1 1 528 . 6 1 1 A 67 67 ASP C C 67 174.300 174.643 -0.343 1 1 529 . 6 1 1 A 67 67 ASP CA C 67 51.590 53.011 -1.421 1 1 530 . 6 1 1 A 67 67 ASP CB C 67 44.380 44.278 0.102 1 1 531 . 6 1 1 A 67 67 ASP N N 67 130.490 127.094 3.396 1 1 532 . 6 1 1 A 68 68 PHE H H 68 8.670 8.298 0.372 1 1 533 . 6 1 1 A 68 68 PHE HA H 68 4.890 5.634 -0.744 1 1 538 . 6 1 1 A 68 68 PHE C C 68 172.220 173.926 -1.706 1 1 539 . 6 1 1 A 68 68 PHE CA C 68 57.360 54.645 2.715 1 1 540 . 6 1 1 A 68 68 PHE CB C 68 40.360 42.434 -2.074 1 1 541 . 6 1 1 A 68 68 PHE N N 68 118.200 119.442 -1.242 1 1 542 . 6 1 1 A 69 69 THR H H 69 8.390 8.910 -0.520 1 1 543 . 6 1 1 A 69 69 THR HA H 69 5.170 4.857 0.313 1 1 548 . 6 1 1 A 69 69 THR C C 69 172.620 174.782 -2.162 1 1 549 . 6 1 1 A 69 69 THR CA C 69 61.370 61.287 0.083 1 1 550 . 6 1 1 A 69 69 THR CB C 69 64.880 70.110 -5.230 1 1 552 . 6 1 1 A 69 69 THR N N 69 115.810 115.393 0.417 1 1 553 . 6 1 1 A 70 70 LEU H H 70 9.560 8.689 0.871 1 1 554 . 6 1 1 A 70 70 LEU HA H 70 5.270 4.765 0.505 1 1 564 . 6 1 1 A 70 70 LEU C C 70 173.800 176.052 -2.252 1 1 565 . 6 1 1 A 70 70 LEU CA C 70 53.460 54.279 -0.819 1 1 566 . 6 1 1 A 70 70 LEU CB C 70 45.040 43.159 1.881 1 1 570 . 6 1 1 A 70 70 LEU N N 70 129.220 125.116 4.104 1 1 571 . 6 1 1 A 71 71 ASN H H 71 9.590 8.365 1.225 1 1 572 . 6 1 1 A 71 71 ASN HA H 71 5.880 5.783 0.097 1 1 577 . 6 1 1 A 71 71 ASN C C 71 177.970 174.090 3.880 1 1 578 . 6 1 1 A 71 71 ASN CA C 71 52.060 52.263 -0.203 1 1 579 . 6 1 1 A 71 71 ASN CB C 71 41.020 40.477 0.543 1 1 580 . 6 1 1 A 71 71 ASN N N 71 125.970 118.096 7.874 1 1 582 . 6 1 1 A 72 72 TYR H H 72 8.740 9.250 -0.510 1 1 583 . 6 1 1 A 72 72 TYR HA H 72 5.110 5.279 -0.169 1 1 588 . 6 1 1 A 72 72 TYR C C 72 177.720 173.079 4.641 1 1 589 . 6 1 1 A 72 72 TYR CA C 72 55.310 55.251 0.059 1 1 590 . 6 1 1 A 72 72 TYR CB C 72 41.510 41.322 0.188 1 1 591 . 6 1 1 A 72 72 TYR N N 72 119.640 120.993 -1.353 1 1 592 . 6 1 1 A 73 73 ASP H H 73 9.780 8.983 0.797 1 1 593 . 6 1 1 A 73 73 ASP HA H 73 4.680 5.127 -0.447 1 1 596 . 6 1 1 A 73 73 ASP C C 73 177.290 176.219 1.071 1 1 597 . 6 1 1 A 73 73 ASP CA C 73 53.650 52.775 0.875 1 1 598 . 6 1 1 A 73 73 ASP CB C 73 40.900 44.029 -3.129 1 1 599 . 6 1 1 A 73 73 ASP N N 73 119.290 120.840 -1.550 1 1 600 . 6 1 1 A 74 74 GLU H H 74 9.430 9.056 0.374 1 1 601 . 6 1 1 A 74 74 GLU HA H 74 4.740 4.812 -0.072 1 1 606 . 6 1 1 A 74 74 GLU C C 74 176.320 178.678 -2.358 1 1 607 . 6 1 1 A 74 74 GLU CA C 74 57.410 58.596 -1.186 1 1 608 . 6 1 1 A 74 74 GLU CB C 74 29.490 29.871 -0.381 1 1 610 . 6 1 1 A 74 74 GLU N N 74 130.930 125.944 4.986 1 1 611 . 6 1 1 A 75 75 ASN H H 75 8.680 7.771 0.909 1 1 612 . 6 1 1 A 75 75 ASN HA H 75 4.600 4.484 0.116 1 1 617 . 6 1 1 A 75 75 ASN C C 75 175.340 176.850 -1.510 1 1 618 . 6 1 1 A 75 75 ASN CA C 75 54.620 55.970 -1.350 1 1 619 . 6 1 1 A 75 75 ASN CB C 75 38.770 38.519 0.251 1 1 620 . 6 1 1 A 75 75 ASN N N 75 115.040 117.512 -2.472 1 1 622 . 6 1 1 A 76 76 ALA H H 76 7.740 7.877 -0.137 1 1 623 . 6 1 1 A 76 76 ALA HA H 76 4.310 4.493 -0.183 1 1 627 . 6 1 1 A 76 76 ALA C C 76 175.550 176.925 -1.375 1 1 628 . 6 1 1 A 76 76 ALA CA C 76 53.260 53.002 0.258 1 1 629 . 6 1 1 A 76 76 ALA CB C 76 21.450 21.552 -0.102 1 1 630 . 6 1 1 A 76 76 ALA N N 76 122.200 119.760 2.440 1 1 631 . 6 1 1 A 77 77 PHE H H 77 8.070 7.910 0.160 1 1 632 . 6 1 1 A 77 77 PHE HA H 77 5.650 4.921 0.729 1 1 637 . 6 1 1 A 77 77 PHE C C 77 174.570 175.383 -0.813 1 1 638 . 6 1 1 A 77 77 PHE CA C 77 56.360 57.523 -1.163 1 1 639 . 6 1 1 A 77 77 PHE CB C 77 46.080 41.273 4.807 1 1 640 . 6 1 1 A 77 77 PHE N N 77 114.160 114.760 -0.600 1 1 641 . 6 1 1 A 78 78 GLU H H 78 8.800 9.011 -0.211 1 1 642 . 6 1 1 A 78 78 GLU HA H 78 4.900 5.000 -0.100 1 1 647 . 6 1 1 A 78 78 GLU C C 78 175.950 174.728 1.222 1 1 648 . 6 1 1 A 78 78 GLU CA C 78 53.670 55.830 -2.160 1 1 649 . 6 1 1 A 78 78 GLU CB C 78 33.600 33.061 0.539 1 1 651 . 6 1 1 A 78 78 GLU N N 78 117.590 120.671 -3.081 1 1 652 . 6 1 1 A 79 79 TYR H H 79 8.770 8.893 -0.123 1 1 653 . 6 1 1 A 79 79 TYR HA H 79 4.250 4.272 -0.022 1 1 658 . 6 1 1 A 79 79 TYR C C 79 174.580 174.939 -0.359 1 1 659 . 6 1 1 A 79 79 TYR CA C 79 59.250 59.532 -0.282 1 1 660 . 6 1 1 A 79 79 TYR CB C 79 38.310 39.233 -0.923 1 1 661 . 6 1 1 A 79 79 TYR N N 79 126.560 128.980 -2.420 1 1 662 . 6 1 1 A 80 80 VAL H H 80 8.220 8.059 0.161 1 1 663 . 6 1 1 A 80 80 VAL HA H 80 3.690 3.888 -0.198 1 1 671 . 6 1 1 A 80 80 VAL C C 80 174.780 175.473 -0.693 1 1 672 . 6 1 1 A 80 80 VAL CA C 80 64.400 62.902 1.498 1 1 673 . 6 1 1 A 80 80 VAL CB C 80 33.510 33.169 0.341 1 1 676 . 6 1 1 A 80 80 VAL N N 80 129.460 124.714 4.746 1 1 677 . 6 1 1 A 81 81 GLU H H 81 6.920 7.474 -0.554 1 1 678 . 6 1 1 A 81 81 GLU HA H 81 4.260 4.794 -0.534 1 1 683 . 6 1 1 A 81 81 GLU C C 81 171.840 174.649 -2.809 1 1 684 . 6 1 1 A 81 81 GLU CA C 81 55.310 55.251 0.059 1 1 685 . 6 1 1 A 81 81 GLU CB C 81 30.520 32.904 -2.384 1 1 687 . 6 1 1 A 81 81 GLU N N 81 112.430 114.611 -2.181 1 1 688 . 6 1 1 A 82 82 ALA H H 82 8.310 8.621 -0.311 1 1 689 . 6 1 1 A 82 82 ALA HA H 82 5.650 5.181 0.469 1 1 693 . 6 1 1 A 82 82 ALA C C 82 176.110 176.967 -0.857 1 1 694 . 6 1 1 A 82 82 ALA CA C 82 50.620 51.619 -0.999 1 1 695 . 6 1 1 A 82 82 ALA CB C 82 21.770 19.965 1.805 1 1 696 . 6 1 1 A 82 82 ALA N N 82 121.240 124.829 -3.589 1 1 697 . 6 1 1 A 83 83 ILE H H 83 9.150 9.534 -0.384 1 1 698 . 6 1 1 A 83 83 ILE HA H 83 4.600 4.768 -0.168 1 1 708 . 6 1 1 A 83 83 ILE C C 83 174.810 175.150 -0.340 1 1 709 . 6 1 1 A 83 83 ILE CA C 83 60.060 59.217 0.843 1 1 710 . 6 1 1 A 83 83 ILE CB C 83 42.440 41.102 1.338 1 1 714 . 6 1 1 A 83 83 ILE N N 83 119.720 120.404 -0.684 1 1 715 . 6 1 1 A 84 84 SER H H 84 8.350 8.825 -0.475 1 1 716 . 6 1 1 A 84 84 SER HA H 84 4.660 5.015 -0.355 1 1 719 . 6 1 1 A 84 84 SER C C 84 177.550 173.065 4.485 1 1 720 . 6 1 1 A 84 84 SER CA C 84 57.330 56.198 1.132 1 1 721 . 6 1 1 A 84 84 SER CB C 84 66.490 66.294 0.196 1 1 722 . 6 1 1 A 84 84 SER N N 84 116.740 117.343 -0.603 1 1 723 . 6 1 1 A 85 85 ASP H H 85 8.740 8.747 -0.007 1 1 724 . 6 1 1 A 85 85 ASP HA H 85 4.820 4.841 -0.021 1 1 727 . 6 1 1 A 85 85 ASP C C 85 176.090 175.632 0.458 1 1 728 . 6 1 1 A 85 85 ASP CA C 85 53.480 52.176 1.304 1 1 729 . 6 1 1 A 85 85 ASP CB C 85 42.480 43.445 -0.965 1 1 730 . 6 1 1 A 85 85 ASP N N 85 120.960 121.589 -0.629 1 1 731 . 6 1 1 A 86 86 ASP H H 86 8.380 8.572 -0.192 1 1 732 . 6 1 1 A 86 86 ASP HA H 86 4.450 4.893 -0.443 1 1 735 . 6 1 1 A 86 86 ASP C C 86 177.100 176.987 0.113 1 1 736 . 6 1 1 A 86 86 ASP CA C 86 56.240 53.305 2.935 1 1 737 . 6 1 1 A 86 86 ASP CB C 86 41.100 41.308 -0.208 1 1 738 . 6 1 1 A 86 86 ASP N N 86 117.710 121.819 -4.109 1 1 739 . 6 1 1 A 87 87 GLY H H 87 8.690 7.593 1.097 1 1 740 . 6 1 1 A 87 87 GLY HA2 H 87 3.870 4.090 -0.220 1 1 741 . 6 1 1 A 87 87 GLY HA3 H 87 4.090 4.098 -0.008 1 1 742 . 6 1 1 A 87 87 GLY C C 87 173.800 174.379 -0.579 1 1 743 . 6 1 1 A 87 87 GLY CA C 87 45.770 45.684 0.086 1 1 744 . 6 1 1 A 87 87 GLY N N 87 108.540 107.197 1.343 1 1 745 . 6 1 1 A 88 88 VAL H H 88 7.910 7.697 0.213 1 1 746 . 6 1 1 A 88 88 VAL HA H 88 4.780 4.288 0.492 1 1 754 . 6 1 1 A 88 88 VAL C C 88 173.970 175.233 -1.263 1 1 755 . 6 1 1 A 88 88 VAL CA C 88 60.900 62.217 -1.317 1 1 756 . 6 1 1 A 88 88 VAL CB C 88 35.460 33.054 2.406 1 1 759 . 6 1 1 A 88 88 VAL N N 88 119.790 120.467 -0.677 1 1 760 . 6 1 1 A 89 89 PHE H H 89 9.210 9.699 -0.489 1 1 761 . 6 1 1 A 89 89 PHE HA H 89 4.930 5.450 -0.520 1 1 766 . 6 1 1 A 89 89 PHE C C 89 173.970 173.839 0.131 1 1 767 . 6 1 1 A 89 89 PHE CA C 89 56.450 55.083 1.367 1 1 768 . 6 1 1 A 89 89 PHE CB C 89 41.120 41.811 -0.691 1 1 769 . 6 1 1 A 89 89 PHE N N 89 126.780 126.130 0.650 1 1 770 . 6 1 1 A 90 90 VAL H H 90 7.880 8.542 -0.662 1 1 771 . 6 1 1 A 90 90 VAL HA H 90 4.860 4.946 -0.086 1 1 779 . 6 1 1 A 90 90 VAL C C 90 173.190 174.993 -1.803 1 1 780 . 6 1 1 A 90 90 VAL CA C 90 59.750 60.873 -1.123 1 1 781 . 6 1 1 A 90 90 VAL CB C 90 34.770 34.215 0.555 1 1 784 . 6 1 1 A 90 90 VAL N N 90 124.990 127.737 -2.747 1 1 785 . 6 1 1 A 91 91 ASN H H 91 8.670 8.752 -0.082 1 1 786 . 6 1 1 A 91 91 ASN HA H 91 4.730 5.160 -0.430 1 1 791 . 6 1 1 A 91 91 ASN C C 91 173.200 173.965 -0.765 1 1 792 . 6 1 1 A 91 91 ASN CA C 91 51.970 53.408 -1.438 1 1 793 . 6 1 1 A 91 91 ASN CB C 91 41.340 41.063 0.277 1 1 794 . 6 1 1 A 91 91 ASN N N 91 124.860 123.608 1.252 1 1 796 . 6 1 1 A 92 92 ALA H H 92 8.840 9.068 -0.228 1 1 797 . 6 1 1 A 92 92 ALA HA H 92 5.290 5.439 -0.149 1 1 801 . 6 1 1 A 92 92 ALA C C 92 176.330 176.187 0.143 1 1 802 . 6 1 1 A 92 92 ALA CA C 92 50.170 51.023 -0.853 1 1 803 . 6 1 1 A 92 92 ALA CB C 92 23.610 21.140 2.470 1 1 804 . 6 1 1 A 92 92 ALA N N 92 128.510 129.171 -0.661 1 1 805 . 6 1 1 A 93 93 LYS H H 93 8.670 9.192 -0.522 1 1 806 . 6 1 1 A 93 93 LYS HA H 93 4.460 4.760 -0.300 1 1 815 . 6 1 1 A 93 93 LYS C C 93 174.170 175.083 -0.913 1 1 816 . 6 1 1 A 93 93 LYS CA C 93 55.010 55.240 -0.230 1 1 817 . 6 1 1 A 93 93 LYS CB C 93 36.430 35.639 0.791 1 1 821 . 6 1 1 A 93 93 LYS N N 93 121.300 121.110 0.190 1 1 822 . 6 1 1 A 94 94 LYS H H 94 8.960 8.787 0.173 1 1 823 . 6 1 1 A 94 94 LYS HA H 94 4.460 4.120 0.340 1 1 832 . 6 1 1 A 94 94 LYS C C 94 176.330 176.580 -0.250 1 1 833 . 6 1 1 A 94 94 LYS CA C 94 56.720 57.028 -0.308 1 1 834 . 6 1 1 A 94 94 LYS CB C 94 31.930 32.589 -0.659 1 1 837 . 6 1 1 A 94 94 LYS N N 94 127.060 127.604 -0.544 1 1 838 . 6 1 1 A 95 95 ILE H H 95 8.290 8.931 -0.641 1 1 839 . 6 1 1 A 95 95 ILE HA H 95 4.120 4.316 -0.196 1 1 849 . 6 1 1 A 95 95 ILE C C 95 175.740 175.143 0.597 1 1 850 . 6 1 1 A 95 95 ILE CA C 95 62.760 61.793 0.967 1 1 851 . 6 1 1 A 95 95 ILE CB C 95 38.890 40.326 -1.436 1 1 855 . 6 1 1 A 95 95 ILE N N 95 126.530 129.114 -2.584 1 1 856 . 6 1 1 A 96 96 GLU H H 96 8.030 7.513 0.517 1 1 857 . 6 1 1 A 96 96 GLU HA H 96 4.450 4.567 -0.117 1 1 862 . 6 1 1 A 96 96 GLU C C 96 174.380 175.345 -0.965 1 1 863 . 6 1 1 A 96 96 GLU CA C 96 54.320 55.175 -0.855 1 1 864 . 6 1 1 A 96 96 GLU CB C 96 32.770 32.818 -0.048 1 1 866 . 6 1 1 A 96 96 GLU N N 96 117.080 120.009 -2.929 1 1 867 . 6 1 1 A 97 97 ASP H H 97 8.730 8.543 0.187 1 1 868 . 6 1 1 A 97 97 ASP HA H 97 4.360 4.414 -0.054 1 1 871 . 6 1 1 A 97 97 ASP C C 97 177.100 177.508 -0.408 1 1 872 . 6 1 1 A 97 97 ASP CA C 97 57.160 56.604 0.556 1 1 873 . 6 1 1 A 97 97 ASP CB C 97 39.920 40.877 -0.957 1 1 874 . 6 1 1 A 97 97 ASP N N 97 120.570 120.966 -0.396 1 1 875 . 6 1 1 A 98 98 GLY H H 98 8.760 7.706 1.054 1 1 876 . 6 1 1 A 98 98 GLY HA2 H 98 2.120 1.893 0.227 1 1 877 . 6 1 1 A 98 98 GLY HA3 H 98 3.910 3.297 0.613 1 1 878 . 6 1 1 A 98 98 GLY C C 98 174.000 173.117 0.883 1 1 879 . 6 1 1 A 98 98 GLY CA C 98 45.720 45.598 0.122 1 1 880 . 6 1 1 A 98 98 GLY N N 98 112.090 106.531 5.559 1 1 881 . 6 1 1 A 99 99 LYS H H 99 7.890 7.531 0.359 1 1 882 . 6 1 1 A 99 99 LYS HA H 99 5.330 5.186 0.144 1 1 891 . 6 1 1 A 99 99 LYS C C 99 174.750 174.332 0.418 1 1 892 . 6 1 1 A 99 99 LYS CA C 99 55.990 55.141 0.849 1 1 893 . 6 1 1 A 99 99 LYS CB C 99 37.840 36.026 1.814 1 1 897 . 6 1 1 A 99 99 LYS N N 99 118.050 116.489 1.561 1 1 898 . 6 1 1 A 100 100 VAL H H 100 8.980 8.719 0.261 1 1 899 . 6 1 1 A 100 100 VAL HA H 100 4.510 4.688 -0.178 1 1 907 . 6 1 1 A 100 100 VAL C C 100 174.760 173.754 1.006 1 1 908 . 6 1 1 A 100 100 VAL CA C 100 60.130 59.012 1.118 1 1 909 . 6 1 1 A 100 100 VAL CB C 100 35.240 35.742 -0.502 1 1 912 . 6 1 1 A 100 100 VAL N N 100 123.850 118.992 4.858 1 1 913 . 6 1 1 A 101 101 ARG H H 101 8.810 8.105 0.705 1 1 914 . 6 1 1 A 101 101 ARG HA H 101 4.850 4.638 0.212 1 1 921 . 6 1 1 A 101 101 ARG C C 101 174.770 174.571 0.199 1 1 922 . 6 1 1 A 101 101 ARG CA C 101 54.580 55.027 -0.447 1 1 923 . 6 1 1 A 101 101 ARG CB C 101 32.400 31.454 0.946 1 1 926 . 6 1 1 A 101 101 ARG N N 101 129.210 123.175 6.035 1 1 927 . 6 1 1 A 102 102 VAL H H 102 9.100 7.866 1.234 1 1 928 . 6 1 1 A 102 102 VAL HA H 102 4.120 4.864 -0.744 1 1 936 . 6 1 1 A 102 102 VAL C C 102 171.640 173.699 -2.059 1 1 937 . 6 1 1 A 102 102 VAL CA C 102 61.350 59.969 1.381 1 1 938 . 6 1 1 A 102 102 VAL CB C 102 32.530 34.413 -1.883 1 1 941 . 6 1 1 A 102 102 VAL N N 102 130.470 122.324 8.146 1 1 942 . 6 1 1 A 103 103 LEU H H 103 8.110 9.578 -1.468 1 1 943 . 6 1 1 A 103 103 LEU HA H 103 5.120 5.382 -0.262 1 1 953 . 6 1 1 A 103 103 LEU C C 103 176.410 175.174 1.236 1 1 954 . 6 1 1 A 103 103 LEU CA C 103 53.380 53.408 -0.028 1 1 955 . 6 1 1 A 103 103 LEU CB C 103 43.680 42.972 0.708 1 1 959 . 6 1 1 A 103 103 LEU N N 103 125.560 129.811 -4.251 1 1 960 . 6 1 1 A 104 104 VAL H H 104 9.580 8.946 0.634 1 1 961 . 6 1 1 A 104 104 VAL HA H 104 5.260 5.457 -0.197 1 1 969 . 6 1 1 A 104 104 VAL C C 104 176.030 174.531 1.499 1 1 970 . 6 1 1 A 104 104 VAL CA C 104 60.220 59.973 0.247 1 1 971 . 6 1 1 A 104 104 VAL CB C 104 34.310 34.735 -0.425 1 1 974 . 6 1 1 A 104 104 VAL N N 104 125.790 126.172 -0.382 1 1 975 . 6 1 1 A 105 105 SER H H 105 9.340 9.230 0.110 1 1 976 . 6 1 1 A 105 105 SER HA H 105 5.300 5.123 0.177 1 1 979 . 6 1 1 A 105 105 SER C C 105 173.600 172.862 0.738 1 1 980 . 6 1 1 A 105 105 SER CA C 105 57.450 57.097 0.353 1 1 981 . 6 1 1 A 105 105 SER CB C 105 65.600 66.737 -1.137 1 1 982 . 6 1 1 A 105 105 SER N N 105 119.220 122.505 -3.285 1 1 983 . 6 1 1 A 106 106 SER H H 106 8.350 8.812 -0.462 1 1 984 . 6 1 1 A 106 106 SER HA H 106 4.720 4.699 0.021 1 1 987 . 6 1 1 A 106 106 SER C C 106 176.930 174.788 2.142 1 1 988 . 6 1 1 A 106 106 SER CA C 106 58.170 57.989 0.181 1 1 989 . 6 1 1 A 106 106 SER CB C 106 64.170 62.867 1.303 1 1 990 . 6 1 1 A 106 106 SER N N 106 114.800 117.127 -2.327 1 1 991 . 6 1 1 A 107 107 LEU H H 107 8.770 9.013 -0.243 1 1 992 . 6 1 1 A 107 107 LEU HA H 107 4.710 4.301 0.409 1 1 1001 . 6 1 1 A 107 107 LEU C C 107 178.280 178.364 -0.084 1 1 1002 . 6 1 1 A 107 107 LEU CA C 107 55.280 57.138 -1.858 1 1 1003 . 6 1 1 A 107 107 LEU CB C 107 43.410 42.047 1.363 1 1 1007 . 6 1 1 A 107 107 LEU N N 107 127.210 127.227 -0.017 1 1 1008 . 6 1 1 A 108 108 THR H H 108 8.210 7.817 0.393 1 1 1009 . 6 1 1 A 108 108 THR HA H 108 4.400 4.294 0.106 1 1 1015 . 6 1 1 A 108 108 THR C C 108 176.130 175.725 0.405 1 1 1016 . 6 1 1 A 108 108 THR CA C 108 62.050 63.225 -1.175 1 1 1017 . 6 1 1 A 108 108 THR CB C 108 70.910 70.352 0.558 1 1 1019 . 6 1 1 A 108 108 THR N N 108 108.810 110.101 -1.291 1 1 1020 . 6 1 1 A 109 109 GLY H H 109 8.250 7.719 0.531 1 1 1021 . 6 1 1 A 109 109 GLY HA2 H 109 3.780 4.068 -0.288 1 1 1022 . 6 1 1 A 109 109 GLY HA3 H 109 4.290 4.085 0.205 1 1 1023 . 6 1 1 A 109 109 GLY C C 109 173.180 174.314 -1.134 1 1 1024 . 6 1 1 A 109 109 GLY CA C 109 45.340 45.150 0.190 1 1 1025 . 6 1 1 A 109 109 GLY N N 109 110.160 110.785 -0.625 1 1 1026 . 6 1 1 A 110 110 GLU H H 110 7.960 7.575 0.385 1 1 1027 . 6 1 1 A 110 110 GLU HA H 110 4.760 4.707 0.053 1 1 1032 . 6 1 1 A 110 110 GLU CA C 110 53.450 53.566 -0.116 1 1 1033 . 6 1 1 A 110 110 GLU CB C 110 30.020 29.980 0.040 1 1 1035 . 6 1 1 A 110 110 GLU N N 110 119.720 120.879 -1.159 1 1 1036 . 6 1 1 A 111 111 PRO HA H 111 3.250 4.124 -0.874 1 1 1043 . 6 1 1 A 111 111 PRO C C 111 176.710 176.320 0.390 1 1 1044 . 6 1 1 A 111 111 PRO CA C 111 62.240 62.044 0.196 1 1 1045 . 6 1 1 A 111 111 PRO CB C 111 31.990 32.298 -0.308 1 1 1048 . 6 1 1 A 112 112 LEU H H 112 8.840 8.563 0.277 1 1 1049 . 6 1 1 A 112 112 LEU HA H 112 4.290 4.305 -0.015 1 1 1059 . 6 1 1 A 112 112 LEU CA C 112 52.220 53.273 -1.053 1 1 1060 . 6 1 1 A 112 112 LEU CB C 112 41.090 43.156 -2.066 1 1 1063 . 6 1 1 A 112 112 LEU N N 112 122.420 123.026 -0.606 1 1 1064 . 6 1 1 A 113 113 PRO HA H 113 4.380 4.233 0.147 1 1 1071 . 6 1 1 A 113 113 PRO C C 113 176.100 177.520 -1.420 1 1 1072 . 6 1 1 A 113 113 PRO CA C 113 61.930 65.575 -3.645 1 1 1073 . 6 1 1 A 113 113 PRO CB C 113 32.470 31.549 0.921 1 1 1076 . 6 1 1 A 114 114 ALA H H 114 8.070 7.803 0.267 1 1 1077 . 6 1 1 A 114 114 ALA HA H 114 4.550 3.940 0.610 1 1 1081 . 6 1 1 A 114 114 ALA C C 114 177.490 177.278 0.212 1 1 1082 . 6 1 1 A 114 114 ALA CA C 114 51.340 53.778 -2.438 1 1 1083 . 6 1 1 A 114 114 ALA CB C 114 19.940 18.198 1.742 1 1 1084 . 6 1 1 A 114 114 ALA N N 114 121.460 120.693 0.767 1 1 1085 . 6 1 1 A 115 115 LYS H H 115 9.000 8.397 0.603 1 1 1086 . 6 1 1 A 115 115 LYS HA H 115 3.930 3.852 0.078 1 1 1095 . 6 1 1 A 115 115 LYS C C 115 175.740 175.161 0.579 1 1 1096 . 6 1 1 A 115 115 LYS CA C 115 57.580 57.588 -0.008 1 1 1097 . 6 1 1 A 115 115 LYS CB C 115 29.510 30.579 -1.069 1 1 1101 . 6 1 1 A 115 115 LYS N N 115 112.560 115.590 -3.030 1 1 1102 . 6 1 1 A 116 116 GLU H H 116 7.620 7.655 -0.035 1 1 1103 . 6 1 1 A 116 116 GLU HA H 116 4.550 4.810 -0.260 1 1 1108 . 6 1 1 A 116 116 GLU C C 116 176.110 174.904 1.206 1 1 1109 . 6 1 1 A 116 116 GLU CA C 116 54.570 54.858 -0.288 1 1 1110 . 6 1 1 A 116 116 GLU CB C 116 33.680 31.778 1.902 1 1 1112 . 6 1 1 A 116 116 GLU N N 116 115.710 117.046 -1.336 1 1 1113 . 6 1 1 A 117 117 VAL H H 117 8.770 8.801 -0.031 1 1 1114 . 6 1 1 A 117 117 VAL HA H 117 3.200 3.984 -0.784 1 1 1122 . 6 1 1 A 117 117 VAL C C 117 175.740 175.895 -0.155 1 1 1123 . 6 1 1 A 117 117 VAL CA C 117 65.340 63.390 1.950 1 1 1124 . 6 1 1 A 117 117 VAL CB C 117 31.290 30.982 0.308 1 1 1127 . 6 1 1 A 117 117 VAL N N 117 124.450 120.907 3.543 1 1 1128 . 6 1 1 A 118 118 LEU H H 118 8.550 8.942 -0.392 1 1 1129 . 6 1 1 A 118 118 LEU HA H 118 4.540 4.392 0.148 1 1 1139 . 6 1 1 A 118 118 LEU C C 118 176.210 176.794 -0.584 1 1 1140 . 6 1 1 A 118 118 LEU CA C 118 55.510 55.997 -0.487 1 1 1141 . 6 1 1 A 118 118 LEU CB C 118 44.600 42.715 1.885 1 1 1145 . 6 1 1 A 118 118 LEU N N 118 128.440 129.464 -1.024 1 1 1146 . 6 1 1 A 119 119 ALA H H 119 7.970 7.510 0.460 1 1 1147 . 6 1 1 A 119 119 ALA HA H 119 4.740 4.803 -0.063 1 1 1151 . 6 1 1 A 119 119 ALA C C 119 174.570 175.256 -0.686 1 1 1152 . 6 1 1 A 119 119 ALA CA C 119 50.770 51.842 -1.072 1 1 1153 . 6 1 1 A 119 119 ALA CB C 119 22.450 22.377 0.073 1 1 1154 . 6 1 1 A 119 119 ALA N N 119 118.100 118.013 0.087 1 1 1155 . 6 1 1 A 120 120 LYS H H 120 8.760 8.730 0.030 1 1 1156 . 6 1 1 A 120 120 LYS HA H 120 5.240 5.479 -0.239 1 1 1165 . 6 1 1 A 120 120 LYS C C 120 175.340 175.184 0.156 1 1 1166 . 6 1 1 A 120 120 LYS CA C 120 54.220 54.761 -0.541 1 1 1167 . 6 1 1 A 120 120 LYS CB C 120 34.340 35.542 -1.202 1 1 1171 . 6 1 1 A 120 120 LYS N N 120 120.010 122.471 -2.461 1 1 1172 . 6 1 1 A 121 121 VAL H H 121 9.410 8.581 0.829 1 1 1173 . 6 1 1 A 121 121 VAL HA H 121 4.230 4.713 -0.483 1 1 1181 . 6 1 1 A 121 121 VAL C C 121 173.980 175.148 -1.168 1 1 1182 . 6 1 1 A 121 121 VAL CA C 121 62.370 61.632 0.738 1 1 1183 . 6 1 1 A 121 121 VAL CB C 121 32.410 33.716 -1.306 1 1 1186 . 6 1 1 A 121 121 VAL N N 121 124.960 124.082 0.878 1 1 1187 . 6 1 1 A 122 122 VAL H H 122 9.280 8.880 0.400 1 1 1188 . 6 1 1 A 122 122 VAL HA H 122 4.360 4.871 -0.511 1 1 1196 . 6 1 1 A 122 122 VAL C C 122 174.190 175.049 -0.859 1 1 1197 . 6 1 1 A 122 122 VAL CA C 122 62.760 61.978 0.782 1 1 1198 . 6 1 1 A 122 122 VAL CB C 122 32.020 31.221 0.799 1 1 1201 . 6 1 1 A 122 122 VAL N N 122 128.990 128.249 0.741 1 1 1202 . 6 1 1 A 123 123 LEU H H 123 8.610 8.848 -0.238 1 1 1203 . 6 1 1 A 123 123 LEU HA H 123 4.900 4.743 0.157 1 1 1213 . 6 1 1 A 123 123 LEU C C 123 174.950 175.722 -0.772 1 1 1214 . 6 1 1 A 123 123 LEU CA C 123 52.050 53.885 -1.835 1 1 1215 . 6 1 1 A 123 123 LEU CB C 123 45.210 41.906 3.304 1 1 1219 . 6 1 1 A 123 123 LEU N N 123 127.200 128.674 -1.474 1 1 1220 . 6 1 1 A 124 124 ARG H H 124 9.540 9.013 0.527 1 1 1221 . 6 1 1 A 124 124 ARG HA H 124 4.900 4.571 0.329 1 1 1229 . 6 1 1 A 124 124 ARG C C 124 176.320 175.568 0.752 1 1 1230 . 6 1 1 A 124 124 ARG CA C 124 55.320 56.659 -1.339 1 1 1231 . 6 1 1 A 124 124 ARG CB C 124 31.750 30.622 1.128 1 1 1234 . 6 1 1 A 124 124 ARG N N 124 124.290 125.974 -1.684 1 1 1236 . 6 1 1 A 125 125 ALA H H 125 8.880 8.719 0.161 1 1 1237 . 6 1 1 A 125 125 ALA HA H 125 4.380 3.974 0.406 1 1 1241 . 6 1 1 A 125 125 ALA C C 125 177.290 177.852 -0.562 1 1 1242 . 6 1 1 A 125 125 ALA CA C 125 52.530 51.340 1.190 1 1 1243 . 6 1 1 A 125 125 ALA CB C 125 19.870 17.302 2.568 1 1 1244 . 6 1 1 A 125 125 ALA N N 125 130.790 129.199 1.591 1 1 1245 . 6 1 1 A 126 126 GLU H H 126 9.260 8.630 0.630 1 1 1246 . 6 1 1 A 126 126 GLU HA H 126 4.460 4.383 0.077 1 1 1251 . 6 1 1 A 126 126 GLU C C 126 176.120 176.045 0.075 1 1 1252 . 6 1 1 A 126 126 GLU CA C 126 56.940 57.101 -0.161 1 1 1253 . 6 1 1 A 126 126 GLU CB C 126 32.450 30.085 2.365 1 1 1255 . 6 1 1 A 126 126 GLU N N 126 125.740 123.547 2.193 1 1 1256 . 6 1 1 A 127 127 ALA H H 127 7.460 7.476 -0.016 1 1 1257 . 6 1 1 A 127 127 ALA HA H 127 4.360 4.592 -0.232 1 1 1261 . 6 1 1 A 127 127 ALA C C 127 173.400 175.784 -2.384 1 1 1262 . 6 1 1 A 127 127 ALA CA C 127 51.360 51.685 -0.325 1 1 1263 . 6 1 1 A 127 127 ALA CB C 127 22.180 22.059 0.121 1 1 1264 . 6 1 1 A 127 127 ALA N N 127 120.910 119.610 1.300 1 1 1265 . 6 1 1 A 128 128 LYS H H 128 7.940 8.674 -0.734 1 1 1266 . 6 1 1 A 128 128 LYS HA H 128 3.580 4.130 -0.550 1 1 1275 . 6 1 1 A 128 128 LYS C C 128 176.080 175.783 0.297 1 1 1276 . 6 1 1 A 128 128 LYS CA C 128 56.860 57.133 -0.273 1 1 1277 . 6 1 1 A 128 128 LYS CB C 128 33.170 33.138 0.032 1 1 1281 . 6 1 1 A 128 128 LYS N N 128 116.520 124.672 -8.152 1 1 1282 . 6 1 1 A 129 129 ALA H H 129 8.590 8.577 0.013 1 1 1283 . 6 1 1 A 129 129 ALA HA H 129 4.390 4.701 -0.311 1 1 1287 . 6 1 1 A 129 129 ALA C C 129 174.970 176.547 -1.577 1 1 1288 . 6 1 1 A 129 129 ALA CA C 129 52.970 51.414 1.556 1 1 1289 . 6 1 1 A 129 129 ALA CB C 129 21.500 19.001 2.499 1 1 1290 . 6 1 1 A 129 129 ALA N N 129 124.710 127.920 -3.210 1 1 1291 . 6 1 1 A 130 130 GLU H H 130 8.660 8.272 0.388 1 1 1292 . 6 1 1 A 130 130 GLU HA H 130 4.660 3.977 0.683 1 1 1297 . 6 1 1 A 130 130 GLU C C 130 177.390 177.525 -0.135 1 1 1298 . 6 1 1 A 130 130 GLU CA C 130 55.070 58.481 -3.411 1 1 1299 . 6 1 1 A 130 130 GLU CB C 130 30.860 29.237 1.623 1 1 1301 . 6 1 1 A 130 130 GLU N N 130 123.180 122.828 0.352 1 1 1302 . 6 1 1 A 131 131 GLY H H 131 9.170 9.073 0.097 1 1 1303 . 6 1 1 A 131 131 GLY HA2 H 131 3.560 3.967 -0.407 1 1 1304 . 6 1 1 A 131 131 GLY HA3 H 131 3.750 3.971 -0.221 1 1 1305 . 6 1 1 A 131 131 GLY C C 131 174.550 174.341 0.209 1 1 1306 . 6 1 1 A 131 131 GLY CA C 131 47.660 45.350 2.310 1 1 1307 . 6 1 1 A 131 131 GLY N N 131 115.530 115.738 -0.208 1 1 1308 . 6 1 1 A 132 132 SER H H 132 8.430 8.363 0.067 1 1 1309 . 6 1 1 A 132 132 SER HA H 132 4.170 4.549 -0.379 1 1 1312 . 6 1 1 A 132 132 SER C C 132 175.350 174.088 1.262 1 1 1313 . 6 1 1 A 132 132 SER CA C 132 59.050 57.757 1.293 1 1 1314 . 6 1 1 A 132 132 SER CB C 132 64.880 62.358 2.522 1 1 1315 . 6 1 1 A 132 132 SER N N 132 115.930 117.203 -1.273 1 1 1316 . 6 1 1 A 133 133 ASN H H 133 8.850 8.274 0.576 1 1 1317 . 6 1 1 A 133 133 ASN HA H 133 4.910 5.100 -0.190 1 1 1322 . 6 1 1 A 133 133 ASN C C 133 175.450 174.661 0.789 1 1 1323 . 6 1 1 A 133 133 ASN CA C 133 54.920 54.172 0.748 1 1 1324 . 6 1 1 A 133 133 ASN CB C 133 41.060 39.365 1.695 1 1 1325 . 6 1 1 A 133 133 ASN N N 133 125.590 125.495 0.095 1 1 1327 . 6 1 1 A 134 134 LEU H H 134 9.070 9.221 -0.151 1 1 1328 . 6 1 1 A 134 134 LEU HA H 134 5.230 5.261 -0.031 1 1 1338 . 6 1 1 A 134 134 LEU C C 134 175.240 174.276 0.964 1 1 1339 . 6 1 1 A 134 134 LEU CA C 134 53.470 54.349 -0.879 1 1 1340 . 6 1 1 A 134 134 LEU CB C 134 45.090 44.431 0.659 1 1 1344 . 6 1 1 A 134 134 LEU N N 134 129.210 121.797 7.413 1 1 1345 . 6 1 1 A 135 135 SER H H 135 8.690 8.405 0.285 1 1 1346 . 6 1 1 A 135 135 SER HA H 135 5.280 5.119 0.161 1 1 1349 . 6 1 1 A 135 135 SER C C 135 173.590 173.336 0.254 1 1 1350 . 6 1 1 A 135 135 SER CA C 135 56.220 57.003 -0.783 1 1 1351 . 6 1 1 A 135 135 SER CB C 135 66.510 63.989 2.521 1 1 1352 . 6 1 1 A 135 135 SER N N 135 113.020 120.894 -7.874 1 1 1353 . 6 1 1 A 136 136 VAL H H 136 8.940 8.774 0.166 1 1 1354 . 6 1 1 A 136 136 VAL HA H 136 5.500 4.561 0.939 1 1 1362 . 6 1 1 A 136 136 VAL C C 136 175.730 175.833 -0.103 1 1 1363 . 6 1 1 A 136 136 VAL CA C 136 60.960 61.624 -0.664 1 1 1364 . 6 1 1 A 136 136 VAL CB C 136 33.630 31.933 1.697 1 1 1367 . 6 1 1 A 136 136 VAL N N 136 124.340 127.431 -3.091 1 1 1368 . 6 1 1 A 137 137 THR H H 137 9.240 8.607 0.633 1 1 1369 . 6 1 1 A 137 137 THR HA H 137 4.920 4.797 0.123 1 1 1374 . 6 1 1 A 137 137 THR C C 137 173.500 174.412 -0.912 1 1 1375 . 6 1 1 A 137 137 THR CA C 137 59.120 60.309 -1.189 1 1 1376 . 6 1 1 A 137 137 THR CB C 137 72.500 70.641 1.859 1 1 1378 . 6 1 1 A 137 137 THR N N 137 117.010 118.968 -1.958 1 1 1379 . 6 1 1 A 138 138 ASN H H 138 9.190 8.802 0.388 1 1 1380 . 6 1 1 A 138 138 ASN HA H 138 4.420 4.372 0.048 1 1 1385 . 6 1 1 A 138 138 ASN C C 138 175.550 174.376 1.174 1 1 1386 . 6 1 1 A 138 138 ASN CA C 138 54.350 53.843 0.507 1 1 1387 . 6 1 1 A 138 138 ASN CB C 138 37.380 36.452 0.928 1 1 1388 . 6 1 1 A 138 138 ASN N N 138 115.270 120.561 -5.291 1 1 1390 . 6 1 1 A 139 139 SER H H 139 8.560 7.957 0.603 1 1 1391 . 6 1 1 A 139 139 SER HA H 139 5.800 4.454 1.346 1 1 1394 . 6 1 1 A 139 139 SER C C 139 175.750 174.156 1.594 1 1 1395 . 6 1 1 A 139 139 SER CA C 139 56.020 60.300 -4.280 1 1 1396 . 6 1 1 A 139 139 SER CB C 139 65.320 63.618 1.702 1 1 1397 . 6 1 1 A 139 139 SER N N 139 112.360 115.265 -2.905 1 1 1398 . 6 1 1 A 140 140 SER H H 140 9.900 8.161 1.739 1 1 1399 . 6 1 1 A 140 140 SER HA H 140 5.360 5.354 0.006 1 1 1402 . 6 1 1 A 140 140 SER C C 140 172.620 173.915 -1.295 1 1 1403 . 6 1 1 A 140 140 SER CA C 140 57.400 56.353 1.047 1 1 1404 . 6 1 1 A 140 140 SER CB C 140 66.550 65.796 0.754 1 1 1405 . 6 1 1 A 140 140 SER N N 140 119.130 120.139 -1.009 1 1 1406 . 6 1 1 A 141 141 VAL H H 141 9.030 8.796 0.234 1 1 1407 . 6 1 1 A 141 141 VAL HA H 141 5.520 5.133 0.387 1 1 1415 . 6 1 1 A 141 141 VAL C C 141 174.750 174.991 -0.241 1 1 1416 . 6 1 1 A 141 141 VAL CA C 141 58.310 59.671 -1.361 1 1 1417 . 6 1 1 A 141 141 VAL CB C 141 35.030 36.577 -1.547 1 1 1420 . 6 1 1 A 141 141 VAL N N 141 111.410 114.182 -2.772 1 1 1421 . 6 1 1 A 142 142 GLY H H 142 8.790 8.603 0.187 1 1 1422 . 6 1 1 A 142 142 GLY HA2 H 142 3.600 4.306 -0.706 1 1 1423 . 6 1 1 A 142 142 GLY HA3 H 142 5.310 4.327 0.983 1 1 1424 . 6 1 1 A 142 142 GLY C C 142 174.180 174.399 -0.219 1 1 1425 . 6 1 1 A 142 142 GLY CA C 142 44.110 45.750 -1.640 1 1 1426 . 6 1 1 A 142 142 GLY N N 142 109.330 109.627 -0.297 1 1 1427 . 6 1 1 A 143 143 ASP H H 143 8.840 8.792 0.048 1 1 1428 . 6 1 1 A 143 143 ASP HA H 143 5.790 4.816 0.974 1 1 1431 . 6 1 1 A 143 143 ASP C C 143 178.860 177.774 1.086 1 1 1432 . 6 1 1 A 143 143 ASP CA C 143 53.040 53.134 -0.094 1 1 1433 . 6 1 1 A 143 143 ASP CB C 143 43.660 41.911 1.749 1 1 1434 . 6 1 1 A 143 143 ASP N N 143 125.390 124.726 0.664 1 1 1435 . 6 1 1 A 144 144 GLY H H 144 9.150 8.823 0.327 1 1 1436 . 6 1 1 A 144 144 GLY HA2 H 144 3.450 3.874 -0.424 1 1 1437 . 6 1 1 A 144 144 GLY HA3 H 144 3.720 3.917 -0.197 1 1 1438 . 6 1 1 A 144 144 GLY C C 144 174.770 175.952 -1.182 1 1 1439 . 6 1 1 A 144 144 GLY CA C 144 46.930 47.182 -0.252 1 1 1440 . 6 1 1 A 144 144 GLY N N 144 106.470 107.792 -1.322 1 1 1441 . 6 1 1 A 145 145 GLU H H 145 8.470 7.948 0.522 1 1 1442 . 6 1 1 A 145 145 GLU HA H 145 4.460 4.268 0.192 1 1 1447 . 6 1 1 A 145 145 GLU C C 145 176.520 176.599 -0.079 1 1 1448 . 6 1 1 A 145 145 GLU CA C 145 55.330 56.988 -1.658 1 1 1449 . 6 1 1 A 145 145 GLU CB C 145 30.620 29.787 0.833 1 1 1451 . 6 1 1 A 145 145 GLU N N 145 119.170 120.098 -0.928 1 1 1452 . 6 1 1 A 146 146 GLY H H 146 7.950 8.588 -0.638 1 1 1453 . 6 1 1 A 146 146 GLY HA2 H 146 3.630 4.043 -0.413 1 1 1454 . 6 1 1 A 146 146 GLY HA3 H 146 4.130 4.054 0.076 1 1 1455 . 6 1 1 A 146 146 GLY C C 146 174.350 173.976 0.374 1 1 1456 . 6 1 1 A 146 146 GLY CA C 146 45.330 45.053 0.277 1 1 1457 . 6 1 1 A 146 146 GLY N N 146 108.130 106.969 1.161 1 1 1458 . 6 1 1 A 147 147 LEU H H 147 8.440 8.575 -0.135 1 1 1459 . 6 1 1 A 147 147 LEU HA H 147 4.340 4.775 -0.435 1 1 1469 . 6 1 1 A 147 147 LEU C C 147 175.950 175.396 0.554 1 1 1470 . 6 1 1 A 147 147 LEU CA C 147 54.860 53.028 1.832 1 1 1471 . 6 1 1 A 147 147 LEU CB C 147 41.590 44.074 -2.484 1 1 1475 . 6 1 1 A 147 147 LEU N N 147 124.000 121.266 2.734 1 1 1476 . 6 1 1 A 148 148 VAL H H 148 7.780 8.413 -0.633 1 1 1477 . 6 1 1 A 148 148 VAL HA H 148 4.830 4.799 0.031 1 1 1485 . 6 1 1 A 148 148 VAL C C 148 175.740 174.585 1.155 1 1 1486 . 6 1 1 A 148 148 VAL CA C 148 61.140 60.725 0.415 1 1 1487 . 6 1 1 A 148 148 VAL CB C 148 33.640 33.642 -0.002 1 1 1490 . 6 1 1 A 148 148 VAL N N 148 120.440 120.970 -0.530 1 1 1491 . 6 1 1 A 149 149 HIS H H 149 9.170 8.914 0.256 1 1 1492 . 6 1 1 A 149 149 HIS HA H 149 4.950 4.966 -0.016 1 1 1496 . 6 1 1 A 149 149 HIS C C 149 174.780 174.497 0.283 1 1 1497 . 6 1 1 A 149 149 HIS CA C 149 53.900 54.728 -0.828 1 1 1498 . 6 1 1 A 149 149 HIS CB C 149 32.200 29.742 2.458 1 1 1499 . 6 1 1 A 149 149 HIS N N 149 124.700 126.536 -1.836 1 1 1500 . 6 1 1 A 150 150 GLU H H 150 9.060 8.698 0.362 1 1 1501 . 6 1 1 A 150 150 GLU HA H 150 4.420 4.237 0.183 1 1 1506 . 6 1 1 A 150 150 GLU C C 150 176.520 176.624 -0.104 1 1 1507 . 6 1 1 A 150 150 GLU CA C 150 57.630 56.848 0.782 1 1 1508 . 6 1 1 A 150 150 GLU CB C 150 30.370 29.824 0.546 1 1 1510 . 6 1 1 A 150 150 GLU N N 150 125.540 123.884 1.656 1 1 1511 . 6 1 1 A 151 151 ILE H H 151 8.150 8.277 -0.127 1 1 1512 . 6 1 1 A 151 151 ILE HA H 151 4.780 4.534 0.246 1 1 1522 . 6 1 1 A 151 151 ILE C C 151 174.570 176.340 -1.770 1 1 1523 . 6 1 1 A 151 151 ILE CA C 151 59.390 59.326 0.064 1 1 1524 . 6 1 1 A 151 151 ILE CB C 151 42.040 39.234 2.806 1 1 1528 . 6 1 1 A 151 151 ILE N N 151 115.880 121.902 -6.022 1 1 1529 . 6 1 1 A 152 152 ALA H H 152 8.010 8.371 -0.361 1 1 1530 . 6 1 1 A 152 152 ALA HA H 152 4.310 4.376 -0.066 1 1 1534 . 6 1 1 A 152 152 ALA C C 152 177.500 176.785 0.715 1 1 1535 . 6 1 1 A 152 152 ALA CA C 152 53.680 52.008 1.672 1 1 1536 . 6 1 1 A 152 152 ALA CB C 152 20.050 19.837 0.213 1 1 1537 . 6 1 1 A 152 152 ALA N N 152 126.640 124.344 2.296 1 1 1538 . 6 1 1 A 153 153 GLY H H 153 8.340 8.356 -0.016 1 1 1539 . 6 1 1 A 153 153 GLY HA2 H 153 4.050 4.386 -0.336 1 1 1540 . 6 1 1 A 153 153 GLY HA3 H 153 4.140 4.387 -0.247 1 1 1541 . 6 1 1 A 153 153 GLY C C 153 173.140 171.836 1.304 1 1 1542 . 6 1 1 A 153 153 GLY CA C 153 44.130 45.624 -1.494 1 1 1543 . 6 1 1 A 153 153 GLY N N 153 107.490 105.436 2.054 1 1 1544 . 6 1 1 A 154 154 THR H H 154 7.380 8.491 -1.111 1 1 1545 . 6 1 1 A 154 154 THR HA H 154 4.700 5.081 -0.381 1 1 1550 . 6 1 1 A 154 154 THR C C 154 171.120 172.788 -1.668 1 1 1551 . 6 1 1 A 154 154 THR CA C 154 60.830 61.091 -0.261 1 1 1552 . 6 1 1 A 154 154 THR CB C 154 68.850 72.354 -3.504 1 1 1554 . 6 1 1 A 154 154 THR N N 154 109.340 114.394 -5.054 1 1 1555 . 6 1 1 A 155 155 GLU H H 155 8.020 8.995 -0.975 1 1 1556 . 6 1 1 A 155 155 GLU HA H 155 5.370 5.457 -0.087 1 1 1561 . 6 1 1 A 155 155 GLU C C 155 174.240 174.668 -0.428 1 1 1562 . 6 1 1 A 155 155 GLU CA C 155 54.830 54.396 0.434 1 1 1563 . 6 1 1 A 155 155 GLU CB C 155 33.620 33.364 0.256 1 1 1565 . 6 1 1 A 155 155 GLU N N 155 118.690 125.727 -7.037 1 1 1566 . 6 1 1 A 156 156 LYS H H 156 9.230 9.123 0.107 1 1 1567 . 6 1 1 A 156 156 LYS HA H 156 4.650 5.130 -0.480 1 1 1576 . 6 1 1 A 156 156 LYS C C 156 174.000 174.425 -0.425 1 1 1577 . 6 1 1 A 156 156 LYS CA C 156 55.840 55.015 0.825 1 1 1578 . 6 1 1 A 156 156 LYS CB C 156 37.550 36.532 1.018 1 1 1582 . 6 1 1 A 156 156 LYS N N 156 121.940 124.864 -2.924 1 1 1583 . 6 1 1 A 157 157 THR H H 157 8.160 8.734 -0.574 1 1 1584 . 6 1 1 A 157 157 THR HA H 157 5.440 5.135 0.305 1 1 1589 . 6 1 1 A 157 157 THR C C 157 174.360 173.725 0.635 1 1 1590 . 6 1 1 A 157 157 THR CA C 157 60.410 60.600 -0.190 1 1 1591 . 6 1 1 A 157 157 THR CB C 157 71.500 71.461 0.039 1 1 1593 . 6 1 1 A 157 157 THR N N 157 113.240 112.735 0.505 1 1 1594 . 6 1 1 A 158 158 VAL H H 158 9.120 9.059 0.061 1 1 1595 . 6 1 1 A 158 158 VAL HA H 158 4.580 4.985 -0.405 1 1 1603 . 6 1 1 A 158 158 VAL C C 158 172.800 174.300 -1.500 1 1 1604 . 6 1 1 A 158 158 VAL CA C 158 59.980 59.608 0.372 1 1 1605 . 6 1 1 A 158 158 VAL CB C 158 36.290 35.025 1.265 1 1 1608 . 6 1 1 A 158 158 VAL N N 158 121.710 120.112 1.598 1 1 1609 . 6 1 1 A 159 159 ASN H H 159 8.240 8.459 -0.219 1 1 1610 . 6 1 1 A 159 159 ASN HA H 159 5.420 5.050 0.370 1 1 1615 . 6 1 1 A 159 159 ASN C C 159 173.800 174.281 -0.481 1 1 1616 . 6 1 1 A 159 159 ASN CA C 159 51.740 52.516 -0.776 1 1 1617 . 6 1 1 A 159 159 ASN CB C 159 40.380 39.416 0.964 1 1 1618 . 6 1 1 A 159 159 ASN N N 159 122.730 123.463 -0.733 1 1 1620 . 6 1 1 A 160 160 ILE H H 160 9.160 8.580 0.580 1 1 1621 . 6 1 1 A 160 160 ILE HA H 160 5.130 5.145 -0.015 1 1 1631 . 6 1 1 A 160 160 ILE C C 160 177.320 175.608 1.712 1 1 1632 . 6 1 1 A 160 160 ILE CA C 160 60.640 61.229 -0.589 1 1 1633 . 6 1 1 A 160 160 ILE CB C 160 38.520 37.650 0.870 1 1 1637 . 6 1 1 A 160 160 ILE N N 160 123.690 125.852 -2.162 1 1 1638 . 6 1 1 A 161 161 ILE H H 161 8.780 9.293 -0.513 1 1 1639 . 6 1 1 A 161 161 ILE HA H 161 4.590 4.580 0.010 1 1 1649 . 6 1 1 A 161 161 ILE C C 161 174.960 175.689 -0.729 1 1 1650 . 6 1 1 A 161 161 ILE CA C 161 59.320 60.440 -1.120 1 1 1651 . 6 1 1 A 161 161 ILE CB C 161 41.030 39.468 1.562 1 1 1655 . 6 1 1 A 161 161 ILE N N 161 122.490 129.255 -6.765 1 1 1656 . 6 1 1 A 162 162 GLU H H 162 8.620 8.535 0.085 1 1 1657 . 6 1 1 A 162 162 GLU HA H 162 4.290 4.334 -0.044 1 1 1662 . 6 1 1 A 162 162 GLU C C 162 176.660 176.798 -0.138 1 1 1663 . 6 1 1 A 162 162 GLU CA C 162 56.470 57.810 -1.340 1 1 1664 . 6 1 1 A 162 162 GLU CB C 162 31.150 30.273 0.877 1 1 1666 . 6 1 1 A 162 162 GLU N N 162 120.520 127.101 -6.581 1 1 1667 . 6 1 1 A 163 163 GLY H H 163 8.480 8.465 0.015 1 1 1668 . 6 1 1 A 163 163 GLY HA2 H 163 3.910 4.286 -0.376 1 1 1669 . 6 1 1 A 163 163 GLY HA3 H 163 4.150 4.287 -0.137 1 1 1670 . 6 1 1 A 163 163 GLY C C 163 174.000 171.796 2.204 1 1 1671 . 6 1 1 A 163 163 GLY CA C 163 45.270 45.373 -0.103 1 1 1672 . 6 1 1 A 163 163 GLY N N 163 110.210 109.814 0.396 1 1 1673 . 6 1 1 A 164 164 THR H H 164 8.170 8.605 -0.435 1 1 1674 . 6 1 1 A 164 164 THR HA H 164 4.410 4.500 -0.090 1 1 1679 . 6 1 1 A 164 164 THR C C 164 174.100 175.088 -0.988 1 1 1680 . 6 1 1 A 164 164 THR CA C 164 61.620 61.822 -0.202 1 1 1681 . 6 1 1 A 164 164 THR CB C 164 70.060 69.674 0.386 1 1 1683 . 6 1 1 A 164 164 THR N N 164 113.480 115.877 -2.397 1 1 1 . 7 1 1 A 13 13 GLY H H 13 8.350 8.577 -0.227 1 1 2 . 7 1 1 A 13 13 GLY HA2 H 13 3.920 4.051 -0.131 1 1 3 . 7 1 1 A 13 13 GLY HA3 H 13 3.920 4.062 -0.142 1 1 4 . 7 1 1 A 13 13 GLY CA C 13 45.290 46.477 -1.187 1 1 5 . 7 1 1 A 13 13 GLY N N 13 110.450 113.414 -2.964 1 1 6 . 7 1 1 A 14 14 LEU H H 14 8.050 7.972 0.078 1 1 7 . 7 1 1 A 14 14 LEU N N 14 121.500 116.387 5.113 1 1 8 . 7 1 1 A 15 15 VAL H H 15 8.070 7.637 0.433 1 1 9 . 7 1 1 A 15 15 VAL N N 15 122.390 113.923 8.467 1 1 10 . 7 1 1 A 16 16 PRO HA H 16 4.360 4.375 -0.015 1 1 17 . 7 1 1 A 16 16 PRO CA C 16 62.770 63.669 -0.899 1 1 18 . 7 1 1 A 16 16 PRO CB C 16 32.020 32.004 0.016 1 1 21 . 7 1 1 A 21 21 MET H H 21 8.180 8.033 0.147 1 1 22 . 7 1 1 A 21 21 MET N N 21 121.310 115.877 5.433 1 1 23 . 7 1 1 A 22 22 ALA H H 22 8.290 8.720 -0.430 1 1 24 . 7 1 1 A 22 22 ALA N N 22 124.800 126.612 -1.812 1 1 25 . 7 1 1 A 23 23 SER H H 23 8.210 8.788 -0.578 1 1 26 . 7 1 1 A 23 23 SER N N 23 114.830 118.573 -3.743 1 1 27 . 7 1 1 A 24 24 LYS H H 24 8.250 8.960 -0.710 1 1 28 . 7 1 1 A 24 24 LYS N N 24 122.980 124.740 -1.760 1 1 29 . 7 1 1 A 25 25 LEU H H 25 8.140 8.250 -0.110 1 1 30 . 7 1 1 A 25 25 LEU HA H 25 4.290 4.655 -0.365 1 1 40 . 7 1 1 A 25 25 LEU C C 25 177.410 176.344 1.066 1 1 41 . 7 1 1 A 25 25 LEU CA C 25 55.430 56.127 -0.697 1 1 42 . 7 1 1 A 25 25 LEU CB C 25 42.350 45.021 -2.671 1 1 46 . 7 1 1 A 25 25 LEU N N 25 122.580 119.784 2.796 1 1 47 . 7 1 1 A 26 26 LYS H H 26 8.200 7.910 0.290 1 1 48 . 7 1 1 A 26 26 LYS HA H 26 4.260 4.996 -0.736 1 1 57 . 7 1 1 A 26 26 LYS C C 26 176.520 175.367 1.153 1 1 58 . 7 1 1 A 26 26 LYS CA C 26 56.700 54.967 1.733 1 1 59 . 7 1 1 A 26 26 LYS CB C 26 33.060 35.222 -2.162 1 1 63 . 7 1 1 A 26 26 LYS N N 26 121.800 114.776 7.024 1 1 64 . 7 1 1 A 27 27 GLU H H 27 8.380 8.711 -0.331 1 1 65 . 7 1 1 A 27 27 GLU HA H 27 4.240 4.811 -0.571 1 1 70 . 7 1 1 A 27 27 GLU C C 27 176.130 174.567 1.563 1 1 71 . 7 1 1 A 27 27 GLU CA C 27 56.700 55.903 0.797 1 1 72 . 7 1 1 A 27 27 GLU CB C 27 30.370 33.476 -3.106 1 1 74 . 7 1 1 A 27 27 GLU N N 27 121.700 119.814 1.886 1 1 75 . 7 1 1 A 28 28 ALA H H 28 8.230 8.665 -0.435 1 1 76 . 7 1 1 A 28 28 ALA HA H 28 4.280 5.094 -0.814 1 1 80 . 7 1 1 A 28 28 ALA C C 28 177.090 175.829 1.261 1 1 81 . 7 1 1 A 28 28 ALA CA C 28 52.530 51.793 0.737 1 1 82 . 7 1 1 A 28 28 ALA CB C 28 19.360 21.585 -2.225 1 1 83 . 7 1 1 A 28 28 ALA N N 28 124.640 123.606 1.034 1 1 84 . 7 1 1 A 29 29 ALA H H 29 8.150 8.578 -0.428 1 1 85 . 7 1 1 A 29 29 ALA HA H 29 4.320 4.696 -0.376 1 1 89 . 7 1 1 A 29 29 ALA C C 29 177.120 175.795 1.325 1 1 90 . 7 1 1 A 29 29 ALA CA C 29 52.040 51.951 0.089 1 1 91 . 7 1 1 A 29 29 ALA CB C 29 19.430 18.731 0.699 1 1 92 . 7 1 1 A 29 29 ALA N N 29 123.430 124.696 -1.266 1 1 93 . 7 1 1 A 30 30 GLU H H 30 8.310 8.894 -0.584 1 1 94 . 7 1 1 A 30 30 GLU HA H 30 4.220 4.916 -0.696 1 1 99 . 7 1 1 A 30 30 GLU C C 30 176.310 175.606 0.704 1 1 100 . 7 1 1 A 30 30 GLU CA C 30 56.630 54.984 1.646 1 1 101 . 7 1 1 A 30 30 GLU CB C 30 30.320 31.954 -1.634 1 1 103 . 7 1 1 A 30 30 GLU N N 30 120.630 122.520 -1.890 1 1 104 . 7 1 1 A 31 31 VAL H H 31 8.630 8.854 -0.224 1 1 105 . 7 1 1 A 31 31 VAL HA H 31 4.430 4.913 -0.483 1 1 113 . 7 1 1 A 31 31 VAL C C 31 176.510 176.192 0.318 1 1 114 . 7 1 1 A 31 31 VAL CA C 31 62.360 62.649 -0.289 1 1 115 . 7 1 1 A 31 31 VAL CB C 31 32.370 31.878 0.492 1 1 118 . 7 1 1 A 31 31 VAL N N 31 127.110 125.183 1.927 1 1 119 . 7 1 1 A 32 32 THR H H 32 7.640 8.559 -0.919 1 1 120 . 7 1 1 A 32 32 THR HA H 32 4.870 4.154 0.716 1 1 125 . 7 1 1 A 32 32 THR C C 32 172.220 174.588 -2.368 1 1 126 . 7 1 1 A 32 32 THR CA C 32 59.510 63.864 -4.354 1 1 127 . 7 1 1 A 32 32 THR CB C 32 71.630 70.352 1.278 1 1 129 . 7 1 1 A 32 32 THR N N 32 118.860 120.986 -2.126 1 1 130 . 7 1 1 A 33 33 GLY H H 33 8.350 7.795 0.555 1 1 131 . 7 1 1 A 33 33 GLY HA2 H 33 4.160 4.049 0.111 1 1 132 . 7 1 1 A 33 33 GLY HA3 H 33 4.250 4.070 0.180 1 1 133 . 7 1 1 A 33 33 GLY C C 33 172.820 172.974 -0.154 1 1 134 . 7 1 1 A 33 33 GLY CA C 33 46.680 44.844 1.836 1 1 135 . 7 1 1 A 33 33 GLY N N 33 106.720 109.282 -2.562 1 1 136 . 7 1 1 A 34 34 SER H H 34 8.810 8.814 -0.004 1 1 137 . 7 1 1 A 34 34 SER HA H 34 5.390 5.197 0.193 1 1 140 . 7 1 1 A 34 34 SER C C 34 173.780 172.619 1.161 1 1 141 . 7 1 1 A 34 34 SER CA C 34 57.380 57.426 -0.046 1 1 142 . 7 1 1 A 34 34 SER CB C 34 65.730 66.720 -0.990 1 1 143 . 7 1 1 A 34 34 SER N N 34 112.690 116.991 -4.301 1 1 144 . 7 1 1 A 35 35 VAL H H 35 8.470 8.726 -0.256 1 1 145 . 7 1 1 A 35 35 VAL HA H 35 4.120 4.954 -0.834 1 1 153 . 7 1 1 A 35 35 VAL C C 35 174.750 174.105 0.645 1 1 154 . 7 1 1 A 35 35 VAL CA C 35 62.310 60.220 2.090 1 1 155 . 7 1 1 A 35 35 VAL CB C 35 34.550 34.123 0.427 1 1 158 . 7 1 1 A 35 35 VAL N N 35 123.150 117.859 5.291 1 1 159 . 7 1 1 A 36 36 SER H H 36 8.240 8.821 -0.581 1 1 160 . 7 1 1 A 36 36 SER HA H 36 4.690 4.774 -0.084 1 1 163 . 7 1 1 A 36 36 SER C C 36 171.860 173.338 -1.478 1 1 164 . 7 1 1 A 36 36 SER CA C 36 56.020 56.486 -0.466 1 1 165 . 7 1 1 A 36 36 SER CB C 36 66.050 63.857 2.193 1 1 166 . 7 1 1 A 36 36 SER N N 36 118.760 122.942 -4.182 1 1 167 . 7 1 1 A 37 37 LEU H H 37 8.310 8.899 -0.589 1 1 168 . 7 1 1 A 37 37 LEU HA H 37 4.870 4.751 0.119 1 1 178 . 7 1 1 A 37 37 LEU C C 37 174.190 175.425 -1.235 1 1 179 . 7 1 1 A 37 37 LEU CA C 37 53.870 53.675 0.195 1 1 180 . 7 1 1 A 37 37 LEU CB C 37 47.000 42.819 4.181 1 1 184 . 7 1 1 A 37 37 LEU N N 37 124.790 128.500 -3.710 1 1 185 . 7 1 1 A 38 38 GLU H H 38 9.270 8.903 0.367 1 1 186 . 7 1 1 A 38 38 GLU HA H 38 4.650 5.115 -0.465 1 1 191 . 7 1 1 A 38 38 GLU C C 38 173.970 175.257 -1.287 1 1 192 . 7 1 1 A 38 38 GLU CA C 38 54.410 55.468 -1.058 1 1 193 . 7 1 1 A 38 38 GLU CB C 38 32.460 31.961 0.499 1 1 195 . 7 1 1 A 38 38 GLU N N 38 126.550 126.431 0.119 1 1 196 . 7 1 1 A 39 39 ALA H H 39 8.120 8.489 -0.369 1 1 197 . 7 1 1 A 39 39 ALA HA H 39 4.600 4.781 -0.181 1 1 201 . 7 1 1 A 39 39 ALA C C 39 175.930 177.159 -1.229 1 1 202 . 7 1 1 A 39 39 ALA CA C 39 51.570 50.728 0.842 1 1 203 . 7 1 1 A 39 39 ALA CB C 39 21.780 22.774 -0.994 1 1 204 . 7 1 1 A 39 39 ALA N N 39 124.410 128.766 -4.356 1 1 205 . 7 1 1 A 40 40 LEU H H 40 7.860 9.095 -1.235 1 1 206 . 7 1 1 A 40 40 LEU HA H 40 4.230 3.974 0.256 1 1 216 . 7 1 1 A 40 40 LEU C C 40 175.940 176.652 -0.712 1 1 217 . 7 1 1 A 40 40 LEU CA C 40 55.360 57.212 -1.852 1 1 218 . 7 1 1 A 40 40 LEU CB C 40 42.990 42.200 0.790 1 1 222 . 7 1 1 A 40 40 LEU N N 40 120.640 122.090 -1.450 1 1 223 . 7 1 1 A 41 41 GLU H H 41 8.210 7.851 0.359 1 1 224 . 7 1 1 A 41 41 GLU HA H 41 4.240 4.007 0.233 1 1 229 . 7 1 1 A 41 41 GLU C C 41 176.920 174.783 2.137 1 1 230 . 7 1 1 A 41 41 GLU CA C 41 58.090 57.642 0.448 1 1 231 . 7 1 1 A 41 41 GLU CB C 41 30.530 27.149 3.381 1 1 233 . 7 1 1 A 41 41 GLU N N 41 114.680 116.399 -1.719 1 1 234 . 7 1 1 A 42 42 GLU H H 42 7.490 7.751 -0.261 1 1 235 . 7 1 1 A 42 42 GLU HA H 42 5.680 4.769 0.911 1 1 240 . 7 1 1 A 42 42 GLU C C 42 173.790 173.971 -0.181 1 1 241 . 7 1 1 A 42 42 GLU CA C 42 54.360 56.231 -1.871 1 1 242 . 7 1 1 A 42 42 GLU CB C 42 33.850 32.718 1.132 1 1 244 . 7 1 1 A 42 42 GLU N N 42 116.670 118.234 -1.564 1 1 245 . 7 1 1 A 43 43 VAL H H 43 8.550 9.004 -0.454 1 1 246 . 7 1 1 A 43 43 VAL HA H 43 4.550 4.630 -0.080 1 1 254 . 7 1 1 A 43 43 VAL C C 43 172.220 173.714 -1.494 1 1 255 . 7 1 1 A 43 43 VAL CA C 43 59.470 60.365 -0.895 1 1 256 . 7 1 1 A 43 43 VAL CB C 43 35.470 34.263 1.207 1 1 259 . 7 1 1 A 43 43 VAL N N 43 120.030 126.220 -6.190 1 1 260 . 7 1 1 A 44 44 GLN H H 44 8.470 8.560 -0.090 1 1 261 . 7 1 1 A 44 44 GLN HA H 44 4.890 4.466 0.424 1 1 268 . 7 1 1 A 44 44 GLN C C 44 176.130 176.005 0.125 1 1 269 . 7 1 1 A 44 44 GLN CA C 44 54.360 55.649 -1.289 1 1 270 . 7 1 1 A 44 44 GLN CB C 44 30.610 28.915 1.695 1 1 272 . 7 1 1 A 44 44 GLN N N 44 124.690 130.181 -5.491 1 1 274 . 7 1 1 A 45 45 VAL H H 45 8.130 8.290 -0.160 1 1 275 . 7 1 1 A 45 45 VAL HA H 45 3.030 3.875 -0.845 1 1 283 . 7 1 1 A 45 45 VAL C C 45 176.710 177.196 -0.486 1 1 284 . 7 1 1 A 45 45 VAL CA C 45 65.810 64.696 1.114 1 1 285 . 7 1 1 A 45 45 VAL CB C 45 31.960 31.443 0.517 1 1 288 . 7 1 1 A 45 45 VAL N N 45 120.450 126.488 -6.038 1 1 289 . 7 1 1 A 46 46 GLY H H 46 8.950 9.977 -1.027 1 1 290 . 7 1 1 A 46 46 GLY HA2 H 46 3.590 3.990 -0.400 1 1 291 . 7 1 1 A 46 46 GLY HA3 H 46 4.410 3.993 0.417 1 1 292 . 7 1 1 A 46 46 GLY C C 46 174.390 173.953 0.437 1 1 293 . 7 1 1 A 46 46 GLY CA C 46 44.730 44.956 -0.226 1 1 294 . 7 1 1 A 46 46 GLY N N 46 116.490 115.203 1.287 1 1 295 . 7 1 1 A 47 47 GLU H H 47 8.260 7.918 0.342 1 1 296 . 7 1 1 A 47 47 GLU HA H 47 4.460 4.667 -0.207 1 1 301 . 7 1 1 A 47 47 GLU C C 47 174.780 175.248 -0.468 1 1 302 . 7 1 1 A 47 47 GLU CA C 47 54.830 55.231 -0.401 1 1 303 . 7 1 1 A 47 47 GLU CB C 47 31.140 31.631 -0.491 1 1 305 . 7 1 1 A 47 47 GLU N N 47 120.520 121.536 -1.016 1 1 306 . 7 1 1 A 48 48 ASN H H 48 8.440 8.798 -0.358 1 1 307 . 7 1 1 A 48 48 ASN HA H 48 5.380 5.522 -0.142 1 1 312 . 7 1 1 A 48 48 ASN C C 48 174.770 173.725 1.045 1 1 313 . 7 1 1 A 48 48 ASN CA C 48 51.570 51.978 -0.408 1 1 314 . 7 1 1 A 48 48 ASN CB C 48 39.010 41.642 -2.632 1 1 315 . 7 1 1 A 48 48 ASN N N 48 117.180 120.392 -3.212 1 1 317 . 7 1 1 A 49 49 LEU H H 49 9.810 8.304 1.506 1 1 318 . 7 1 1 A 49 49 LEU HA H 49 4.510 5.142 -0.632 1 1 328 . 7 1 1 A 49 49 LEU C C 49 174.560 175.139 -0.579 1 1 329 . 7 1 1 A 49 49 LEU CA C 49 53.460 53.416 0.044 1 1 330 . 7 1 1 A 49 49 LEU CB C 49 45.520 45.746 -0.226 1 1 333 . 7 1 1 A 49 49 LEU N N 49 125.620 124.375 1.245 1 1 334 . 7 1 1 A 50 50 GLU H H 50 8.750 9.131 -0.381 1 1 335 . 7 1 1 A 50 50 GLU HA H 50 4.360 5.070 -0.710 1 1 340 . 7 1 1 A 50 50 GLU C C 50 175.340 174.288 1.052 1 1 341 . 7 1 1 A 50 50 GLU CA C 50 55.550 55.355 0.195 1 1 342 . 7 1 1 A 50 50 GLU CB C 50 29.890 30.842 -0.952 1 1 344 . 7 1 1 A 50 50 GLU N N 50 125.420 124.505 0.915 1 1 345 . 7 1 1 A 51 51 VAL H H 51 9.230 8.940 0.290 1 1 346 . 7 1 1 A 51 51 VAL HA H 51 4.190 4.770 -0.580 1 1 354 . 7 1 1 A 51 51 VAL C C 51 175.310 174.800 0.510 1 1 355 . 7 1 1 A 51 51 VAL CA C 51 62.520 61.006 1.514 1 1 356 . 7 1 1 A 51 51 VAL CB C 51 31.470 33.436 -1.966 1 1 359 . 7 1 1 A 51 51 VAL N N 51 129.810 126.611 3.199 1 1 360 . 7 1 1 A 52 52 GLY H H 52 9.410 8.654 0.756 1 1 361 . 7 1 1 A 52 52 GLY HA2 H 52 3.460 3.901 -0.441 1 1 362 . 7 1 1 A 52 52 GLY HA3 H 52 4.680 3.919 0.761 1 1 363 . 7 1 1 A 52 52 GLY C C 52 173.000 172.921 0.079 1 1 364 . 7 1 1 A 52 52 GLY CA C 52 46.470 46.705 -0.235 1 1 365 . 7 1 1 A 52 52 GLY N N 52 116.600 116.700 -0.100 1 1 366 . 7 1 1 A 53 53 VAL H H 53 9.130 8.298 0.832 1 1 367 . 7 1 1 A 53 53 VAL HA H 53 4.840 4.608 0.232 1 1 375 . 7 1 1 A 53 53 VAL C C 53 175.470 175.303 0.167 1 1 376 . 7 1 1 A 53 53 VAL CA C 53 61.350 61.154 0.196 1 1 377 . 7 1 1 A 53 53 VAL CB C 53 34.300 31.557 2.743 1 1 380 . 7 1 1 A 53 53 VAL N N 53 129.050 125.780 3.270 1 1 381 . 7 1 1 A 54 54 GLY H H 54 8.420 8.841 -0.421 1 1 382 . 7 1 1 A 54 54 GLY HA2 H 54 3.850 3.740 0.110 1 1 383 . 7 1 1 A 54 54 GLY HA3 H 54 3.850 3.884 -0.034 1 1 384 . 7 1 1 A 54 54 GLY C C 54 173.310 173.202 0.108 1 1 385 . 7 1 1 A 54 54 GLY CA C 54 45.180 44.147 1.033 1 1 386 . 7 1 1 A 54 54 GLY N N 54 116.890 115.439 1.451 1 1 387 . 7 1 1 A 55 55 ILE H H 55 10.190 8.033 2.157 1 1 388 . 7 1 1 A 55 55 ILE HA H 55 4.010 4.642 -0.632 1 1 398 . 7 1 1 A 55 55 ILE C C 55 174.380 175.003 -0.623 1 1 399 . 7 1 1 A 55 55 ILE CA C 55 61.350 59.923 1.427 1 1 400 . 7 1 1 A 55 55 ILE CB C 55 40.840 39.825 1.015 1 1 404 . 7 1 1 A 55 55 ILE N N 55 129.330 121.106 8.224 1 1 405 . 7 1 1 A 56 56 ASP H H 56 8.810 8.845 -0.035 1 1 406 . 7 1 1 A 56 56 ASP HA H 56 4.440 4.822 -0.382 1 1 409 . 7 1 1 A 56 56 ASP C C 56 175.530 175.972 -0.442 1 1 410 . 7 1 1 A 56 56 ASP CA C 56 56.460 55.786 0.674 1 1 411 . 7 1 1 A 56 56 ASP CB C 56 42.720 43.121 -0.401 1 1 412 . 7 1 1 A 56 56 ASP N N 56 128.310 127.321 0.989 1 1 413 . 7 1 1 A 57 57 GLU H H 57 7.270 7.640 -0.370 1 1 414 . 7 1 1 A 57 57 GLU HA H 57 4.290 4.632 -0.342 1 1 419 . 7 1 1 A 57 57 GLU C C 57 173.370 173.980 -0.610 1 1 420 . 7 1 1 A 57 57 GLU CA C 57 54.840 55.571 -0.731 1 1 421 . 7 1 1 A 57 57 GLU CB C 57 33.190 32.303 0.887 1 1 423 . 7 1 1 A 57 57 GLU N N 57 112.810 113.384 -0.574 1 1 424 . 7 1 1 A 58 58 LEU H H 58 8.370 8.749 -0.379 1 1 425 . 7 1 1 A 58 58 LEU HA H 58 4.830 5.069 -0.239 1 1 434 . 7 1 1 A 58 58 LEU C C 58 174.180 174.832 -0.652 1 1 435 . 7 1 1 A 58 58 LEU CA C 58 55.320 53.603 1.717 1 1 436 . 7 1 1 A 58 58 LEU CB C 58 44.300 44.111 0.189 1 1 439 . 7 1 1 A 58 58 LEU N N 58 123.130 121.601 1.529 1 1 440 . 7 1 1 A 59 59 VAL H H 59 9.120 8.785 0.335 1 1 441 . 7 1 1 A 59 59 VAL HA H 59 4.240 4.385 -0.145 1 1 449 . 7 1 1 A 59 59 VAL C C 59 174.960 175.877 -0.917 1 1 450 . 7 1 1 A 59 59 VAL CA C 59 61.760 60.657 1.103 1 1 451 . 7 1 1 A 59 59 VAL CB C 59 33.760 32.774 0.986 1 1 454 . 7 1 1 A 59 59 VAL N N 59 127.930 125.220 2.710 1 1 455 . 7 1 1 A 60 60 ASN H H 60 8.770 8.801 -0.031 1 1 456 . 7 1 1 A 60 60 ASN HA H 60 4.250 4.287 -0.037 1 1 461 . 7 1 1 A 60 60 ASN C C 60 172.810 173.977 -1.167 1 1 462 . 7 1 1 A 60 60 ASN CA C 60 54.830 54.410 0.420 1 1 463 . 7 1 1 A 60 60 ASN CB C 60 36.030 36.843 -0.813 1 1 464 . 7 1 1 A 60 60 ASN N N 60 115.500 122.632 -7.132 1 1 466 . 7 1 1 A 61 61 ALA H H 61 7.330 7.362 -0.032 1 1 467 . 7 1 1 A 61 61 ALA HA H 61 4.520 4.970 -0.450 1 1 471 . 7 1 1 A 61 61 ALA C C 61 174.580 175.684 -1.104 1 1 472 . 7 1 1 A 61 61 ALA CA C 61 51.560 50.645 0.915 1 1 473 . 7 1 1 A 61 61 ALA CB C 61 22.870 23.147 -0.277 1 1 474 . 7 1 1 A 61 61 ALA N N 61 115.640 118.582 -2.942 1 1 475 . 7 1 1 A 62 62 GLU H H 62 7.900 8.914 -1.014 1 1 476 . 7 1 1 A 62 62 GLU HA H 62 4.310 4.921 -0.611 1 1 481 . 7 1 1 A 62 62 GLU C C 62 173.790 174.903 -1.113 1 1 482 . 7 1 1 A 62 62 GLU CA C 62 55.080 55.374 -0.294 1 1 483 . 7 1 1 A 62 62 GLU CB C 62 32.610 30.745 1.865 1 1 485 . 7 1 1 A 62 62 GLU N N 62 117.400 120.659 -3.259 1 1 486 . 7 1 1 A 63 63 ALA H H 63 8.910 8.195 0.715 1 1 487 . 7 1 1 A 63 63 ALA HA H 63 4.690 4.463 0.227 1 1 491 . 7 1 1 A 63 63 ALA C C 63 175.720 176.807 -1.087 1 1 492 . 7 1 1 A 63 63 ALA CA C 63 50.600 53.131 -2.531 1 1 493 . 7 1 1 A 63 63 ALA CB C 63 20.660 19.132 1.528 1 1 494 . 7 1 1 A 63 63 ALA N N 63 122.480 124.889 -2.409 1 1 495 . 7 1 1 A 64 64 PHE H H 64 9.220 9.171 0.049 1 1 496 . 7 1 1 A 64 64 PHE HA H 64 4.320 4.801 -0.481 1 1 501 . 7 1 1 A 64 64 PHE C C 64 174.380 175.860 -1.480 1 1 502 . 7 1 1 A 64 64 PHE CA C 64 59.770 58.927 0.843 1 1 503 . 7 1 1 A 64 64 PHE CB C 64 40.830 41.446 -0.616 1 1 504 . 7 1 1 A 64 64 PHE N N 64 120.870 120.938 -0.068 1 1 505 . 7 1 1 A 65 65 ALA H H 65 8.150 8.000 0.150 1 1 506 . 7 1 1 A 65 65 ALA HA H 65 5.280 4.905 0.375 1 1 510 . 7 1 1 A 65 65 ALA C C 65 175.950 175.688 0.262 1 1 511 . 7 1 1 A 65 65 ALA CA C 65 51.120 50.904 0.216 1 1 512 . 7 1 1 A 65 65 ALA CB C 65 22.850 21.535 1.315 1 1 513 . 7 1 1 A 65 65 ALA N N 65 122.350 120.432 1.918 1 1 514 . 7 1 1 A 66 66 TYR H H 66 9.260 9.303 -0.043 1 1 515 . 7 1 1 A 66 66 TYR HA H 66 5.710 4.981 0.729 1 1 520 . 7 1 1 A 66 66 TYR C C 66 175.690 174.420 1.270 1 1 521 . 7 1 1 A 66 66 TYR CA C 66 54.390 58.891 -4.501 1 1 522 . 7 1 1 A 66 66 TYR CB C 66 41.560 39.998 1.562 1 1 523 . 7 1 1 A 66 66 TYR N N 66 124.350 126.863 -2.513 1 1 524 . 7 1 1 A 67 67 ASP H H 67 9.070 8.145 0.925 1 1 525 . 7 1 1 A 67 67 ASP HA H 67 5.630 5.470 0.160 1 1 528 . 7 1 1 A 67 67 ASP C C 67 174.300 174.402 -0.102 1 1 529 . 7 1 1 A 67 67 ASP CA C 67 51.590 52.981 -1.391 1 1 530 . 7 1 1 A 67 67 ASP CB C 67 44.380 43.340 1.040 1 1 531 . 7 1 1 A 67 67 ASP N N 67 130.490 126.749 3.741 1 1 532 . 7 1 1 A 68 68 PHE H H 68 8.670 8.324 0.346 1 1 533 . 7 1 1 A 68 68 PHE HA H 68 4.890 5.586 -0.696 1 1 538 . 7 1 1 A 68 68 PHE C C 68 172.220 173.858 -1.638 1 1 539 . 7 1 1 A 68 68 PHE CA C 68 57.360 54.763 2.597 1 1 540 . 7 1 1 A 68 68 PHE CB C 68 40.360 42.299 -1.939 1 1 541 . 7 1 1 A 68 68 PHE N N 68 118.200 119.606 -1.406 1 1 542 . 7 1 1 A 69 69 THR H H 69 8.390 8.938 -0.548 1 1 543 . 7 1 1 A 69 69 THR HA H 69 5.170 4.960 0.210 1 1 548 . 7 1 1 A 69 69 THR C C 69 172.620 174.799 -2.179 1 1 549 . 7 1 1 A 69 69 THR CA C 69 61.370 61.280 0.090 1 1 550 . 7 1 1 A 69 69 THR CB C 69 64.880 70.316 -5.436 1 1 552 . 7 1 1 A 69 69 THR N N 69 115.810 115.372 0.438 1 1 553 . 7 1 1 A 70 70 LEU H H 70 9.560 8.735 0.825 1 1 554 . 7 1 1 A 70 70 LEU HA H 70 5.270 4.761 0.509 1 1 564 . 7 1 1 A 70 70 LEU C C 70 173.800 175.994 -2.194 1 1 565 . 7 1 1 A 70 70 LEU CA C 70 53.460 54.268 -0.808 1 1 566 . 7 1 1 A 70 70 LEU CB C 70 45.040 43.176 1.864 1 1 570 . 7 1 1 A 70 70 LEU N N 70 129.220 125.146 4.074 1 1 571 . 7 1 1 A 71 71 ASN H H 71 9.590 8.644 0.946 1 1 572 . 7 1 1 A 71 71 ASN HA H 71 5.880 5.792 0.088 1 1 577 . 7 1 1 A 71 71 ASN C C 71 177.970 174.248 3.722 1 1 578 . 7 1 1 A 71 71 ASN CA C 71 52.060 52.170 -0.110 1 1 579 . 7 1 1 A 71 71 ASN CB C 71 41.020 40.718 0.302 1 1 580 . 7 1 1 A 71 71 ASN N N 71 125.970 118.003 7.967 1 1 582 . 7 1 1 A 72 72 TYR H H 72 8.740 9.058 -0.318 1 1 583 . 7 1 1 A 72 72 TYR HA H 72 5.110 5.330 -0.220 1 1 588 . 7 1 1 A 72 72 TYR C C 72 177.720 172.281 5.439 1 1 589 . 7 1 1 A 72 72 TYR CA C 72 55.310 55.257 0.053 1 1 590 . 7 1 1 A 72 72 TYR CB C 72 41.510 41.190 0.320 1 1 591 . 7 1 1 A 72 72 TYR N N 72 119.640 120.638 -0.998 1 1 592 . 7 1 1 A 73 73 ASP H H 73 9.780 8.972 0.808 1 1 593 . 7 1 1 A 73 73 ASP HA H 73 4.680 5.022 -0.342 1 1 596 . 7 1 1 A 73 73 ASP C C 73 177.290 176.825 0.465 1 1 597 . 7 1 1 A 73 73 ASP CA C 73 53.650 52.560 1.090 1 1 598 . 7 1 1 A 73 73 ASP CB C 73 40.900 42.297 -1.397 1 1 599 . 7 1 1 A 73 73 ASP N N 73 119.290 121.233 -1.943 1 1 600 . 7 1 1 A 74 74 GLU H H 74 9.430 8.888 0.542 1 1 601 . 7 1 1 A 74 74 GLU HA H 74 4.740 4.416 0.324 1 1 606 . 7 1 1 A 74 74 GLU C C 74 176.320 178.556 -2.236 1 1 607 . 7 1 1 A 74 74 GLU CA C 74 57.410 59.015 -1.605 1 1 608 . 7 1 1 A 74 74 GLU CB C 74 29.490 29.073 0.417 1 1 610 . 7 1 1 A 74 74 GLU N N 74 130.930 125.969 4.961 1 1 611 . 7 1 1 A 75 75 ASN H H 75 8.680 8.208 0.472 1 1 612 . 7 1 1 A 75 75 ASN HA H 75 4.600 4.500 0.100 1 1 617 . 7 1 1 A 75 75 ASN C C 75 175.340 176.727 -1.387 1 1 618 . 7 1 1 A 75 75 ASN CA C 75 54.620 56.120 -1.500 1 1 619 . 7 1 1 A 75 75 ASN CB C 75 38.770 38.322 0.448 1 1 620 . 7 1 1 A 75 75 ASN N N 75 115.040 118.382 -3.342 1 1 622 . 7 1 1 A 76 76 ALA H H 76 7.740 7.933 -0.193 1 1 623 . 7 1 1 A 76 76 ALA HA H 76 4.310 4.487 -0.177 1 1 627 . 7 1 1 A 76 76 ALA C C 76 175.550 176.262 -0.712 1 1 628 . 7 1 1 A 76 76 ALA CA C 76 53.260 51.806 1.454 1 1 629 . 7 1 1 A 76 76 ALA CB C 76 21.450 19.848 1.602 1 1 630 . 7 1 1 A 76 76 ALA N N 76 122.200 118.681 3.519 1 1 631 . 7 1 1 A 77 77 PHE H H 77 8.070 7.809 0.261 1 1 632 . 7 1 1 A 77 77 PHE HA H 77 5.650 5.252 0.398 1 1 637 . 7 1 1 A 77 77 PHE C C 77 174.570 173.668 0.902 1 1 638 . 7 1 1 A 77 77 PHE CA C 77 56.360 56.810 -0.450 1 1 639 . 7 1 1 A 77 77 PHE CB C 77 46.080 43.314 2.766 1 1 640 . 7 1 1 A 77 77 PHE N N 77 114.160 116.381 -2.221 1 1 641 . 7 1 1 A 78 78 GLU H H 78 8.800 9.074 -0.274 1 1 642 . 7 1 1 A 78 78 GLU HA H 78 4.900 4.999 -0.099 1 1 647 . 7 1 1 A 78 78 GLU C C 78 175.950 174.811 1.139 1 1 648 . 7 1 1 A 78 78 GLU CA C 78 53.670 56.295 -2.625 1 1 649 . 7 1 1 A 78 78 GLU CB C 78 33.600 32.874 0.726 1 1 651 . 7 1 1 A 78 78 GLU N N 78 117.590 120.301 -2.711 1 1 652 . 7 1 1 A 79 79 TYR H H 79 8.770 9.144 -0.374 1 1 653 . 7 1 1 A 79 79 TYR HA H 79 4.250 4.253 -0.003 1 1 658 . 7 1 1 A 79 79 TYR C C 79 174.580 174.966 -0.386 1 1 659 . 7 1 1 A 79 79 TYR CA C 79 59.250 59.667 -0.417 1 1 660 . 7 1 1 A 79 79 TYR CB C 79 38.310 39.257 -0.947 1 1 661 . 7 1 1 A 79 79 TYR N N 79 126.560 128.947 -2.387 1 1 662 . 7 1 1 A 80 80 VAL H H 80 8.220 8.205 0.015 1 1 663 . 7 1 1 A 80 80 VAL HA H 80 3.690 3.878 -0.188 1 1 671 . 7 1 1 A 80 80 VAL C C 80 174.780 174.695 0.085 1 1 672 . 7 1 1 A 80 80 VAL CA C 80 64.400 62.941 1.459 1 1 673 . 7 1 1 A 80 80 VAL CB C 80 33.510 32.646 0.864 1 1 676 . 7 1 1 A 80 80 VAL N N 80 129.460 125.170 4.290 1 1 677 . 7 1 1 A 81 81 GLU H H 81 6.920 7.037 -0.117 1 1 678 . 7 1 1 A 81 81 GLU HA H 81 4.260 4.604 -0.344 1 1 683 . 7 1 1 A 81 81 GLU C C 81 171.840 175.601 -3.761 1 1 684 . 7 1 1 A 81 81 GLU CA C 81 55.310 55.116 0.194 1 1 685 . 7 1 1 A 81 81 GLU CB C 81 30.520 33.333 -2.813 1 1 687 . 7 1 1 A 81 81 GLU N N 81 112.430 117.092 -4.662 1 1 688 . 7 1 1 A 82 82 ALA H H 82 8.310 8.619 -0.309 1 1 689 . 7 1 1 A 82 82 ALA HA H 82 5.650 5.072 0.578 1 1 693 . 7 1 1 A 82 82 ALA C C 82 176.110 177.121 -1.011 1 1 694 . 7 1 1 A 82 82 ALA CA C 82 50.620 51.799 -1.179 1 1 695 . 7 1 1 A 82 82 ALA CB C 82 21.770 20.040 1.730 1 1 696 . 7 1 1 A 82 82 ALA N N 82 121.240 126.690 -5.450 1 1 697 . 7 1 1 A 83 83 ILE H H 83 9.150 9.622 -0.472 1 1 698 . 7 1 1 A 83 83 ILE HA H 83 4.600 4.872 -0.272 1 1 708 . 7 1 1 A 83 83 ILE C C 83 174.810 174.907 -0.097 1 1 709 . 7 1 1 A 83 83 ILE CA C 83 60.060 59.258 0.802 1 1 710 . 7 1 1 A 83 83 ILE CB C 83 42.440 41.858 0.582 1 1 714 . 7 1 1 A 83 83 ILE N N 83 119.720 119.115 0.605 1 1 715 . 7 1 1 A 84 84 SER H H 84 8.350 8.968 -0.618 1 1 716 . 7 1 1 A 84 84 SER HA H 84 4.660 4.841 -0.181 1 1 719 . 7 1 1 A 84 84 SER C C 84 177.550 172.228 5.322 1 1 720 . 7 1 1 A 84 84 SER CA C 84 57.330 55.547 1.783 1 1 721 . 7 1 1 A 84 84 SER CB C 84 66.490 65.249 1.241 1 1 722 . 7 1 1 A 84 84 SER N N 84 116.740 118.637 -1.897 1 1 723 . 7 1 1 A 85 85 ASP H H 85 8.740 8.629 0.111 1 1 724 . 7 1 1 A 85 85 ASP HA H 85 4.820 4.771 0.049 1 1 727 . 7 1 1 A 85 85 ASP C C 85 176.090 175.891 0.199 1 1 728 . 7 1 1 A 85 85 ASP CA C 85 53.480 52.258 1.222 1 1 729 . 7 1 1 A 85 85 ASP CB C 85 42.480 43.190 -0.710 1 1 730 . 7 1 1 A 85 85 ASP N N 85 120.960 121.911 -0.951 1 1 731 . 7 1 1 A 86 86 ASP H H 86 8.380 8.781 -0.401 1 1 732 . 7 1 1 A 86 86 ASP HA H 86 4.450 4.886 -0.436 1 1 735 . 7 1 1 A 86 86 ASP C C 86 177.100 176.638 0.462 1 1 736 . 7 1 1 A 86 86 ASP CA C 86 56.240 54.088 2.152 1 1 737 . 7 1 1 A 86 86 ASP CB C 86 41.100 41.279 -0.179 1 1 738 . 7 1 1 A 86 86 ASP N N 86 117.710 120.697 -2.987 1 1 739 . 7 1 1 A 87 87 GLY H H 87 8.690 7.563 1.127 1 1 740 . 7 1 1 A 87 87 GLY HA2 H 87 3.870 4.085 -0.215 1 1 741 . 7 1 1 A 87 87 GLY HA3 H 87 4.090 4.095 -0.005 1 1 742 . 7 1 1 A 87 87 GLY C C 87 173.800 174.377 -0.577 1 1 743 . 7 1 1 A 87 87 GLY CA C 87 45.770 45.669 0.101 1 1 744 . 7 1 1 A 87 87 GLY N N 87 108.540 107.111 1.429 1 1 745 . 7 1 1 A 88 88 VAL H H 88 7.910 7.739 0.171 1 1 746 . 7 1 1 A 88 88 VAL HA H 88 4.780 4.265 0.515 1 1 754 . 7 1 1 A 88 88 VAL C C 88 173.970 175.313 -1.343 1 1 755 . 7 1 1 A 88 88 VAL CA C 88 60.900 62.234 -1.334 1 1 756 . 7 1 1 A 88 88 VAL CB C 88 35.460 32.819 2.641 1 1 759 . 7 1 1 A 88 88 VAL N N 88 119.790 120.662 -0.872 1 1 760 . 7 1 1 A 89 89 PHE H H 89 9.210 9.744 -0.534 1 1 761 . 7 1 1 A 89 89 PHE HA H 89 4.930 5.402 -0.472 1 1 766 . 7 1 1 A 89 89 PHE C C 89 173.970 173.858 0.112 1 1 767 . 7 1 1 A 89 89 PHE CA C 89 56.450 55.426 1.024 1 1 768 . 7 1 1 A 89 89 PHE CB C 89 41.120 41.983 -0.863 1 1 769 . 7 1 1 A 89 89 PHE N N 89 126.780 126.781 -0.001 1 1 770 . 7 1 1 A 90 90 VAL H H 90 7.880 8.643 -0.763 1 1 771 . 7 1 1 A 90 90 VAL HA H 90 4.860 5.000 -0.140 1 1 779 . 7 1 1 A 90 90 VAL C C 90 173.190 175.008 -1.818 1 1 780 . 7 1 1 A 90 90 VAL CA C 90 59.750 60.806 -1.056 1 1 781 . 7 1 1 A 90 90 VAL CB C 90 34.770 34.397 0.373 1 1 784 . 7 1 1 A 90 90 VAL N N 90 124.990 126.924 -1.934 1 1 785 . 7 1 1 A 91 91 ASN H H 91 8.670 8.733 -0.063 1 1 786 . 7 1 1 A 91 91 ASN HA H 91 4.730 5.176 -0.446 1 1 791 . 7 1 1 A 91 91 ASN C C 91 173.200 173.908 -0.708 1 1 792 . 7 1 1 A 91 91 ASN CA C 91 51.970 53.306 -1.336 1 1 793 . 7 1 1 A 91 91 ASN CB C 91 41.340 41.144 0.196 1 1 794 . 7 1 1 A 91 91 ASN N N 91 124.860 123.336 1.524 1 1 796 . 7 1 1 A 92 92 ALA H H 92 8.840 9.084 -0.244 1 1 797 . 7 1 1 A 92 92 ALA HA H 92 5.290 5.434 -0.144 1 1 801 . 7 1 1 A 92 92 ALA C C 92 176.330 176.220 0.110 1 1 802 . 7 1 1 A 92 92 ALA CA C 92 50.170 50.945 -0.775 1 1 803 . 7 1 1 A 92 92 ALA CB C 92 23.610 21.217 2.393 1 1 804 . 7 1 1 A 92 92 ALA N N 92 128.510 129.230 -0.720 1 1 805 . 7 1 1 A 93 93 LYS H H 93 8.670 9.350 -0.680 1 1 806 . 7 1 1 A 93 93 LYS HA H 93 4.460 4.753 -0.293 1 1 815 . 7 1 1 A 93 93 LYS C C 93 174.170 174.943 -0.773 1 1 816 . 7 1 1 A 93 93 LYS CA C 93 55.010 55.057 -0.047 1 1 817 . 7 1 1 A 93 93 LYS CB C 93 36.430 35.689 0.741 1 1 821 . 7 1 1 A 93 93 LYS N N 93 121.300 121.224 0.076 1 1 822 . 7 1 1 A 94 94 LYS H H 94 8.960 8.611 0.349 1 1 823 . 7 1 1 A 94 94 LYS HA H 94 4.460 4.109 0.351 1 1 832 . 7 1 1 A 94 94 LYS C C 94 176.330 177.023 -0.693 1 1 833 . 7 1 1 A 94 94 LYS CA C 94 56.720 56.629 0.091 1 1 834 . 7 1 1 A 94 94 LYS CB C 94 31.930 32.567 -0.637 1 1 837 . 7 1 1 A 94 94 LYS N N 94 127.060 127.385 -0.325 1 1 838 . 7 1 1 A 95 95 ILE H H 95 8.290 8.747 -0.457 1 1 839 . 7 1 1 A 95 95 ILE HA H 95 4.120 4.144 -0.024 1 1 849 . 7 1 1 A 95 95 ILE C C 95 175.740 175.207 0.533 1 1 850 . 7 1 1 A 95 95 ILE CA C 95 62.760 62.444 0.316 1 1 851 . 7 1 1 A 95 95 ILE CB C 95 38.890 39.040 -0.150 1 1 855 . 7 1 1 A 95 95 ILE N N 95 126.530 128.103 -1.573 1 1 856 . 7 1 1 A 96 96 GLU H H 96 8.030 7.397 0.633 1 1 857 . 7 1 1 A 96 96 GLU HA H 96 4.450 4.581 -0.131 1 1 862 . 7 1 1 A 96 96 GLU C C 96 174.380 175.462 -1.082 1 1 863 . 7 1 1 A 96 96 GLU CA C 96 54.320 55.416 -1.096 1 1 864 . 7 1 1 A 96 96 GLU CB C 96 32.770 33.077 -0.307 1 1 866 . 7 1 1 A 96 96 GLU N N 96 117.080 119.817 -2.737 1 1 867 . 7 1 1 A 97 97 ASP H H 97 8.730 8.614 0.116 1 1 868 . 7 1 1 A 97 97 ASP HA H 97 4.360 4.382 -0.022 1 1 871 . 7 1 1 A 97 97 ASP C C 97 177.100 177.443 -0.343 1 1 872 . 7 1 1 A 97 97 ASP CA C 97 57.160 56.957 0.203 1 1 873 . 7 1 1 A 97 97 ASP CB C 97 39.920 40.765 -0.845 1 1 874 . 7 1 1 A 97 97 ASP N N 97 120.570 121.231 -0.661 1 1 875 . 7 1 1 A 98 98 GLY H H 98 8.760 7.866 0.894 1 1 876 . 7 1 1 A 98 98 GLY HA2 H 98 2.120 1.924 0.196 1 1 877 . 7 1 1 A 98 98 GLY HA3 H 98 3.910 3.281 0.629 1 1 878 . 7 1 1 A 98 98 GLY C C 98 174.000 173.188 0.812 1 1 879 . 7 1 1 A 98 98 GLY CA C 98 45.720 45.656 0.064 1 1 880 . 7 1 1 A 98 98 GLY N N 98 112.090 106.887 5.203 1 1 881 . 7 1 1 A 99 99 LYS H H 99 7.890 7.526 0.364 1 1 882 . 7 1 1 A 99 99 LYS HA H 99 5.330 5.191 0.139 1 1 891 . 7 1 1 A 99 99 LYS C C 99 174.750 174.384 0.366 1 1 892 . 7 1 1 A 99 99 LYS CA C 99 55.990 55.107 0.883 1 1 893 . 7 1 1 A 99 99 LYS CB C 99 37.840 36.164 1.676 1 1 897 . 7 1 1 A 99 99 LYS N N 99 118.050 116.183 1.867 1 1 898 . 7 1 1 A 100 100 VAL H H 100 8.980 8.269 0.711 1 1 899 . 7 1 1 A 100 100 VAL HA H 100 4.510 4.754 -0.244 1 1 907 . 7 1 1 A 100 100 VAL C C 100 174.760 173.680 1.080 1 1 908 . 7 1 1 A 100 100 VAL CA C 100 60.130 59.002 1.128 1 1 909 . 7 1 1 A 100 100 VAL CB C 100 35.240 35.781 -0.541 1 1 912 . 7 1 1 A 100 100 VAL N N 100 123.850 119.317 4.533 1 1 913 . 7 1 1 A 101 101 ARG H H 101 8.810 8.236 0.574 1 1 914 . 7 1 1 A 101 101 ARG HA H 101 4.850 4.748 0.102 1 1 921 . 7 1 1 A 101 101 ARG C C 101 174.770 174.316 0.454 1 1 922 . 7 1 1 A 101 101 ARG CA C 101 54.580 54.745 -0.165 1 1 923 . 7 1 1 A 101 101 ARG CB C 101 32.400 31.711 0.689 1 1 926 . 7 1 1 A 101 101 ARG N N 101 129.210 122.915 6.295 1 1 927 . 7 1 1 A 102 102 VAL H H 102 9.100 8.010 1.090 1 1 928 . 7 1 1 A 102 102 VAL HA H 102 4.120 4.917 -0.797 1 1 936 . 7 1 1 A 102 102 VAL C C 102 171.640 173.568 -1.928 1 1 937 . 7 1 1 A 102 102 VAL CA C 102 61.350 59.735 1.615 1 1 938 . 7 1 1 A 102 102 VAL CB C 102 32.530 34.272 -1.742 1 1 941 . 7 1 1 A 102 102 VAL N N 102 130.470 122.855 7.615 1 1 942 . 7 1 1 A 103 103 LEU H H 103 8.110 9.625 -1.515 1 1 943 . 7 1 1 A 103 103 LEU HA H 103 5.120 5.187 -0.067 1 1 953 . 7 1 1 A 103 103 LEU C C 103 176.410 175.015 1.395 1 1 954 . 7 1 1 A 103 103 LEU CA C 103 53.380 53.619 -0.239 1 1 955 . 7 1 1 A 103 103 LEU CB C 103 43.680 42.087 1.593 1 1 959 . 7 1 1 A 103 103 LEU N N 103 125.560 129.836 -4.276 1 1 960 . 7 1 1 A 104 104 VAL H H 104 9.580 8.720 0.860 1 1 961 . 7 1 1 A 104 104 VAL HA H 104 5.260 5.190 0.070 1 1 969 . 7 1 1 A 104 104 VAL C C 104 176.030 174.640 1.390 1 1 970 . 7 1 1 A 104 104 VAL CA C 104 60.220 60.301 -0.081 1 1 971 . 7 1 1 A 104 104 VAL CB C 104 34.310 34.162 0.148 1 1 974 . 7 1 1 A 104 104 VAL N N 104 125.790 126.030 -0.240 1 1 975 . 7 1 1 A 105 105 SER H H 105 9.340 9.578 -0.238 1 1 976 . 7 1 1 A 105 105 SER HA H 105 5.300 5.166 0.134 1 1 979 . 7 1 1 A 105 105 SER C C 105 173.600 173.012 0.588 1 1 980 . 7 1 1 A 105 105 SER CA C 105 57.450 57.195 0.255 1 1 981 . 7 1 1 A 105 105 SER CB C 105 65.600 66.429 -0.829 1 1 982 . 7 1 1 A 105 105 SER N N 105 119.220 122.613 -3.393 1 1 983 . 7 1 1 A 106 106 SER H H 106 8.350 8.787 -0.437 1 1 984 . 7 1 1 A 106 106 SER HA H 106 4.720 4.753 -0.033 1 1 987 . 7 1 1 A 106 106 SER C C 106 176.930 174.662 2.268 1 1 988 . 7 1 1 A 106 106 SER CA C 106 58.170 57.815 0.355 1 1 989 . 7 1 1 A 106 106 SER CB C 106 64.170 63.460 0.710 1 1 990 . 7 1 1 A 106 106 SER N N 106 114.800 117.529 -2.729 1 1 991 . 7 1 1 A 107 107 LEU H H 107 8.770 8.248 0.522 1 1 992 . 7 1 1 A 107 107 LEU HA H 107 4.710 4.655 0.055 1 1 1001 . 7 1 1 A 107 107 LEU C C 107 178.280 177.435 0.845 1 1 1002 . 7 1 1 A 107 107 LEU CA C 107 55.280 54.280 1.000 1 1 1003 . 7 1 1 A 107 107 LEU CB C 107 43.410 41.367 2.043 1 1 1007 . 7 1 1 A 107 107 LEU N N 107 127.210 126.252 0.958 1 1 1008 . 7 1 1 A 108 108 THR H H 108 8.210 7.798 0.412 1 1 1009 . 7 1 1 A 108 108 THR HA H 108 4.400 4.639 -0.239 1 1 1015 . 7 1 1 A 108 108 THR C C 108 176.130 175.766 0.364 1 1 1016 . 7 1 1 A 108 108 THR CA C 108 62.050 62.286 -0.236 1 1 1017 . 7 1 1 A 108 108 THR CB C 108 70.910 71.400 -0.490 1 1 1019 . 7 1 1 A 108 108 THR N N 108 108.810 111.862 -3.052 1 1 1020 . 7 1 1 A 109 109 GLY H H 109 8.250 8.223 0.027 1 1 1021 . 7 1 1 A 109 109 GLY HA2 H 109 3.780 4.064 -0.284 1 1 1022 . 7 1 1 A 109 109 GLY HA3 H 109 4.290 4.082 0.208 1 1 1023 . 7 1 1 A 109 109 GLY C C 109 173.180 174.364 -1.184 1 1 1024 . 7 1 1 A 109 109 GLY CA C 109 45.340 45.151 0.189 1 1 1025 . 7 1 1 A 109 109 GLY N N 109 110.160 111.061 -0.901 1 1 1026 . 7 1 1 A 110 110 GLU H H 110 7.960 7.554 0.406 1 1 1027 . 7 1 1 A 110 110 GLU HA H 110 4.760 4.783 -0.023 1 1 1032 . 7 1 1 A 110 110 GLU CA C 110 53.450 53.531 -0.081 1 1 1033 . 7 1 1 A 110 110 GLU CB C 110 30.020 29.918 0.102 1 1 1035 . 7 1 1 A 110 110 GLU N N 110 119.720 120.694 -0.974 1 1 1036 . 7 1 1 A 111 111 PRO HA H 111 3.250 4.095 -0.845 1 1 1043 . 7 1 1 A 111 111 PRO C C 111 176.710 176.000 0.710 1 1 1044 . 7 1 1 A 111 111 PRO CA C 111 62.240 61.862 0.378 1 1 1045 . 7 1 1 A 111 111 PRO CB C 111 31.990 32.069 -0.079 1 1 1048 . 7 1 1 A 112 112 LEU H H 112 8.840 7.746 1.094 1 1 1049 . 7 1 1 A 112 112 LEU HA H 112 4.290 4.145 0.145 1 1 1059 . 7 1 1 A 112 112 LEU CA C 112 52.220 53.494 -1.274 1 1 1060 . 7 1 1 A 112 112 LEU CB C 112 41.090 42.621 -1.531 1 1 1063 . 7 1 1 A 112 112 LEU N N 112 122.420 122.328 0.092 1 1 1064 . 7 1 1 A 113 113 PRO HA H 113 4.380 4.232 0.148 1 1 1071 . 7 1 1 A 113 113 PRO C C 113 176.100 177.478 -1.378 1 1 1072 . 7 1 1 A 113 113 PRO CA C 113 61.930 64.433 -2.503 1 1 1073 . 7 1 1 A 113 113 PRO CB C 113 32.470 31.811 0.659 1 1 1076 . 7 1 1 A 114 114 ALA H H 114 8.070 7.807 0.263 1 1 1077 . 7 1 1 A 114 114 ALA HA H 114 4.550 3.909 0.641 1 1 1081 . 7 1 1 A 114 114 ALA C C 114 177.490 177.531 -0.041 1 1 1082 . 7 1 1 A 114 114 ALA CA C 114 51.340 53.953 -2.613 1 1 1083 . 7 1 1 A 114 114 ALA CB C 114 19.940 18.038 1.902 1 1 1084 . 7 1 1 A 114 114 ALA N N 114 121.460 120.736 0.724 1 1 1085 . 7 1 1 A 115 115 LYS H H 115 9.000 8.956 0.044 1 1 1086 . 7 1 1 A 115 115 LYS HA H 115 3.930 3.789 0.141 1 1 1095 . 7 1 1 A 115 115 LYS C C 115 175.740 174.996 0.744 1 1 1096 . 7 1 1 A 115 115 LYS CA C 115 57.580 57.649 -0.069 1 1 1097 . 7 1 1 A 115 115 LYS CB C 115 29.510 30.531 -1.021 1 1 1101 . 7 1 1 A 115 115 LYS N N 115 112.560 115.660 -3.100 1 1 1102 . 7 1 1 A 116 116 GLU H H 116 7.620 7.647 -0.027 1 1 1103 . 7 1 1 A 116 116 GLU HA H 116 4.550 4.555 -0.005 1 1 1108 . 7 1 1 A 116 116 GLU C C 116 176.110 174.339 1.771 1 1 1109 . 7 1 1 A 116 116 GLU CA C 116 54.570 55.363 -0.793 1 1 1110 . 7 1 1 A 116 116 GLU CB C 116 33.680 33.387 0.293 1 1 1112 . 7 1 1 A 116 116 GLU N N 116 115.710 117.952 -2.242 1 1 1113 . 7 1 1 A 117 117 VAL H H 117 8.770 8.770 0.000 1 1 1114 . 7 1 1 A 117 117 VAL HA H 117 3.200 3.941 -0.741 1 1 1122 . 7 1 1 A 117 117 VAL C C 117 175.740 175.932 -0.192 1 1 1123 . 7 1 1 A 117 117 VAL CA C 117 65.340 63.550 1.790 1 1 1124 . 7 1 1 A 117 117 VAL CB C 117 31.290 31.019 0.271 1 1 1127 . 7 1 1 A 117 117 VAL N N 117 124.450 126.286 -1.836 1 1 1128 . 7 1 1 A 118 118 LEU H H 118 8.550 9.063 -0.513 1 1 1129 . 7 1 1 A 118 118 LEU HA H 118 4.540 4.478 0.062 1 1 1139 . 7 1 1 A 118 118 LEU C C 118 176.210 176.406 -0.196 1 1 1140 . 7 1 1 A 118 118 LEU CA C 118 55.510 55.819 -0.309 1 1 1141 . 7 1 1 A 118 118 LEU CB C 118 44.600 43.050 1.550 1 1 1145 . 7 1 1 A 118 118 LEU N N 118 128.440 128.876 -0.436 1 1 1146 . 7 1 1 A 119 119 ALA H H 119 7.970 7.524 0.446 1 1 1147 . 7 1 1 A 119 119 ALA HA H 119 4.740 4.868 -0.128 1 1 1151 . 7 1 1 A 119 119 ALA C C 119 174.570 175.263 -0.693 1 1 1152 . 7 1 1 A 119 119 ALA CA C 119 50.770 51.809 -1.039 1 1 1153 . 7 1 1 A 119 119 ALA CB C 119 22.450 22.303 0.147 1 1 1154 . 7 1 1 A 119 119 ALA N N 119 118.100 118.173 -0.073 1 1 1155 . 7 1 1 A 120 120 LYS H H 120 8.760 9.104 -0.344 1 1 1156 . 7 1 1 A 120 120 LYS HA H 120 5.240 5.406 -0.166 1 1 1165 . 7 1 1 A 120 120 LYS C C 120 175.340 175.351 -0.011 1 1 1166 . 7 1 1 A 120 120 LYS CA C 120 54.220 55.011 -0.791 1 1 1167 . 7 1 1 A 120 120 LYS CB C 120 34.340 34.799 -0.459 1 1 1171 . 7 1 1 A 120 120 LYS N N 120 120.010 121.554 -1.544 1 1 1172 . 7 1 1 A 121 121 VAL H H 121 9.410 9.238 0.172 1 1 1173 . 7 1 1 A 121 121 VAL HA H 121 4.230 4.499 -0.269 1 1 1181 . 7 1 1 A 121 121 VAL C C 121 173.980 175.692 -1.712 1 1 1182 . 7 1 1 A 121 121 VAL CA C 121 62.370 62.482 -0.112 1 1 1183 . 7 1 1 A 121 121 VAL CB C 121 32.410 32.201 0.209 1 1 1186 . 7 1 1 A 121 121 VAL N N 121 124.960 126.102 -1.142 1 1 1187 . 7 1 1 A 122 122 VAL H H 122 9.280 8.507 0.773 1 1 1188 . 7 1 1 A 122 122 VAL HA H 122 4.360 4.549 -0.189 1 1 1196 . 7 1 1 A 122 122 VAL C C 122 174.190 175.465 -1.275 1 1 1197 . 7 1 1 A 122 122 VAL CA C 122 62.760 62.788 -0.028 1 1 1198 . 7 1 1 A 122 122 VAL CB C 122 32.020 31.517 0.503 1 1 1201 . 7 1 1 A 122 122 VAL N N 122 128.990 127.959 1.031 1 1 1202 . 7 1 1 A 123 123 LEU H H 123 8.610 8.902 -0.292 1 1 1203 . 7 1 1 A 123 123 LEU HA H 123 4.900 4.679 0.221 1 1 1213 . 7 1 1 A 123 123 LEU C C 123 174.950 176.398 -1.448 1 1 1214 . 7 1 1 A 123 123 LEU CA C 123 52.050 53.394 -1.344 1 1 1215 . 7 1 1 A 123 123 LEU CB C 123 45.210 42.844 2.366 1 1 1219 . 7 1 1 A 123 123 LEU N N 123 127.200 128.692 -1.492 1 1 1220 . 7 1 1 A 124 124 ARG H H 124 9.540 8.924 0.616 1 1 1221 . 7 1 1 A 124 124 ARG HA H 124 4.900 5.016 -0.116 1 1 1229 . 7 1 1 A 124 124 ARG C C 124 176.320 174.894 1.426 1 1 1230 . 7 1 1 A 124 124 ARG CA C 124 55.320 54.417 0.903 1 1 1231 . 7 1 1 A 124 124 ARG CB C 124 31.750 33.219 -1.469 1 1 1234 . 7 1 1 A 124 124 ARG N N 124 124.290 121.813 2.477 1 1 1236 . 7 1 1 A 125 125 ALA H H 125 8.880 8.437 0.443 1 1 1237 . 7 1 1 A 125 125 ALA HA H 125 4.380 3.804 0.576 1 1 1241 . 7 1 1 A 125 125 ALA C C 125 177.290 177.646 -0.356 1 1 1242 . 7 1 1 A 125 125 ALA CA C 125 52.530 51.153 1.377 1 1 1243 . 7 1 1 A 125 125 ALA CB C 125 19.870 17.178 2.692 1 1 1244 . 7 1 1 A 125 125 ALA N N 125 130.790 129.047 1.743 1 1 1245 . 7 1 1 A 126 126 GLU H H 126 9.260 8.285 0.975 1 1 1246 . 7 1 1 A 126 126 GLU HA H 126 4.460 4.309 0.151 1 1 1251 . 7 1 1 A 126 126 GLU C C 126 176.120 176.145 -0.025 1 1 1252 . 7 1 1 A 126 126 GLU CA C 126 56.940 57.096 -0.156 1 1 1253 . 7 1 1 A 126 126 GLU CB C 126 32.450 30.225 2.225 1 1 1255 . 7 1 1 A 126 126 GLU N N 126 125.740 123.434 2.306 1 1 1256 . 7 1 1 A 127 127 ALA H H 127 7.460 7.436 0.024 1 1 1257 . 7 1 1 A 127 127 ALA HA H 127 4.360 4.597 -0.237 1 1 1261 . 7 1 1 A 127 127 ALA C C 127 173.400 175.798 -2.398 1 1 1262 . 7 1 1 A 127 127 ALA CA C 127 51.360 51.616 -0.256 1 1 1263 . 7 1 1 A 127 127 ALA CB C 127 22.180 22.087 0.093 1 1 1264 . 7 1 1 A 127 127 ALA N N 127 120.910 119.428 1.482 1 1 1265 . 7 1 1 A 128 128 LYS H H 128 7.940 8.670 -0.730 1 1 1266 . 7 1 1 A 128 128 LYS HA H 128 3.580 4.175 -0.595 1 1 1275 . 7 1 1 A 128 128 LYS C C 128 176.080 175.718 0.362 1 1 1276 . 7 1 1 A 128 128 LYS CA C 128 56.860 57.059 -0.199 1 1 1277 . 7 1 1 A 128 128 LYS CB C 128 33.170 33.334 -0.164 1 1 1281 . 7 1 1 A 128 128 LYS N N 128 116.520 124.362 -7.842 1 1 1282 . 7 1 1 A 129 129 ALA H H 129 8.590 8.760 -0.170 1 1 1283 . 7 1 1 A 129 129 ALA HA H 129 4.390 4.684 -0.294 1 1 1287 . 7 1 1 A 129 129 ALA C C 129 174.970 176.336 -1.366 1 1 1288 . 7 1 1 A 129 129 ALA CA C 129 52.970 51.451 1.519 1 1 1289 . 7 1 1 A 129 129 ALA CB C 129 21.500 18.805 2.695 1 1 1290 . 7 1 1 A 129 129 ALA N N 129 124.710 127.648 -2.938 1 1 1291 . 7 1 1 A 130 130 GLU H H 130 8.660 8.328 0.332 1 1 1292 . 7 1 1 A 130 130 GLU HA H 130 4.660 3.976 0.684 1 1 1297 . 7 1 1 A 130 130 GLU C C 130 177.390 177.389 0.001 1 1 1298 . 7 1 1 A 130 130 GLU CA C 130 55.070 58.506 -3.436 1 1 1299 . 7 1 1 A 130 130 GLU CB C 130 30.860 29.241 1.619 1 1 1301 . 7 1 1 A 130 130 GLU N N 130 123.180 122.948 0.232 1 1 1302 . 7 1 1 A 131 131 GLY H H 131 9.170 9.103 0.067 1 1 1303 . 7 1 1 A 131 131 GLY HA2 H 131 3.560 4.010 -0.450 1 1 1304 . 7 1 1 A 131 131 GLY HA3 H 131 3.750 4.015 -0.265 1 1 1305 . 7 1 1 A 131 131 GLY C C 131 174.550 174.843 -0.293 1 1 1306 . 7 1 1 A 131 131 GLY CA C 131 47.660 45.529 2.131 1 1 1307 . 7 1 1 A 131 131 GLY N N 131 115.530 116.057 -0.527 1 1 1308 . 7 1 1 A 132 132 SER H H 132 8.430 8.095 0.335 1 1 1309 . 7 1 1 A 132 132 SER HA H 132 4.170 4.552 -0.382 1 1 1312 . 7 1 1 A 132 132 SER C C 132 175.350 174.290 1.060 1 1 1313 . 7 1 1 A 132 132 SER CA C 132 59.050 57.855 1.195 1 1 1314 . 7 1 1 A 132 132 SER CB C 132 64.880 62.531 2.349 1 1 1315 . 7 1 1 A 132 132 SER N N 132 115.930 115.579 0.351 1 1 1316 . 7 1 1 A 133 133 ASN H H 133 8.850 9.056 -0.206 1 1 1317 . 7 1 1 A 133 133 ASN HA H 133 4.910 5.157 -0.247 1 1 1322 . 7 1 1 A 133 133 ASN C C 133 175.450 174.666 0.784 1 1 1323 . 7 1 1 A 133 133 ASN CA C 133 54.920 53.916 1.004 1 1 1324 . 7 1 1 A 133 133 ASN CB C 133 41.060 38.873 2.187 1 1 1325 . 7 1 1 A 133 133 ASN N N 133 125.590 121.938 3.652 1 1 1327 . 7 1 1 A 134 134 LEU H H 134 9.070 9.643 -0.573 1 1 1328 . 7 1 1 A 134 134 LEU HA H 134 5.230 5.209 0.021 1 1 1338 . 7 1 1 A 134 134 LEU C C 134 175.240 175.427 -0.187 1 1 1339 . 7 1 1 A 134 134 LEU CA C 134 53.470 53.383 0.087 1 1 1340 . 7 1 1 A 134 134 LEU CB C 134 45.090 44.755 0.335 1 1 1344 . 7 1 1 A 134 134 LEU N N 134 129.210 126.543 2.667 1 1 1345 . 7 1 1 A 135 135 SER H H 135 8.690 8.767 -0.077 1 1 1346 . 7 1 1 A 135 135 SER HA H 135 5.280 5.548 -0.268 1 1 1349 . 7 1 1 A 135 135 SER C C 135 173.590 173.563 0.027 1 1 1350 . 7 1 1 A 135 135 SER CA C 135 56.220 56.655 -0.435 1 1 1351 . 7 1 1 A 135 135 SER CB C 135 66.510 65.334 1.176 1 1 1352 . 7 1 1 A 135 135 SER N N 135 113.020 118.953 -5.933 1 1 1353 . 7 1 1 A 136 136 VAL H H 136 8.940 8.603 0.337 1 1 1354 . 7 1 1 A 136 136 VAL HA H 136 5.500 5.115 0.385 1 1 1362 . 7 1 1 A 136 136 VAL C C 136 175.730 175.294 0.436 1 1 1363 . 7 1 1 A 136 136 VAL CA C 136 60.960 61.041 -0.081 1 1 1364 . 7 1 1 A 136 136 VAL CB C 136 33.630 33.046 0.584 1 1 1367 . 7 1 1 A 136 136 VAL N N 136 124.340 119.669 4.671 1 1 1368 . 7 1 1 A 137 137 THR H H 137 9.240 8.548 0.692 1 1 1369 . 7 1 1 A 137 137 THR HA H 137 4.920 4.805 0.115 1 1 1374 . 7 1 1 A 137 137 THR C C 137 173.500 174.697 -1.197 1 1 1375 . 7 1 1 A 137 137 THR CA C 137 59.120 60.325 -1.205 1 1 1376 . 7 1 1 A 137 137 THR CB C 137 72.500 70.648 1.852 1 1 1378 . 7 1 1 A 137 137 THR N N 137 117.010 118.118 -1.108 1 1 1379 . 7 1 1 A 138 138 ASN H H 138 9.190 8.747 0.443 1 1 1380 . 7 1 1 A 138 138 ASN HA H 138 4.420 4.395 0.025 1 1 1385 . 7 1 1 A 138 138 ASN C C 138 175.550 175.252 0.298 1 1 1386 . 7 1 1 A 138 138 ASN CA C 138 54.350 53.855 0.495 1 1 1387 . 7 1 1 A 138 138 ASN CB C 138 37.380 36.121 1.259 1 1 1388 . 7 1 1 A 138 138 ASN N N 138 115.270 120.787 -5.517 1 1 1390 . 7 1 1 A 139 139 SER H H 139 8.560 7.887 0.673 1 1 1391 . 7 1 1 A 139 139 SER HA H 139 5.800 4.469 1.331 1 1 1394 . 7 1 1 A 139 139 SER C C 139 175.750 174.441 1.309 1 1 1395 . 7 1 1 A 139 139 SER CA C 139 56.020 58.003 -1.983 1 1 1396 . 7 1 1 A 139 139 SER CB C 139 65.320 62.820 2.500 1 1 1397 . 7 1 1 A 139 139 SER N N 139 112.360 116.095 -3.735 1 1 1398 . 7 1 1 A 140 140 SER H H 140 9.900 8.119 1.781 1 1 1399 . 7 1 1 A 140 140 SER HA H 140 5.360 5.111 0.249 1 1 1402 . 7 1 1 A 140 140 SER C C 140 172.620 174.471 -1.851 1 1 1403 . 7 1 1 A 140 140 SER CA C 140 57.400 56.977 0.423 1 1 1404 . 7 1 1 A 140 140 SER CB C 140 66.550 65.797 0.753 1 1 1405 . 7 1 1 A 140 140 SER N N 140 119.130 118.934 0.196 1 1 1406 . 7 1 1 A 141 141 VAL H H 141 9.030 8.696 0.334 1 1 1407 . 7 1 1 A 141 141 VAL HA H 141 5.520 5.168 0.352 1 1 1415 . 7 1 1 A 141 141 VAL C C 141 174.750 175.311 -0.561 1 1 1416 . 7 1 1 A 141 141 VAL CA C 141 58.310 59.674 -1.364 1 1 1417 . 7 1 1 A 141 141 VAL CB C 141 35.030 36.087 -1.057 1 1 1420 . 7 1 1 A 141 141 VAL N N 141 111.410 114.482 -3.072 1 1 1421 . 7 1 1 A 142 142 GLY H H 142 8.790 8.526 0.264 1 1 1422 . 7 1 1 A 142 142 GLY HA2 H 142 3.600 4.130 -0.530 1 1 1423 . 7 1 1 A 142 142 GLY HA3 H 142 5.310 4.180 1.130 1 1 1424 . 7 1 1 A 142 142 GLY C C 142 174.180 173.490 0.690 1 1 1425 . 7 1 1 A 142 142 GLY CA C 142 44.110 46.373 -2.263 1 1 1426 . 7 1 1 A 142 142 GLY N N 142 109.330 110.033 -0.703 1 1 1427 . 7 1 1 A 143 143 ASP H H 143 8.840 8.491 0.349 1 1 1428 . 7 1 1 A 143 143 ASP HA H 143 5.790 5.129 0.661 1 1 1431 . 7 1 1 A 143 143 ASP C C 143 178.860 178.161 0.699 1 1 1432 . 7 1 1 A 143 143 ASP CA C 143 53.040 55.117 -2.077 1 1 1433 . 7 1 1 A 143 143 ASP CB C 143 43.660 42.499 1.161 1 1 1434 . 7 1 1 A 143 143 ASP N N 143 125.390 124.051 1.339 1 1 1435 . 7 1 1 A 144 144 GLY H H 144 9.150 8.989 0.161 1 1 1436 . 7 1 1 A 144 144 GLY HA2 H 144 3.450 3.739 -0.289 1 1 1437 . 7 1 1 A 144 144 GLY HA3 H 144 3.720 3.871 -0.151 1 1 1438 . 7 1 1 A 144 144 GLY C C 144 174.770 175.518 -0.748 1 1 1439 . 7 1 1 A 144 144 GLY CA C 144 46.930 47.295 -0.365 1 1 1440 . 7 1 1 A 144 144 GLY N N 144 106.470 111.358 -4.888 1 1 1441 . 7 1 1 A 145 145 GLU H H 145 8.470 7.879 0.591 1 1 1442 . 7 1 1 A 145 145 GLU HA H 145 4.460 4.294 0.166 1 1 1447 . 7 1 1 A 145 145 GLU C C 145 176.520 176.576 -0.056 1 1 1448 . 7 1 1 A 145 145 GLU CA C 145 55.330 57.071 -1.741 1 1 1449 . 7 1 1 A 145 145 GLU CB C 145 30.620 29.882 0.738 1 1 1451 . 7 1 1 A 145 145 GLU N N 145 119.170 119.564 -0.394 1 1 1452 . 7 1 1 A 146 146 GLY H H 146 7.950 8.190 -0.240 1 1 1453 . 7 1 1 A 146 146 GLY HA2 H 146 3.630 3.976 -0.346 1 1 1454 . 7 1 1 A 146 146 GLY HA3 H 146 4.130 3.983 0.147 1 1 1455 . 7 1 1 A 146 146 GLY C C 146 174.350 173.721 0.629 1 1 1456 . 7 1 1 A 146 146 GLY CA C 146 45.330 44.956 0.374 1 1 1457 . 7 1 1 A 146 146 GLY N N 146 108.130 107.160 0.970 1 1 1458 . 7 1 1 A 147 147 LEU H H 147 8.440 7.836 0.604 1 1 1459 . 7 1 1 A 147 147 LEU HA H 147 4.340 4.523 -0.183 1 1 1469 . 7 1 1 A 147 147 LEU C C 147 175.950 175.520 0.430 1 1 1470 . 7 1 1 A 147 147 LEU CA C 147 54.860 53.443 1.417 1 1 1471 . 7 1 1 A 147 147 LEU CB C 147 41.590 44.117 -2.527 1 1 1475 . 7 1 1 A 147 147 LEU N N 147 124.000 122.656 1.344 1 1 1476 . 7 1 1 A 148 148 VAL H H 148 7.780 8.650 -0.870 1 1 1477 . 7 1 1 A 148 148 VAL HA H 148 4.830 4.011 0.819 1 1 1485 . 7 1 1 A 148 148 VAL C C 148 175.740 175.455 0.285 1 1 1486 . 7 1 1 A 148 148 VAL CA C 148 61.140 62.902 -1.762 1 1 1487 . 7 1 1 A 148 148 VAL CB C 148 33.640 31.554 2.086 1 1 1490 . 7 1 1 A 148 148 VAL N N 148 120.440 124.595 -4.155 1 1 1491 . 7 1 1 A 149 149 HIS H H 149 9.170 8.624 0.546 1 1 1492 . 7 1 1 A 149 149 HIS HA H 149 4.950 4.915 0.035 1 1 1496 . 7 1 1 A 149 149 HIS C C 149 174.780 174.510 0.270 1 1 1497 . 7 1 1 A 149 149 HIS CA C 149 53.900 55.029 -1.129 1 1 1498 . 7 1 1 A 149 149 HIS CB C 149 32.200 28.918 3.282 1 1 1499 . 7 1 1 A 149 149 HIS N N 149 124.700 127.097 -2.397 1 1 1500 . 7 1 1 A 150 150 GLU H H 150 9.060 8.749 0.311 1 1 1501 . 7 1 1 A 150 150 GLU HA H 150 4.420 4.255 0.165 1 1 1506 . 7 1 1 A 150 150 GLU C C 150 176.520 176.695 -0.175 1 1 1507 . 7 1 1 A 150 150 GLU CA C 150 57.630 56.890 0.740 1 1 1508 . 7 1 1 A 150 150 GLU CB C 150 30.370 29.951 0.419 1 1 1510 . 7 1 1 A 150 150 GLU N N 150 125.540 123.827 1.713 1 1 1511 . 7 1 1 A 151 151 ILE H H 151 8.150 7.820 0.330 1 1 1512 . 7 1 1 A 151 151 ILE HA H 151 4.780 4.447 0.333 1 1 1522 . 7 1 1 A 151 151 ILE C C 151 174.570 176.227 -1.657 1 1 1523 . 7 1 1 A 151 151 ILE CA C 151 59.390 59.805 -0.415 1 1 1524 . 7 1 1 A 151 151 ILE CB C 151 42.040 39.931 2.109 1 1 1528 . 7 1 1 A 151 151 ILE N N 151 115.880 122.023 -6.143 1 1 1529 . 7 1 1 A 152 152 ALA H H 152 8.010 8.870 -0.860 1 1 1530 . 7 1 1 A 152 152 ALA HA H 152 4.310 4.348 -0.038 1 1 1534 . 7 1 1 A 152 152 ALA C C 152 177.500 176.866 0.634 1 1 1535 . 7 1 1 A 152 152 ALA CA C 152 53.680 51.820 1.860 1 1 1536 . 7 1 1 A 152 152 ALA CB C 152 20.050 19.790 0.260 1 1 1537 . 7 1 1 A 152 152 ALA N N 152 126.640 124.609 2.031 1 1 1538 . 7 1 1 A 153 153 GLY H H 153 8.340 8.354 -0.014 1 1 1539 . 7 1 1 A 153 153 GLY HA2 H 153 4.050 4.406 -0.356 1 1 1540 . 7 1 1 A 153 153 GLY HA3 H 153 4.140 4.413 -0.273 1 1 1541 . 7 1 1 A 153 153 GLY C C 153 173.140 171.876 1.264 1 1 1542 . 7 1 1 A 153 153 GLY CA C 153 44.130 45.490 -1.360 1 1 1543 . 7 1 1 A 153 153 GLY N N 153 107.490 105.234 2.256 1 1 1544 . 7 1 1 A 154 154 THR H H 154 7.380 8.480 -1.100 1 1 1545 . 7 1 1 A 154 154 THR HA H 154 4.700 5.028 -0.328 1 1 1550 . 7 1 1 A 154 154 THR C C 154 171.120 173.794 -2.674 1 1 1551 . 7 1 1 A 154 154 THR CA C 154 60.830 61.108 -0.278 1 1 1552 . 7 1 1 A 154 154 THR CB C 154 68.850 72.456 -3.606 1 1 1554 . 7 1 1 A 154 154 THR N N 154 109.340 114.423 -5.083 1 1 1555 . 7 1 1 A 155 155 GLU H H 155 8.020 8.666 -0.646 1 1 1556 . 7 1 1 A 155 155 GLU HA H 155 5.370 5.596 -0.226 1 1 1561 . 7 1 1 A 155 155 GLU C C 155 174.240 174.304 -0.064 1 1 1562 . 7 1 1 A 155 155 GLU CA C 155 54.830 54.288 0.542 1 1 1563 . 7 1 1 A 155 155 GLU CB C 155 33.620 32.850 0.770 1 1 1565 . 7 1 1 A 155 155 GLU N N 155 118.690 122.615 -3.925 1 1 1566 . 7 1 1 A 156 156 LYS H H 156 9.230 9.322 -0.092 1 1 1567 . 7 1 1 A 156 156 LYS HA H 156 4.650 4.864 -0.214 1 1 1576 . 7 1 1 A 156 156 LYS C C 156 174.000 174.543 -0.543 1 1 1577 . 7 1 1 A 156 156 LYS CA C 156 55.840 55.273 0.567 1 1 1578 . 7 1 1 A 156 156 LYS CB C 156 37.550 36.501 1.049 1 1 1582 . 7 1 1 A 156 156 LYS N N 156 121.940 121.073 0.867 1 1 1583 . 7 1 1 A 157 157 THR H H 157 8.160 8.639 -0.479 1 1 1584 . 7 1 1 A 157 157 THR HA H 157 5.440 5.130 0.310 1 1 1589 . 7 1 1 A 157 157 THR C C 157 174.360 173.640 0.720 1 1 1590 . 7 1 1 A 157 157 THR CA C 157 60.410 60.705 -0.295 1 1 1591 . 7 1 1 A 157 157 THR CB C 157 71.500 71.167 0.333 1 1 1593 . 7 1 1 A 157 157 THR N N 157 113.240 112.910 0.330 1 1 1594 . 7 1 1 A 158 158 VAL H H 158 9.120 9.037 0.083 1 1 1595 . 7 1 1 A 158 158 VAL HA H 158 4.580 5.356 -0.776 1 1 1603 . 7 1 1 A 158 158 VAL C C 158 172.800 174.858 -2.058 1 1 1604 . 7 1 1 A 158 158 VAL CA C 158 59.980 60.024 -0.044 1 1 1605 . 7 1 1 A 158 158 VAL CB C 158 36.290 34.199 2.091 1 1 1608 . 7 1 1 A 158 158 VAL N N 158 121.710 122.271 -0.561 1 1 1609 . 7 1 1 A 159 159 ASN H H 159 8.240 8.823 -0.583 1 1 1610 . 7 1 1 A 159 159 ASN HA H 159 5.420 5.026 0.394 1 1 1615 . 7 1 1 A 159 159 ASN C C 159 173.800 174.202 -0.402 1 1 1616 . 7 1 1 A 159 159 ASN CA C 159 51.740 52.419 -0.679 1 1 1617 . 7 1 1 A 159 159 ASN CB C 159 40.380 39.247 1.133 1 1 1618 . 7 1 1 A 159 159 ASN N N 159 122.730 124.058 -1.328 1 1 1620 . 7 1 1 A 160 160 ILE H H 160 9.160 8.753 0.407 1 1 1621 . 7 1 1 A 160 160 ILE HA H 160 5.130 4.927 0.203 1 1 1631 . 7 1 1 A 160 160 ILE C C 160 177.320 175.667 1.653 1 1 1632 . 7 1 1 A 160 160 ILE CA C 160 60.640 60.738 -0.098 1 1 1633 . 7 1 1 A 160 160 ILE CB C 160 38.520 37.647 0.873 1 1 1637 . 7 1 1 A 160 160 ILE N N 160 123.690 125.937 -2.247 1 1 1638 . 7 1 1 A 161 161 ILE H H 161 8.780 8.848 -0.068 1 1 1639 . 7 1 1 A 161 161 ILE HA H 161 4.590 4.591 -0.001 1 1 1649 . 7 1 1 A 161 161 ILE C C 161 174.960 176.000 -1.040 1 1 1650 . 7 1 1 A 161 161 ILE CA C 161 59.320 60.389 -1.069 1 1 1651 . 7 1 1 A 161 161 ILE CB C 161 41.030 39.863 1.167 1 1 1655 . 7 1 1 A 161 161 ILE N N 161 122.490 129.034 -6.544 1 1 1656 . 7 1 1 A 162 162 GLU H H 162 8.620 8.509 0.111 1 1 1657 . 7 1 1 A 162 162 GLU HA H 162 4.290 4.385 -0.095 1 1 1662 . 7 1 1 A 162 162 GLU C C 162 176.660 176.513 0.147 1 1 1663 . 7 1 1 A 162 162 GLU CA C 162 56.470 57.341 -0.871 1 1 1664 . 7 1 1 A 162 162 GLU CB C 162 31.150 30.318 0.832 1 1 1666 . 7 1 1 A 162 162 GLU N N 162 120.520 126.074 -5.554 1 1 1667 . 7 1 1 A 163 163 GLY H H 163 8.480 8.488 -0.008 1 1 1668 . 7 1 1 A 163 163 GLY HA2 H 163 3.910 4.253 -0.343 1 1 1669 . 7 1 1 A 163 163 GLY HA3 H 163 4.150 4.256 -0.106 1 1 1670 . 7 1 1 A 163 163 GLY C C 163 174.000 172.535 1.465 1 1 1671 . 7 1 1 A 163 163 GLY CA C 163 45.270 45.778 -0.508 1 1 1672 . 7 1 1 A 163 163 GLY N N 163 110.210 109.052 1.158 1 1 1673 . 7 1 1 A 164 164 THR H H 164 8.170 8.495 -0.325 1 1 1674 . 7 1 1 A 164 164 THR HA H 164 4.410 4.931 -0.521 1 1 1679 . 7 1 1 A 164 164 THR C C 164 174.100 174.199 -0.099 1 1 1680 . 7 1 1 A 164 164 THR CA C 164 61.620 60.977 0.643 1 1 1681 . 7 1 1 A 164 164 THR CB C 164 70.060 71.922 -1.862 1 1 1683 . 7 1 1 A 164 164 THR N N 164 113.480 116.393 -2.913 1 1 1 . 8 1 1 A 13 13 GLY H H 13 8.350 8.272 0.078 1 1 2 . 8 1 1 A 13 13 GLY HA2 H 13 3.920 3.866 0.054 1 1 3 . 8 1 1 A 13 13 GLY HA3 H 13 3.920 3.932 -0.012 1 1 4 . 8 1 1 A 13 13 GLY CA C 13 45.290 45.273 0.017 1 1 5 . 8 1 1 A 13 13 GLY N N 13 110.450 107.437 3.013 1 1 6 . 8 1 1 A 14 14 LEU H H 14 8.050 8.027 0.023 1 1 7 . 8 1 1 A 14 14 LEU N N 14 121.500 117.766 3.734 1 1 8 . 8 1 1 A 15 15 VAL H H 15 8.070 7.632 0.438 1 1 9 . 8 1 1 A 15 15 VAL N N 15 122.390 113.443 8.947 1 1 10 . 8 1 1 A 16 16 PRO HA H 16 4.360 4.114 0.246 1 1 17 . 8 1 1 A 16 16 PRO CA C 16 62.770 65.563 -2.793 1 1 18 . 8 1 1 A 16 16 PRO CB C 16 32.020 31.627 0.393 1 1 21 . 8 1 1 A 21 21 MET H H 21 8.180 8.188 -0.008 1 1 22 . 8 1 1 A 21 21 MET N N 21 121.310 124.061 -2.751 1 1 23 . 8 1 1 A 22 22 ALA H H 22 8.290 8.457 -0.167 1 1 24 . 8 1 1 A 22 22 ALA N N 22 124.800 124.650 0.150 1 1 25 . 8 1 1 A 23 23 SER H H 23 8.210 8.873 -0.663 1 1 26 . 8 1 1 A 23 23 SER N N 23 114.830 120.260 -5.430 1 1 27 . 8 1 1 A 24 24 LYS H H 24 8.250 7.657 0.593 1 1 28 . 8 1 1 A 24 24 LYS N N 24 122.980 121.302 1.678 1 1 29 . 8 1 1 A 25 25 LEU H H 25 8.140 9.051 -0.911 1 1 30 . 8 1 1 A 25 25 LEU HA H 25 4.290 4.534 -0.244 1 1 40 . 8 1 1 A 25 25 LEU C C 25 177.410 177.224 0.186 1 1 41 . 8 1 1 A 25 25 LEU CA C 25 55.430 56.323 -0.893 1 1 42 . 8 1 1 A 25 25 LEU CB C 25 42.350 44.051 -1.701 1 1 46 . 8 1 1 A 25 25 LEU N N 25 122.580 125.399 -2.819 1 1 47 . 8 1 1 A 26 26 LYS H H 26 8.200 7.665 0.535 1 1 48 . 8 1 1 A 26 26 LYS HA H 26 4.260 4.595 -0.335 1 1 57 . 8 1 1 A 26 26 LYS C C 26 176.520 176.059 0.461 1 1 58 . 8 1 1 A 26 26 LYS CA C 26 56.700 55.456 1.244 1 1 59 . 8 1 1 A 26 26 LYS CB C 26 33.060 33.050 0.010 1 1 63 . 8 1 1 A 26 26 LYS N N 26 121.800 114.316 7.484 1 1 64 . 8 1 1 A 27 27 GLU H H 27 8.380 7.904 0.476 1 1 65 . 8 1 1 A 27 27 GLU HA H 27 4.240 4.845 -0.605 1 1 70 . 8 1 1 A 27 27 GLU C C 27 176.130 175.507 0.623 1 1 71 . 8 1 1 A 27 27 GLU CA C 27 56.700 54.686 2.014 1 1 72 . 8 1 1 A 27 27 GLU CB C 27 30.370 31.901 -1.531 1 1 74 . 8 1 1 A 27 27 GLU N N 27 121.700 120.042 1.658 1 1 75 . 8 1 1 A 28 28 ALA H H 28 8.230 8.685 -0.455 1 1 76 . 8 1 1 A 28 28 ALA HA H 28 4.280 4.905 -0.625 1 1 80 . 8 1 1 A 28 28 ALA C C 28 177.090 175.867 1.223 1 1 81 . 8 1 1 A 28 28 ALA CA C 28 52.530 51.215 1.315 1 1 82 . 8 1 1 A 28 28 ALA CB C 28 19.360 20.364 -1.004 1 1 83 . 8 1 1 A 28 28 ALA N N 28 124.640 122.284 2.356 1 1 84 . 8 1 1 A 29 29 ALA H H 29 8.150 8.520 -0.370 1 1 85 . 8 1 1 A 29 29 ALA HA H 29 4.320 4.653 -0.333 1 1 89 . 8 1 1 A 29 29 ALA C C 29 177.120 176.057 1.063 1 1 90 . 8 1 1 A 29 29 ALA CA C 29 52.040 51.989 0.051 1 1 91 . 8 1 1 A 29 29 ALA CB C 29 19.430 18.842 0.588 1 1 92 . 8 1 1 A 29 29 ALA N N 29 123.430 125.114 -1.684 1 1 93 . 8 1 1 A 30 30 GLU H H 30 8.310 8.420 -0.110 1 1 94 . 8 1 1 A 30 30 GLU HA H 30 4.220 4.917 -0.697 1 1 99 . 8 1 1 A 30 30 GLU C C 30 176.310 175.982 0.328 1 1 100 . 8 1 1 A 30 30 GLU CA C 30 56.630 55.268 1.362 1 1 101 . 8 1 1 A 30 30 GLU CB C 30 30.320 30.823 -0.503 1 1 103 . 8 1 1 A 30 30 GLU N N 30 120.630 119.422 1.208 1 1 104 . 8 1 1 A 31 31 VAL H H 31 8.630 8.861 -0.231 1 1 105 . 8 1 1 A 31 31 VAL HA H 31 4.430 4.781 -0.351 1 1 113 . 8 1 1 A 31 31 VAL C C 31 176.510 176.271 0.239 1 1 114 . 8 1 1 A 31 31 VAL CA C 31 62.360 63.335 -0.975 1 1 115 . 8 1 1 A 31 31 VAL CB C 31 32.370 31.785 0.585 1 1 118 . 8 1 1 A 31 31 VAL N N 31 127.110 124.778 2.332 1 1 119 . 8 1 1 A 32 32 THR H H 32 7.640 8.606 -0.966 1 1 120 . 8 1 1 A 32 32 THR HA H 32 4.870 4.018 0.852 1 1 125 . 8 1 1 A 32 32 THR C C 32 172.220 174.780 -2.560 1 1 126 . 8 1 1 A 32 32 THR CA C 32 59.510 64.780 -5.270 1 1 127 . 8 1 1 A 32 32 THR CB C 32 71.630 69.952 1.678 1 1 129 . 8 1 1 A 32 32 THR N N 32 118.860 120.815 -1.955 1 1 130 . 8 1 1 A 33 33 GLY H H 33 8.350 8.007 0.343 1 1 131 . 8 1 1 A 33 33 GLY HA2 H 33 4.160 4.062 0.098 1 1 132 . 8 1 1 A 33 33 GLY HA3 H 33 4.250 4.067 0.183 1 1 133 . 8 1 1 A 33 33 GLY C C 33 172.820 173.172 -0.352 1 1 134 . 8 1 1 A 33 33 GLY CA C 33 46.680 44.941 1.739 1 1 135 . 8 1 1 A 33 33 GLY N N 33 106.720 108.775 -2.055 1 1 136 . 8 1 1 A 34 34 SER H H 34 8.810 8.730 0.080 1 1 137 . 8 1 1 A 34 34 SER HA H 34 5.390 5.060 0.330 1 1 140 . 8 1 1 A 34 34 SER C C 34 173.780 173.111 0.669 1 1 141 . 8 1 1 A 34 34 SER CA C 34 57.380 57.455 -0.075 1 1 142 . 8 1 1 A 34 34 SER CB C 34 65.730 67.100 -1.370 1 1 143 . 8 1 1 A 34 34 SER N N 34 112.690 118.876 -6.186 1 1 144 . 8 1 1 A 35 35 VAL H H 35 8.470 8.682 -0.212 1 1 145 . 8 1 1 A 35 35 VAL HA H 35 4.120 4.541 -0.421 1 1 153 . 8 1 1 A 35 35 VAL C C 35 174.750 174.310 0.440 1 1 154 . 8 1 1 A 35 35 VAL CA C 35 62.310 60.684 1.626 1 1 155 . 8 1 1 A 35 35 VAL CB C 35 34.550 33.084 1.466 1 1 158 . 8 1 1 A 35 35 VAL N N 35 123.150 121.060 2.090 1 1 159 . 8 1 1 A 36 36 SER H H 36 8.240 8.568 -0.328 1 1 160 . 8 1 1 A 36 36 SER HA H 36 4.690 4.920 -0.230 1 1 163 . 8 1 1 A 36 36 SER C C 36 171.860 173.633 -1.773 1 1 164 . 8 1 1 A 36 36 SER CA C 36 56.020 57.167 -1.147 1 1 165 . 8 1 1 A 36 36 SER CB C 36 66.050 63.939 2.111 1 1 166 . 8 1 1 A 36 36 SER N N 36 118.760 118.695 0.065 1 1 167 . 8 1 1 A 37 37 LEU H H 37 8.310 8.873 -0.563 1 1 168 . 8 1 1 A 37 37 LEU HA H 37 4.870 5.132 -0.262 1 1 178 . 8 1 1 A 37 37 LEU C C 37 174.190 174.684 -0.494 1 1 179 . 8 1 1 A 37 37 LEU CA C 37 53.870 53.533 0.337 1 1 180 . 8 1 1 A 37 37 LEU CB C 37 47.000 43.773 3.227 1 1 184 . 8 1 1 A 37 37 LEU N N 37 124.790 127.883 -3.093 1 1 185 . 8 1 1 A 38 38 GLU H H 38 9.270 8.854 0.416 1 1 186 . 8 1 1 A 38 38 GLU HA H 38 4.650 5.188 -0.538 1 1 191 . 8 1 1 A 38 38 GLU C C 38 173.970 175.055 -1.085 1 1 192 . 8 1 1 A 38 38 GLU CA C 38 54.410 55.329 -0.919 1 1 193 . 8 1 1 A 38 38 GLU CB C 38 32.460 32.341 0.119 1 1 195 . 8 1 1 A 38 38 GLU N N 38 126.550 125.554 0.996 1 1 196 . 8 1 1 A 39 39 ALA H H 39 8.120 8.264 -0.144 1 1 197 . 8 1 1 A 39 39 ALA HA H 39 4.600 4.760 -0.160 1 1 201 . 8 1 1 A 39 39 ALA C C 39 175.930 177.163 -1.233 1 1 202 . 8 1 1 A 39 39 ALA CA C 39 51.570 51.706 -0.136 1 1 203 . 8 1 1 A 39 39 ALA CB C 39 21.780 22.542 -0.762 1 1 204 . 8 1 1 A 39 39 ALA N N 39 124.410 127.406 -2.996 1 1 205 . 8 1 1 A 40 40 LEU H H 40 7.860 8.860 -1.000 1 1 206 . 8 1 1 A 40 40 LEU HA H 40 4.230 3.996 0.234 1 1 216 . 8 1 1 A 40 40 LEU C C 40 175.940 176.674 -0.734 1 1 217 . 8 1 1 A 40 40 LEU CA C 40 55.360 57.766 -2.406 1 1 218 . 8 1 1 A 40 40 LEU CB C 40 42.990 42.828 0.162 1 1 222 . 8 1 1 A 40 40 LEU N N 40 120.640 122.349 -1.709 1 1 223 . 8 1 1 A 41 41 GLU H H 41 8.210 7.896 0.314 1 1 224 . 8 1 1 A 41 41 GLU HA H 41 4.240 4.082 0.158 1 1 229 . 8 1 1 A 41 41 GLU C C 41 176.920 174.798 2.122 1 1 230 . 8 1 1 A 41 41 GLU CA C 41 58.090 57.779 0.311 1 1 231 . 8 1 1 A 41 41 GLU CB C 41 30.530 27.048 3.482 1 1 233 . 8 1 1 A 41 41 GLU N N 41 114.680 117.571 -2.891 1 1 234 . 8 1 1 A 42 42 GLU H H 42 7.490 7.796 -0.306 1 1 235 . 8 1 1 A 42 42 GLU HA H 42 5.680 4.794 0.886 1 1 240 . 8 1 1 A 42 42 GLU C C 42 173.790 174.180 -0.390 1 1 241 . 8 1 1 A 42 42 GLU CA C 42 54.360 56.202 -1.842 1 1 242 . 8 1 1 A 42 42 GLU CB C 42 33.850 33.268 0.582 1 1 244 . 8 1 1 A 42 42 GLU N N 42 116.670 118.425 -1.755 1 1 245 . 8 1 1 A 43 43 VAL H H 43 8.550 8.845 -0.295 1 1 246 . 8 1 1 A 43 43 VAL HA H 43 4.550 4.635 -0.085 1 1 254 . 8 1 1 A 43 43 VAL C C 43 172.220 173.809 -1.589 1 1 255 . 8 1 1 A 43 43 VAL CA C 43 59.470 60.513 -1.043 1 1 256 . 8 1 1 A 43 43 VAL CB C 43 35.470 34.721 0.749 1 1 259 . 8 1 1 A 43 43 VAL N N 43 120.030 125.104 -5.074 1 1 260 . 8 1 1 A 44 44 GLN H H 44 8.470 8.580 -0.110 1 1 261 . 8 1 1 A 44 44 GLN HA H 44 4.890 4.634 0.256 1 1 268 . 8 1 1 A 44 44 GLN C C 44 176.130 175.876 0.254 1 1 269 . 8 1 1 A 44 44 GLN CA C 44 54.360 56.081 -1.721 1 1 270 . 8 1 1 A 44 44 GLN CB C 44 30.610 29.029 1.581 1 1 272 . 8 1 1 A 44 44 GLN N N 44 124.690 130.094 -5.404 1 1 274 . 8 1 1 A 45 45 VAL H H 45 8.130 8.488 -0.358 1 1 275 . 8 1 1 A 45 45 VAL HA H 45 3.030 3.991 -0.961 1 1 283 . 8 1 1 A 45 45 VAL C C 45 176.710 177.159 -0.449 1 1 284 . 8 1 1 A 45 45 VAL CA C 45 65.810 64.790 1.020 1 1 285 . 8 1 1 A 45 45 VAL CB C 45 31.960 31.495 0.465 1 1 288 . 8 1 1 A 45 45 VAL N N 45 120.450 127.532 -7.082 1 1 289 . 8 1 1 A 46 46 GLY H H 46 8.950 9.954 -1.004 1 1 290 . 8 1 1 A 46 46 GLY HA2 H 46 3.590 4.004 -0.414 1 1 291 . 8 1 1 A 46 46 GLY HA3 H 46 4.410 4.004 0.406 1 1 292 . 8 1 1 A 46 46 GLY C C 46 174.390 173.730 0.660 1 1 293 . 8 1 1 A 46 46 GLY CA C 46 44.730 45.008 -0.278 1 1 294 . 8 1 1 A 46 46 GLY N N 46 116.490 115.094 1.396 1 1 295 . 8 1 1 A 47 47 GLU H H 47 8.260 7.707 0.553 1 1 296 . 8 1 1 A 47 47 GLU HA H 47 4.460 4.742 -0.282 1 1 301 . 8 1 1 A 47 47 GLU C C 47 174.780 175.260 -0.480 1 1 302 . 8 1 1 A 47 47 GLU CA C 47 54.830 54.865 -0.035 1 1 303 . 8 1 1 A 47 47 GLU CB C 47 31.140 32.384 -1.244 1 1 305 . 8 1 1 A 47 47 GLU N N 47 120.520 121.591 -1.071 1 1 306 . 8 1 1 A 48 48 ASN H H 48 8.440 8.985 -0.545 1 1 307 . 8 1 1 A 48 48 ASN HA H 48 5.380 5.602 -0.222 1 1 312 . 8 1 1 A 48 48 ASN C C 48 174.770 172.943 1.827 1 1 313 . 8 1 1 A 48 48 ASN CA C 48 51.570 51.327 0.243 1 1 314 . 8 1 1 A 48 48 ASN CB C 48 39.010 42.387 -3.377 1 1 315 . 8 1 1 A 48 48 ASN N N 48 117.180 119.711 -2.531 1 1 317 . 8 1 1 A 49 49 LEU H H 49 9.810 8.956 0.854 1 1 318 . 8 1 1 A 49 49 LEU HA H 49 4.510 5.083 -0.573 1 1 328 . 8 1 1 A 49 49 LEU C C 49 174.560 175.250 -0.690 1 1 329 . 8 1 1 A 49 49 LEU CA C 49 53.460 53.516 -0.056 1 1 330 . 8 1 1 A 49 49 LEU CB C 49 45.520 45.787 -0.267 1 1 333 . 8 1 1 A 49 49 LEU N N 49 125.620 123.845 1.775 1 1 334 . 8 1 1 A 50 50 GLU H H 50 8.750 8.802 -0.052 1 1 335 . 8 1 1 A 50 50 GLU HA H 50 4.360 4.971 -0.611 1 1 340 . 8 1 1 A 50 50 GLU C C 50 175.340 175.253 0.087 1 1 341 . 8 1 1 A 50 50 GLU CA C 50 55.550 55.305 0.245 1 1 342 . 8 1 1 A 50 50 GLU CB C 50 29.890 31.168 -1.278 1 1 344 . 8 1 1 A 50 50 GLU N N 50 125.420 125.674 -0.254 1 1 345 . 8 1 1 A 51 51 VAL H H 51 9.230 9.153 0.077 1 1 346 . 8 1 1 A 51 51 VAL HA H 51 4.190 4.711 -0.521 1 1 354 . 8 1 1 A 51 51 VAL C C 51 175.310 175.561 -0.251 1 1 355 . 8 1 1 A 51 51 VAL CA C 51 62.520 61.244 1.276 1 1 356 . 8 1 1 A 51 51 VAL CB C 51 31.470 31.501 -0.031 1 1 359 . 8 1 1 A 51 51 VAL N N 51 129.810 124.981 4.829 1 1 360 . 8 1 1 A 52 52 GLY H H 52 9.410 8.801 0.609 1 1 361 . 8 1 1 A 52 52 GLY HA2 H 52 3.460 3.856 -0.396 1 1 362 . 8 1 1 A 52 52 GLY HA3 H 52 4.680 3.887 0.793 1 1 363 . 8 1 1 A 52 52 GLY C C 52 173.000 173.398 -0.398 1 1 364 . 8 1 1 A 52 52 GLY CA C 52 46.470 47.426 -0.956 1 1 365 . 8 1 1 A 52 52 GLY N N 52 116.600 114.141 2.459 1 1 366 . 8 1 1 A 53 53 VAL H H 53 9.130 8.942 0.188 1 1 367 . 8 1 1 A 53 53 VAL HA H 53 4.840 5.039 -0.199 1 1 375 . 8 1 1 A 53 53 VAL C C 53 175.470 175.684 -0.214 1 1 376 . 8 1 1 A 53 53 VAL CA C 53 61.350 61.500 -0.150 1 1 377 . 8 1 1 A 53 53 VAL CB C 53 34.300 31.893 2.407 1 1 380 . 8 1 1 A 53 53 VAL N N 53 129.050 121.899 7.151 1 1 381 . 8 1 1 A 54 54 GLY H H 54 8.420 8.426 -0.006 1 1 382 . 8 1 1 A 54 54 GLY HA2 H 54 3.850 3.963 -0.113 1 1 383 . 8 1 1 A 54 54 GLY HA3 H 54 3.850 3.999 -0.149 1 1 384 . 8 1 1 A 54 54 GLY C C 54 173.310 172.800 0.510 1 1 385 . 8 1 1 A 54 54 GLY CA C 54 45.180 45.416 -0.236 1 1 386 . 8 1 1 A 54 54 GLY N N 54 116.890 114.788 2.102 1 1 387 . 8 1 1 A 55 55 ILE H H 55 10.190 7.831 2.359 1 1 388 . 8 1 1 A 55 55 ILE HA H 55 4.010 4.550 -0.540 1 1 398 . 8 1 1 A 55 55 ILE C C 55 174.380 174.873 -0.493 1 1 399 . 8 1 1 A 55 55 ILE CA C 55 61.350 60.036 1.314 1 1 400 . 8 1 1 A 55 55 ILE CB C 55 40.840 41.725 -0.885 1 1 404 . 8 1 1 A 55 55 ILE N N 55 129.330 119.220 10.110 1 1 405 . 8 1 1 A 56 56 ASP H H 56 8.810 9.685 -0.875 1 1 406 . 8 1 1 A 56 56 ASP HA H 56 4.440 4.841 -0.401 1 1 409 . 8 1 1 A 56 56 ASP C C 56 175.530 176.142 -0.612 1 1 410 . 8 1 1 A 56 56 ASP CA C 56 56.460 55.623 0.837 1 1 411 . 8 1 1 A 56 56 ASP CB C 56 42.720 43.123 -0.403 1 1 412 . 8 1 1 A 56 56 ASP N N 56 128.310 126.363 1.947 1 1 413 . 8 1 1 A 57 57 GLU H H 57 7.270 7.442 -0.172 1 1 414 . 8 1 1 A 57 57 GLU HA H 57 4.290 4.800 -0.510 1 1 419 . 8 1 1 A 57 57 GLU C C 57 173.370 174.394 -1.024 1 1 420 . 8 1 1 A 57 57 GLU CA C 57 54.840 55.461 -0.621 1 1 421 . 8 1 1 A 57 57 GLU CB C 57 33.190 33.516 -0.326 1 1 423 . 8 1 1 A 57 57 GLU N N 57 112.810 116.716 -3.906 1 1 424 . 8 1 1 A 58 58 LEU H H 58 8.370 8.657 -0.287 1 1 425 . 8 1 1 A 58 58 LEU HA H 58 4.830 4.713 0.117 1 1 434 . 8 1 1 A 58 58 LEU C C 58 174.180 175.119 -0.939 1 1 435 . 8 1 1 A 58 58 LEU CA C 58 55.320 54.782 0.538 1 1 436 . 8 1 1 A 58 58 LEU CB C 58 44.300 43.054 1.246 1 1 439 . 8 1 1 A 58 58 LEU N N 58 123.130 125.690 -2.560 1 1 440 . 8 1 1 A 59 59 VAL H H 59 9.120 8.861 0.259 1 1 441 . 8 1 1 A 59 59 VAL HA H 59 4.240 5.031 -0.791 1 1 449 . 8 1 1 A 59 59 VAL C C 59 174.960 176.003 -1.043 1 1 450 . 8 1 1 A 59 59 VAL CA C 59 61.760 61.180 0.580 1 1 451 . 8 1 1 A 59 59 VAL CB C 59 33.760 32.694 1.066 1 1 454 . 8 1 1 A 59 59 VAL N N 59 127.930 125.552 2.378 1 1 455 . 8 1 1 A 60 60 ASN H H 60 8.770 8.534 0.236 1 1 456 . 8 1 1 A 60 60 ASN HA H 60 4.250 4.732 -0.482 1 1 461 . 8 1 1 A 60 60 ASN C C 60 172.810 173.869 -1.059 1 1 462 . 8 1 1 A 60 60 ASN CA C 60 54.830 54.788 0.042 1 1 463 . 8 1 1 A 60 60 ASN CB C 60 36.030 36.631 -0.601 1 1 464 . 8 1 1 A 60 60 ASN N N 60 115.500 118.521 -3.021 1 1 466 . 8 1 1 A 61 61 ALA H H 61 7.330 7.393 -0.063 1 1 467 . 8 1 1 A 61 61 ALA HA H 61 4.520 4.536 -0.016 1 1 471 . 8 1 1 A 61 61 ALA C C 61 174.580 175.103 -0.523 1 1 472 . 8 1 1 A 61 61 ALA CA C 61 51.560 51.166 0.394 1 1 473 . 8 1 1 A 61 61 ALA CB C 61 22.870 22.110 0.760 1 1 474 . 8 1 1 A 61 61 ALA N N 61 115.640 118.339 -2.699 1 1 475 . 8 1 1 A 62 62 GLU H H 62 7.900 8.630 -0.730 1 1 476 . 8 1 1 A 62 62 GLU HA H 62 4.310 4.760 -0.450 1 1 481 . 8 1 1 A 62 62 GLU C C 62 173.790 175.283 -1.493 1 1 482 . 8 1 1 A 62 62 GLU CA C 62 55.080 55.361 -0.281 1 1 483 . 8 1 1 A 62 62 GLU CB C 62 32.610 29.966 2.644 1 1 485 . 8 1 1 A 62 62 GLU N N 62 117.400 118.403 -1.003 1 1 486 . 8 1 1 A 63 63 ALA H H 63 8.910 8.871 0.039 1 1 487 . 8 1 1 A 63 63 ALA HA H 63 4.690 4.609 0.081 1 1 491 . 8 1 1 A 63 63 ALA C C 63 175.720 176.944 -1.224 1 1 492 . 8 1 1 A 63 63 ALA CA C 63 50.600 53.039 -2.439 1 1 493 . 8 1 1 A 63 63 ALA CB C 63 20.660 19.175 1.485 1 1 494 . 8 1 1 A 63 63 ALA N N 63 122.480 128.949 -6.469 1 1 495 . 8 1 1 A 64 64 PHE H H 64 9.220 9.926 -0.706 1 1 496 . 8 1 1 A 64 64 PHE HA H 64 4.320 4.647 -0.327 1 1 501 . 8 1 1 A 64 64 PHE C C 64 174.380 176.547 -2.167 1 1 502 . 8 1 1 A 64 64 PHE CA C 64 59.770 59.191 0.579 1 1 503 . 8 1 1 A 64 64 PHE CB C 64 40.830 40.084 0.746 1 1 504 . 8 1 1 A 64 64 PHE N N 64 120.870 123.101 -2.231 1 1 505 . 8 1 1 A 65 65 ALA H H 65 8.150 7.844 0.306 1 1 506 . 8 1 1 A 65 65 ALA HA H 65 5.280 4.781 0.499 1 1 510 . 8 1 1 A 65 65 ALA C C 65 175.950 174.837 1.113 1 1 511 . 8 1 1 A 65 65 ALA CA C 65 51.120 51.141 -0.021 1 1 512 . 8 1 1 A 65 65 ALA CB C 65 22.850 21.160 1.690 1 1 513 . 8 1 1 A 65 65 ALA N N 65 122.350 120.033 2.317 1 1 514 . 8 1 1 A 66 66 TYR H H 66 9.260 9.288 -0.028 1 1 515 . 8 1 1 A 66 66 TYR HA H 66 5.710 5.123 0.587 1 1 520 . 8 1 1 A 66 66 TYR C C 66 175.690 173.605 2.085 1 1 521 . 8 1 1 A 66 66 TYR CA C 66 54.390 56.527 -2.137 1 1 522 . 8 1 1 A 66 66 TYR CB C 66 41.560 39.584 1.976 1 1 523 . 8 1 1 A 66 66 TYR N N 66 124.350 126.747 -2.397 1 1 524 . 8 1 1 A 67 67 ASP H H 67 9.070 8.931 0.139 1 1 525 . 8 1 1 A 67 67 ASP HA H 67 5.630 4.898 0.732 1 1 528 . 8 1 1 A 67 67 ASP C C 67 174.300 175.249 -0.949 1 1 529 . 8 1 1 A 67 67 ASP CA C 67 51.590 52.907 -1.317 1 1 530 . 8 1 1 A 67 67 ASP CB C 67 44.380 43.237 1.143 1 1 531 . 8 1 1 A 67 67 ASP N N 67 130.490 128.578 1.912 1 1 532 . 8 1 1 A 68 68 PHE H H 68 8.670 8.284 0.386 1 1 533 . 8 1 1 A 68 68 PHE HA H 68 4.890 5.261 -0.371 1 1 538 . 8 1 1 A 68 68 PHE C C 68 172.220 172.466 -0.246 1 1 539 . 8 1 1 A 68 68 PHE CA C 68 57.360 55.589 1.771 1 1 540 . 8 1 1 A 68 68 PHE CB C 68 40.360 42.208 -1.848 1 1 541 . 8 1 1 A 68 68 PHE N N 68 118.200 120.687 -2.487 1 1 542 . 8 1 1 A 69 69 THR H H 69 8.390 8.371 0.019 1 1 543 . 8 1 1 A 69 69 THR HA H 69 5.170 4.746 0.424 1 1 548 . 8 1 1 A 69 69 THR C C 69 172.620 174.067 -1.447 1 1 549 . 8 1 1 A 69 69 THR CA C 69 61.370 61.481 -0.111 1 1 550 . 8 1 1 A 69 69 THR CB C 69 64.880 69.643 -4.763 1 1 552 . 8 1 1 A 69 69 THR N N 69 115.810 114.937 0.873 1 1 553 . 8 1 1 A 70 70 LEU H H 70 9.560 8.927 0.633 1 1 554 . 8 1 1 A 70 70 LEU HA H 70 5.270 4.701 0.569 1 1 564 . 8 1 1 A 70 70 LEU C C 70 173.800 175.587 -1.787 1 1 565 . 8 1 1 A 70 70 LEU CA C 70 53.460 55.614 -2.154 1 1 566 . 8 1 1 A 70 70 LEU CB C 70 45.040 42.956 2.084 1 1 570 . 8 1 1 A 70 70 LEU N N 70 129.220 129.758 -0.538 1 1 571 . 8 1 1 A 71 71 ASN H H 71 9.590 8.464 1.126 1 1 572 . 8 1 1 A 71 71 ASN HA H 71 5.880 5.832 0.048 1 1 577 . 8 1 1 A 71 71 ASN C C 71 177.970 173.496 4.474 1 1 578 . 8 1 1 A 71 71 ASN CA C 71 52.060 51.522 0.538 1 1 579 . 8 1 1 A 71 71 ASN CB C 71 41.020 43.046 -2.026 1 1 580 . 8 1 1 A 71 71 ASN N N 71 125.970 122.373 3.597 1 1 582 . 8 1 1 A 72 72 TYR H H 72 8.740 9.586 -0.846 1 1 583 . 8 1 1 A 72 72 TYR HA H 72 5.110 5.190 -0.080 1 1 588 . 8 1 1 A 72 72 TYR C C 72 177.720 171.754 5.966 1 1 589 . 8 1 1 A 72 72 TYR CA C 72 55.310 56.074 -0.764 1 1 590 . 8 1 1 A 72 72 TYR CB C 72 41.510 40.120 1.390 1 1 591 . 8 1 1 A 72 72 TYR N N 72 119.640 116.700 2.940 1 1 592 . 8 1 1 A 73 73 ASP H H 73 9.780 8.990 0.790 1 1 593 . 8 1 1 A 73 73 ASP HA H 73 4.680 4.899 -0.219 1 1 596 . 8 1 1 A 73 73 ASP C C 73 177.290 177.005 0.285 1 1 597 . 8 1 1 A 73 73 ASP CA C 73 53.650 53.881 -0.231 1 1 598 . 8 1 1 A 73 73 ASP CB C 73 40.900 42.693 -1.793 1 1 599 . 8 1 1 A 73 73 ASP N N 73 119.290 121.166 -1.876 1 1 600 . 8 1 1 A 74 74 GLU H H 74 9.430 8.523 0.907 1 1 601 . 8 1 1 A 74 74 GLU HA H 74 4.740 4.513 0.227 1 1 606 . 8 1 1 A 74 74 GLU C C 74 176.320 176.800 -0.480 1 1 607 . 8 1 1 A 74 74 GLU CA C 74 57.410 56.581 0.829 1 1 608 . 8 1 1 A 74 74 GLU CB C 74 29.490 30.754 -1.264 1 1 610 . 8 1 1 A 74 74 GLU N N 74 130.930 122.432 8.498 1 1 611 . 8 1 1 A 75 75 ASN H H 75 8.680 8.075 0.605 1 1 612 . 8 1 1 A 75 75 ASN HA H 75 4.600 4.792 -0.192 1 1 617 . 8 1 1 A 75 75 ASN C C 75 175.340 175.616 -0.276 1 1 618 . 8 1 1 A 75 75 ASN CA C 75 54.620 53.311 1.309 1 1 619 . 8 1 1 A 75 75 ASN CB C 75 38.770 39.276 -0.506 1 1 620 . 8 1 1 A 75 75 ASN N N 75 115.040 117.704 -2.664 1 1 622 . 8 1 1 A 76 76 ALA H H 76 7.740 8.060 -0.320 1 1 623 . 8 1 1 A 76 76 ALA HA H 76 4.310 4.423 -0.113 1 1 627 . 8 1 1 A 76 76 ALA C C 76 175.550 177.148 -1.598 1 1 628 . 8 1 1 A 76 76 ALA CA C 76 53.260 53.396 -0.136 1 1 629 . 8 1 1 A 76 76 ALA CB C 76 21.450 21.276 0.174 1 1 630 . 8 1 1 A 76 76 ALA N N 76 122.200 121.391 0.809 1 1 631 . 8 1 1 A 77 77 PHE H H 77 8.070 8.189 -0.119 1 1 632 . 8 1 1 A 77 77 PHE HA H 77 5.650 4.977 0.673 1 1 637 . 8 1 1 A 77 77 PHE C C 77 174.570 175.378 -0.808 1 1 638 . 8 1 1 A 77 77 PHE CA C 77 56.360 57.465 -1.105 1 1 639 . 8 1 1 A 77 77 PHE CB C 77 46.080 40.843 5.237 1 1 640 . 8 1 1 A 77 77 PHE N N 77 114.160 115.408 -1.248 1 1 641 . 8 1 1 A 78 78 GLU H H 78 8.800 8.940 -0.140 1 1 642 . 8 1 1 A 78 78 GLU HA H 78 4.900 4.952 -0.052 1 1 647 . 8 1 1 A 78 78 GLU C C 78 175.950 174.673 1.277 1 1 648 . 8 1 1 A 78 78 GLU CA C 78 53.670 56.433 -2.763 1 1 649 . 8 1 1 A 78 78 GLU CB C 78 33.600 32.453 1.147 1 1 651 . 8 1 1 A 78 78 GLU N N 78 117.590 120.766 -3.176 1 1 652 . 8 1 1 A 79 79 TYR H H 79 8.770 9.731 -0.961 1 1 653 . 8 1 1 A 79 79 TYR HA H 79 4.250 4.163 0.087 1 1 658 . 8 1 1 A 79 79 TYR C C 79 174.580 174.945 -0.365 1 1 659 . 8 1 1 A 79 79 TYR CA C 79 59.250 59.601 -0.351 1 1 660 . 8 1 1 A 79 79 TYR CB C 79 38.310 39.244 -0.934 1 1 661 . 8 1 1 A 79 79 TYR N N 79 126.560 129.297 -2.737 1 1 662 . 8 1 1 A 80 80 VAL H H 80 8.220 8.290 -0.070 1 1 663 . 8 1 1 A 80 80 VAL HA H 80 3.690 3.865 -0.175 1 1 671 . 8 1 1 A 80 80 VAL C C 80 174.780 175.454 -0.674 1 1 672 . 8 1 1 A 80 80 VAL CA C 80 64.400 62.779 1.621 1 1 673 . 8 1 1 A 80 80 VAL CB C 80 33.510 32.852 0.658 1 1 676 . 8 1 1 A 80 80 VAL N N 80 129.460 124.709 4.751 1 1 677 . 8 1 1 A 81 81 GLU H H 81 6.920 7.574 -0.654 1 1 678 . 8 1 1 A 81 81 GLU HA H 81 4.260 4.646 -0.386 1 1 683 . 8 1 1 A 81 81 GLU C C 81 171.840 174.832 -2.992 1 1 684 . 8 1 1 A 81 81 GLU CA C 81 55.310 55.215 0.095 1 1 685 . 8 1 1 A 81 81 GLU CB C 81 30.520 33.118 -2.598 1 1 687 . 8 1 1 A 81 81 GLU N N 81 112.430 114.913 -2.483 1 1 688 . 8 1 1 A 82 82 ALA H H 82 8.310 8.632 -0.322 1 1 689 . 8 1 1 A 82 82 ALA HA H 82 5.650 5.096 0.554 1 1 693 . 8 1 1 A 82 82 ALA C C 82 176.110 176.904 -0.794 1 1 694 . 8 1 1 A 82 82 ALA CA C 82 50.620 51.813 -1.193 1 1 695 . 8 1 1 A 82 82 ALA CB C 82 21.770 20.007 1.763 1 1 696 . 8 1 1 A 82 82 ALA N N 82 121.240 124.491 -3.251 1 1 697 . 8 1 1 A 83 83 ILE H H 83 9.150 8.811 0.339 1 1 698 . 8 1 1 A 83 83 ILE HA H 83 4.600 4.884 -0.284 1 1 708 . 8 1 1 A 83 83 ILE C C 83 174.810 174.749 0.061 1 1 709 . 8 1 1 A 83 83 ILE CA C 83 60.060 59.414 0.646 1 1 710 . 8 1 1 A 83 83 ILE CB C 83 42.440 42.613 -0.173 1 1 714 . 8 1 1 A 83 83 ILE N N 83 119.720 119.233 0.487 1 1 715 . 8 1 1 A 84 84 SER H H 84 8.350 8.740 -0.390 1 1 716 . 8 1 1 A 84 84 SER HA H 84 4.660 4.921 -0.261 1 1 719 . 8 1 1 A 84 84 SER C C 84 177.550 172.648 4.902 1 1 720 . 8 1 1 A 84 84 SER CA C 84 57.330 57.440 -0.110 1 1 721 . 8 1 1 A 84 84 SER CB C 84 66.490 67.034 -0.544 1 1 722 . 8 1 1 A 84 84 SER N N 84 116.740 121.132 -4.392 1 1 723 . 8 1 1 A 85 85 ASP H H 85 8.740 8.773 -0.033 1 1 724 . 8 1 1 A 85 85 ASP HA H 85 4.820 4.687 0.133 1 1 727 . 8 1 1 A 85 85 ASP C C 85 176.090 176.642 -0.552 1 1 728 . 8 1 1 A 85 85 ASP CA C 85 53.480 53.269 0.211 1 1 729 . 8 1 1 A 85 85 ASP CB C 85 42.480 42.417 0.063 1 1 730 . 8 1 1 A 85 85 ASP N N 85 120.960 122.501 -1.541 1 1 731 . 8 1 1 A 86 86 ASP H H 86 8.380 8.880 -0.500 1 1 732 . 8 1 1 A 86 86 ASP HA H 86 4.450 4.891 -0.441 1 1 735 . 8 1 1 A 86 86 ASP C C 86 177.100 177.113 -0.013 1 1 736 . 8 1 1 A 86 86 ASP CA C 86 56.240 54.237 2.003 1 1 737 . 8 1 1 A 86 86 ASP CB C 86 41.100 41.461 -0.361 1 1 738 . 8 1 1 A 86 86 ASP N N 86 117.710 121.461 -3.751 1 1 739 . 8 1 1 A 87 87 GLY H H 87 8.690 7.890 0.800 1 1 740 . 8 1 1 A 87 87 GLY HA2 H 87 3.870 4.123 -0.253 1 1 741 . 8 1 1 A 87 87 GLY HA3 H 87 4.090 4.133 -0.043 1 1 742 . 8 1 1 A 87 87 GLY C C 87 173.800 173.789 0.011 1 1 743 . 8 1 1 A 87 87 GLY CA C 87 45.770 45.834 -0.064 1 1 744 . 8 1 1 A 87 87 GLY N N 87 108.540 107.775 0.765 1 1 745 . 8 1 1 A 88 88 VAL H H 88 7.910 7.619 0.291 1 1 746 . 8 1 1 A 88 88 VAL HA H 88 4.780 4.279 0.501 1 1 754 . 8 1 1 A 88 88 VAL C C 88 173.970 175.266 -1.296 1 1 755 . 8 1 1 A 88 88 VAL CA C 88 60.900 61.848 -0.948 1 1 756 . 8 1 1 A 88 88 VAL CB C 88 35.460 33.150 2.310 1 1 759 . 8 1 1 A 88 88 VAL N N 88 119.790 119.268 0.522 1 1 760 . 8 1 1 A 89 89 PHE H H 89 9.210 8.670 0.540 1 1 761 . 8 1 1 A 89 89 PHE HA H 89 4.930 5.438 -0.508 1 1 766 . 8 1 1 A 89 89 PHE C C 89 173.970 173.284 0.686 1 1 767 . 8 1 1 A 89 89 PHE CA C 89 56.450 55.057 1.393 1 1 768 . 8 1 1 A 89 89 PHE CB C 89 41.120 41.614 -0.494 1 1 769 . 8 1 1 A 89 89 PHE N N 89 126.780 127.473 -0.693 1 1 770 . 8 1 1 A 90 90 VAL H H 90 7.880 8.886 -1.006 1 1 771 . 8 1 1 A 90 90 VAL HA H 90 4.860 5.311 -0.451 1 1 779 . 8 1 1 A 90 90 VAL C C 90 173.190 174.292 -1.102 1 1 780 . 8 1 1 A 90 90 VAL CA C 90 59.750 59.929 -0.179 1 1 781 . 8 1 1 A 90 90 VAL CB C 90 34.770 34.229 0.541 1 1 784 . 8 1 1 A 90 90 VAL N N 90 124.990 128.511 -3.521 1 1 785 . 8 1 1 A 91 91 ASN H H 91 8.670 9.694 -1.024 1 1 786 . 8 1 1 A 91 91 ASN HA H 91 4.730 5.566 -0.836 1 1 791 . 8 1 1 A 91 91 ASN C C 91 173.200 174.474 -1.274 1 1 792 . 8 1 1 A 91 91 ASN CA C 91 51.970 51.727 0.243 1 1 793 . 8 1 1 A 91 91 ASN CB C 91 41.340 42.233 -0.893 1 1 794 . 8 1 1 A 91 91 ASN N N 91 124.860 125.592 -0.732 1 1 796 . 8 1 1 A 92 92 ALA H H 92 8.840 9.217 -0.377 1 1 797 . 8 1 1 A 92 92 ALA HA H 92 5.290 5.387 -0.097 1 1 801 . 8 1 1 A 92 92 ALA C C 92 176.330 176.274 0.056 1 1 802 . 8 1 1 A 92 92 ALA CA C 92 50.170 50.973 -0.803 1 1 803 . 8 1 1 A 92 92 ALA CB C 92 23.610 21.565 2.045 1 1 804 . 8 1 1 A 92 92 ALA N N 92 128.510 128.923 -0.413 1 1 805 . 8 1 1 A 93 93 LYS H H 93 8.670 9.239 -0.569 1 1 806 . 8 1 1 A 93 93 LYS HA H 93 4.460 4.845 -0.385 1 1 815 . 8 1 1 A 93 93 LYS C C 93 174.170 175.075 -0.905 1 1 816 . 8 1 1 A 93 93 LYS CA C 93 55.010 54.845 0.165 1 1 817 . 8 1 1 A 93 93 LYS CB C 93 36.430 35.645 0.785 1 1 821 . 8 1 1 A 93 93 LYS N N 93 121.300 120.252 1.048 1 1 822 . 8 1 1 A 94 94 LYS H H 94 8.960 8.703 0.257 1 1 823 . 8 1 1 A 94 94 LYS HA H 94 4.460 4.147 0.313 1 1 832 . 8 1 1 A 94 94 LYS C C 94 176.330 176.910 -0.580 1 1 833 . 8 1 1 A 94 94 LYS CA C 94 56.720 56.672 0.048 1 1 834 . 8 1 1 A 94 94 LYS CB C 94 31.930 32.731 -0.801 1 1 837 . 8 1 1 A 94 94 LYS N N 94 127.060 127.447 -0.387 1 1 838 . 8 1 1 A 95 95 ILE H H 95 8.290 8.685 -0.395 1 1 839 . 8 1 1 A 95 95 ILE HA H 95 4.120 4.129 -0.009 1 1 849 . 8 1 1 A 95 95 ILE C C 95 175.740 175.226 0.514 1 1 850 . 8 1 1 A 95 95 ILE CA C 95 62.760 62.699 0.061 1 1 851 . 8 1 1 A 95 95 ILE CB C 95 38.890 39.266 -0.376 1 1 855 . 8 1 1 A 95 95 ILE N N 95 126.530 128.075 -1.545 1 1 856 . 8 1 1 A 96 96 GLU H H 96 8.030 7.333 0.697 1 1 857 . 8 1 1 A 96 96 GLU HA H 96 4.450 4.609 -0.159 1 1 862 . 8 1 1 A 96 96 GLU C C 96 174.380 174.078 0.302 1 1 863 . 8 1 1 A 96 96 GLU CA C 96 54.320 55.402 -1.082 1 1 864 . 8 1 1 A 96 96 GLU CB C 96 32.770 33.021 -0.251 1 1 866 . 8 1 1 A 96 96 GLU N N 96 117.080 120.317 -3.237 1 1 867 . 8 1 1 A 97 97 ASP H H 97 8.730 8.765 -0.035 1 1 868 . 8 1 1 A 97 97 ASP HA H 97 4.360 4.576 -0.216 1 1 871 . 8 1 1 A 97 97 ASP C C 97 177.100 176.986 0.114 1 1 872 . 8 1 1 A 97 97 ASP CA C 97 57.160 55.406 1.754 1 1 873 . 8 1 1 A 97 97 ASP CB C 97 39.920 40.612 -0.692 1 1 874 . 8 1 1 A 97 97 ASP N N 97 120.570 121.095 -0.525 1 1 875 . 8 1 1 A 98 98 GLY H H 98 8.760 8.599 0.161 1 1 876 . 8 1 1 A 98 98 GLY HA2 H 98 2.120 1.699 0.421 1 1 877 . 8 1 1 A 98 98 GLY HA3 H 98 3.910 3.393 0.517 1 1 878 . 8 1 1 A 98 98 GLY C C 98 174.000 172.857 1.143 1 1 879 . 8 1 1 A 98 98 GLY CA C 98 45.720 45.241 0.479 1 1 880 . 8 1 1 A 98 98 GLY N N 98 112.090 111.458 0.632 1 1 881 . 8 1 1 A 99 99 LYS H H 99 7.890 7.181 0.709 1 1 882 . 8 1 1 A 99 99 LYS HA H 99 5.330 4.760 0.570 1 1 891 . 8 1 1 A 99 99 LYS C C 99 174.750 174.356 0.394 1 1 892 . 8 1 1 A 99 99 LYS CA C 99 55.990 54.824 1.166 1 1 893 . 8 1 1 A 99 99 LYS CB C 99 37.840 35.476 2.364 1 1 897 . 8 1 1 A 99 99 LYS N N 99 118.050 114.796 3.254 1 1 898 . 8 1 1 A 100 100 VAL H H 100 8.980 8.571 0.409 1 1 899 . 8 1 1 A 100 100 VAL HA H 100 4.510 4.725 -0.215 1 1 907 . 8 1 1 A 100 100 VAL C C 100 174.760 173.959 0.801 1 1 908 . 8 1 1 A 100 100 VAL CA C 100 60.130 59.048 1.082 1 1 909 . 8 1 1 A 100 100 VAL CB C 100 35.240 35.778 -0.538 1 1 912 . 8 1 1 A 100 100 VAL N N 100 123.850 119.561 4.289 1 1 913 . 8 1 1 A 101 101 ARG H H 101 8.810 8.217 0.593 1 1 914 . 8 1 1 A 101 101 ARG HA H 101 4.850 4.491 0.359 1 1 921 . 8 1 1 A 101 101 ARG C C 101 174.770 174.802 -0.032 1 1 922 . 8 1 1 A 101 101 ARG CA C 101 54.580 55.299 -0.719 1 1 923 . 8 1 1 A 101 101 ARG CB C 101 32.400 31.260 1.140 1 1 926 . 8 1 1 A 101 101 ARG N N 101 129.210 123.836 5.374 1 1 927 . 8 1 1 A 102 102 VAL H H 102 9.100 8.083 1.017 1 1 928 . 8 1 1 A 102 102 VAL HA H 102 4.120 4.808 -0.688 1 1 936 . 8 1 1 A 102 102 VAL C C 102 171.640 173.726 -2.086 1 1 937 . 8 1 1 A 102 102 VAL CA C 102 61.350 59.311 2.039 1 1 938 . 8 1 1 A 102 102 VAL CB C 102 32.530 34.435 -1.905 1 1 941 . 8 1 1 A 102 102 VAL N N 102 130.470 122.296 8.174 1 1 942 . 8 1 1 A 103 103 LEU H H 103 8.110 9.192 -1.082 1 1 943 . 8 1 1 A 103 103 LEU HA H 103 5.120 4.912 0.208 1 1 953 . 8 1 1 A 103 103 LEU C C 103 176.410 174.817 1.593 1 1 954 . 8 1 1 A 103 103 LEU CA C 103 53.380 53.302 0.078 1 1 955 . 8 1 1 A 103 103 LEU CB C 103 43.680 43.947 -0.267 1 1 959 . 8 1 1 A 103 103 LEU N N 103 125.560 128.699 -3.139 1 1 960 . 8 1 1 A 104 104 VAL H H 104 9.580 9.041 0.539 1 1 961 . 8 1 1 A 104 104 VAL HA H 104 5.260 5.085 0.175 1 1 969 . 8 1 1 A 104 104 VAL C C 104 176.030 174.272 1.758 1 1 970 . 8 1 1 A 104 104 VAL CA C 104 60.220 59.702 0.518 1 1 971 . 8 1 1 A 104 104 VAL CB C 104 34.310 35.043 -0.733 1 1 974 . 8 1 1 A 104 104 VAL N N 104 125.790 126.166 -0.376 1 1 975 . 8 1 1 A 105 105 SER H H 105 9.340 8.867 0.473 1 1 976 . 8 1 1 A 105 105 SER HA H 105 5.300 5.088 0.212 1 1 979 . 8 1 1 A 105 105 SER C C 105 173.600 173.133 0.467 1 1 980 . 8 1 1 A 105 105 SER CA C 105 57.450 57.371 0.079 1 1 981 . 8 1 1 A 105 105 SER CB C 105 65.600 66.778 -1.178 1 1 982 . 8 1 1 A 105 105 SER N N 105 119.220 122.384 -3.164 1 1 983 . 8 1 1 A 106 106 SER H H 106 8.350 9.042 -0.692 1 1 984 . 8 1 1 A 106 106 SER HA H 106 4.720 4.457 0.263 1 1 987 . 8 1 1 A 106 106 SER C C 106 176.930 174.550 2.380 1 1 988 . 8 1 1 A 106 106 SER CA C 106 58.170 59.331 -1.161 1 1 989 . 8 1 1 A 106 106 SER CB C 106 64.170 62.631 1.539 1 1 990 . 8 1 1 A 106 106 SER N N 106 114.800 120.278 -5.478 1 1 991 . 8 1 1 A 107 107 LEU H H 107 8.770 8.919 -0.149 1 1 992 . 8 1 1 A 107 107 LEU HA H 107 4.710 4.193 0.517 1 1 1001 . 8 1 1 A 107 107 LEU C C 107 178.280 178.398 -0.118 1 1 1002 . 8 1 1 A 107 107 LEU CA C 107 55.280 57.339 -2.059 1 1 1003 . 8 1 1 A 107 107 LEU CB C 107 43.410 41.847 1.563 1 1 1007 . 8 1 1 A 107 107 LEU N N 107 127.210 128.080 -0.870 1 1 1008 . 8 1 1 A 108 108 THR H H 108 8.210 7.815 0.395 1 1 1009 . 8 1 1 A 108 108 THR HA H 108 4.400 4.290 0.110 1 1 1015 . 8 1 1 A 108 108 THR C C 108 176.130 175.721 0.409 1 1 1016 . 8 1 1 A 108 108 THR CA C 108 62.050 63.352 -1.302 1 1 1017 . 8 1 1 A 108 108 THR CB C 108 70.910 70.333 0.577 1 1 1019 . 8 1 1 A 108 108 THR N N 108 108.810 110.766 -1.956 1 1 1020 . 8 1 1 A 109 109 GLY H H 109 8.250 7.754 0.496 1 1 1021 . 8 1 1 A 109 109 GLY HA2 H 109 3.780 4.061 -0.281 1 1 1022 . 8 1 1 A 109 109 GLY HA3 H 109 4.290 4.076 0.214 1 1 1023 . 8 1 1 A 109 109 GLY C C 109 173.180 174.188 -1.008 1 1 1024 . 8 1 1 A 109 109 GLY CA C 109 45.340 45.156 0.184 1 1 1025 . 8 1 1 A 109 109 GLY N N 109 110.160 110.904 -0.744 1 1 1026 . 8 1 1 A 110 110 GLU H H 110 7.960 7.596 0.364 1 1 1027 . 8 1 1 A 110 110 GLU HA H 110 4.760 4.779 -0.019 1 1 1032 . 8 1 1 A 110 110 GLU CA C 110 53.450 53.514 -0.064 1 1 1033 . 8 1 1 A 110 110 GLU CB C 110 30.020 29.898 0.122 1 1 1035 . 8 1 1 A 110 110 GLU N N 110 119.720 120.684 -0.964 1 1 1036 . 8 1 1 A 111 111 PRO HA H 111 3.250 4.152 -0.902 1 1 1043 . 8 1 1 A 111 111 PRO C C 111 176.710 175.971 0.739 1 1 1044 . 8 1 1 A 111 111 PRO CA C 111 62.240 62.218 0.022 1 1 1045 . 8 1 1 A 111 111 PRO CB C 111 31.990 31.770 0.220 1 1 1048 . 8 1 1 A 112 112 LEU H H 112 8.840 7.711 1.129 1 1 1049 . 8 1 1 A 112 112 LEU HA H 112 4.290 4.219 0.071 1 1 1059 . 8 1 1 A 112 112 LEU CA C 112 52.220 53.666 -1.446 1 1 1060 . 8 1 1 A 112 112 LEU CB C 112 41.090 41.599 -0.509 1 1 1063 . 8 1 1 A 112 112 LEU N N 112 122.420 122.042 0.378 1 1 1064 . 8 1 1 A 113 113 PRO HA H 113 4.380 4.247 0.133 1 1 1071 . 8 1 1 A 113 113 PRO C C 113 176.100 177.534 -1.434 1 1 1072 . 8 1 1 A 113 113 PRO CA C 113 61.930 64.171 -2.241 1 1 1073 . 8 1 1 A 113 113 PRO CB C 113 32.470 31.817 0.653 1 1 1076 . 8 1 1 A 114 114 ALA H H 114 8.070 7.837 0.233 1 1 1077 . 8 1 1 A 114 114 ALA HA H 114 4.550 3.986 0.564 1 1 1081 . 8 1 1 A 114 114 ALA C C 114 177.490 177.405 0.085 1 1 1082 . 8 1 1 A 114 114 ALA CA C 114 51.340 53.995 -2.655 1 1 1083 . 8 1 1 A 114 114 ALA CB C 114 19.940 18.096 1.844 1 1 1084 . 8 1 1 A 114 114 ALA N N 114 121.460 120.183 1.277 1 1 1085 . 8 1 1 A 115 115 LYS H H 115 9.000 8.906 0.094 1 1 1086 . 8 1 1 A 115 115 LYS HA H 115 3.930 3.835 0.095 1 1 1095 . 8 1 1 A 115 115 LYS C C 115 175.740 175.419 0.321 1 1 1096 . 8 1 1 A 115 115 LYS CA C 115 57.580 57.600 -0.020 1 1 1097 . 8 1 1 A 115 115 LYS CB C 115 29.510 30.444 -0.934 1 1 1101 . 8 1 1 A 115 115 LYS N N 115 112.560 115.298 -2.738 1 1 1102 . 8 1 1 A 116 116 GLU H H 116 7.620 7.655 -0.035 1 1 1103 . 8 1 1 A 116 116 GLU HA H 116 4.550 4.627 -0.077 1 1 1108 . 8 1 1 A 116 116 GLU C C 116 176.110 174.903 1.207 1 1 1109 . 8 1 1 A 116 116 GLU CA C 116 54.570 54.995 -0.425 1 1 1110 . 8 1 1 A 116 116 GLU CB C 116 33.680 32.397 1.283 1 1 1112 . 8 1 1 A 116 116 GLU N N 116 115.710 117.758 -2.048 1 1 1113 . 8 1 1 A 117 117 VAL H H 117 8.770 8.906 -0.136 1 1 1114 . 8 1 1 A 117 117 VAL HA H 117 3.200 4.184 -0.984 1 1 1122 . 8 1 1 A 117 117 VAL C C 117 175.740 175.662 0.078 1 1 1123 . 8 1 1 A 117 117 VAL CA C 117 65.340 62.860 2.480 1 1 1124 . 8 1 1 A 117 117 VAL CB C 117 31.290 31.230 0.060 1 1 1127 . 8 1 1 A 117 117 VAL N N 117 124.450 120.456 3.994 1 1 1128 . 8 1 1 A 118 118 LEU H H 118 8.550 8.970 -0.420 1 1 1129 . 8 1 1 A 118 118 LEU HA H 118 4.540 4.467 0.073 1 1 1139 . 8 1 1 A 118 118 LEU C C 118 176.210 177.280 -1.070 1 1 1140 . 8 1 1 A 118 118 LEU CA C 118 55.510 55.990 -0.480 1 1 1141 . 8 1 1 A 118 118 LEU CB C 118 44.600 42.757 1.843 1 1 1145 . 8 1 1 A 118 118 LEU N N 118 128.440 128.849 -0.409 1 1 1146 . 8 1 1 A 119 119 ALA H H 119 7.970 7.681 0.289 1 1 1147 . 8 1 1 A 119 119 ALA HA H 119 4.740 4.835 -0.095 1 1 1151 . 8 1 1 A 119 119 ALA C C 119 174.570 175.233 -0.663 1 1 1152 . 8 1 1 A 119 119 ALA CA C 119 50.770 51.665 -0.895 1 1 1153 . 8 1 1 A 119 119 ALA CB C 119 22.450 22.563 -0.113 1 1 1154 . 8 1 1 A 119 119 ALA N N 119 118.100 117.471 0.629 1 1 1155 . 8 1 1 A 120 120 LYS H H 120 8.760 8.817 -0.057 1 1 1156 . 8 1 1 A 120 120 LYS HA H 120 5.240 5.394 -0.154 1 1 1165 . 8 1 1 A 120 120 LYS C C 120 175.340 175.463 -0.123 1 1 1166 . 8 1 1 A 120 120 LYS CA C 120 54.220 55.227 -1.007 1 1 1167 . 8 1 1 A 120 120 LYS CB C 120 34.340 34.127 0.213 1 1 1171 . 8 1 1 A 120 120 LYS N N 120 120.010 121.136 -1.126 1 1 1172 . 8 1 1 A 121 121 VAL H H 121 9.410 8.930 0.480 1 1 1173 . 8 1 1 A 121 121 VAL HA H 121 4.230 4.493 -0.263 1 1 1181 . 8 1 1 A 121 121 VAL C C 121 173.980 175.171 -1.191 1 1 1182 . 8 1 1 A 121 121 VAL CA C 121 62.370 62.394 -0.024 1 1 1183 . 8 1 1 A 121 121 VAL CB C 121 32.410 32.125 0.285 1 1 1186 . 8 1 1 A 121 121 VAL N N 121 124.960 125.518 -0.558 1 1 1187 . 8 1 1 A 122 122 VAL H H 122 9.280 8.064 1.216 1 1 1188 . 8 1 1 A 122 122 VAL HA H 122 4.360 4.835 -0.475 1 1 1196 . 8 1 1 A 122 122 VAL C C 122 174.190 175.079 -0.889 1 1 1197 . 8 1 1 A 122 122 VAL CA C 122 62.760 61.157 1.603 1 1 1198 . 8 1 1 A 122 122 VAL CB C 122 32.020 32.413 -0.393 1 1 1201 . 8 1 1 A 122 122 VAL N N 122 128.990 124.162 4.828 1 1 1202 . 8 1 1 A 123 123 LEU H H 123 8.610 8.745 -0.135 1 1 1203 . 8 1 1 A 123 123 LEU HA H 123 4.900 4.410 0.490 1 1 1213 . 8 1 1 A 123 123 LEU C C 123 174.950 176.724 -1.774 1 1 1214 . 8 1 1 A 123 123 LEU CA C 123 52.050 53.748 -1.698 1 1 1215 . 8 1 1 A 123 123 LEU CB C 123 45.210 41.081 4.129 1 1 1219 . 8 1 1 A 123 123 LEU N N 123 127.200 128.456 -1.256 1 1 1220 . 8 1 1 A 124 124 ARG H H 124 9.540 8.875 0.665 1 1 1221 . 8 1 1 A 124 124 ARG HA H 124 4.900 4.333 0.567 1 1 1229 . 8 1 1 A 124 124 ARG C C 124 176.320 175.928 0.392 1 1 1230 . 8 1 1 A 124 124 ARG CA C 124 55.320 57.147 -1.827 1 1 1231 . 8 1 1 A 124 124 ARG CB C 124 31.750 30.587 1.163 1 1 1234 . 8 1 1 A 124 124 ARG N N 124 124.290 126.162 -1.872 1 1 1236 . 8 1 1 A 125 125 ALA H H 125 8.880 8.571 0.309 1 1 1237 . 8 1 1 A 125 125 ALA HA H 125 4.380 4.104 0.276 1 1 1241 . 8 1 1 A 125 125 ALA C C 125 177.290 177.778 -0.488 1 1 1242 . 8 1 1 A 125 125 ALA CA C 125 52.530 51.218 1.312 1 1 1243 . 8 1 1 A 125 125 ALA CB C 125 19.870 17.110 2.760 1 1 1244 . 8 1 1 A 125 125 ALA N N 125 130.790 129.786 1.004 1 1 1245 . 8 1 1 A 126 126 GLU H H 126 9.260 8.545 0.715 1 1 1246 . 8 1 1 A 126 126 GLU HA H 126 4.460 4.362 0.098 1 1 1251 . 8 1 1 A 126 126 GLU C C 126 176.120 176.042 0.078 1 1 1252 . 8 1 1 A 126 126 GLU CA C 126 56.940 57.045 -0.105 1 1 1253 . 8 1 1 A 126 126 GLU CB C 126 32.450 30.108 2.342 1 1 1255 . 8 1 1 A 126 126 GLU N N 126 125.740 123.310 2.430 1 1 1256 . 8 1 1 A 127 127 ALA H H 127 7.460 7.511 -0.051 1 1 1257 . 8 1 1 A 127 127 ALA HA H 127 4.360 4.603 -0.243 1 1 1261 . 8 1 1 A 127 127 ALA C C 127 173.400 175.796 -2.396 1 1 1262 . 8 1 1 A 127 127 ALA CA C 127 51.360 51.634 -0.274 1 1 1263 . 8 1 1 A 127 127 ALA CB C 127 22.180 21.968 0.212 1 1 1264 . 8 1 1 A 127 127 ALA N N 127 120.910 119.628 1.282 1 1 1265 . 8 1 1 A 128 128 LYS H H 128 7.940 8.677 -0.737 1 1 1266 . 8 1 1 A 128 128 LYS HA H 128 3.580 4.139 -0.559 1 1 1275 . 8 1 1 A 128 128 LYS C C 128 176.080 175.775 0.305 1 1 1276 . 8 1 1 A 128 128 LYS CA C 128 56.860 57.167 -0.307 1 1 1277 . 8 1 1 A 128 128 LYS CB C 128 33.170 33.136 0.034 1 1 1281 . 8 1 1 A 128 128 LYS N N 128 116.520 124.565 -8.045 1 1 1282 . 8 1 1 A 129 129 ALA H H 129 8.590 8.643 -0.053 1 1 1283 . 8 1 1 A 129 129 ALA HA H 129 4.390 4.651 -0.261 1 1 1287 . 8 1 1 A 129 129 ALA C C 129 174.970 175.737 -0.767 1 1 1288 . 8 1 1 A 129 129 ALA CA C 129 52.970 51.376 1.594 1 1 1289 . 8 1 1 A 129 129 ALA CB C 129 21.500 18.796 2.704 1 1 1290 . 8 1 1 A 129 129 ALA N N 129 124.710 127.749 -3.039 1 1 1291 . 8 1 1 A 130 130 GLU H H 130 8.660 8.166 0.494 1 1 1292 . 8 1 1 A 130 130 GLU HA H 130 4.660 4.188 0.472 1 1 1297 . 8 1 1 A 130 130 GLU C C 130 177.390 177.042 0.348 1 1 1298 . 8 1 1 A 130 130 GLU CA C 130 55.070 57.583 -2.513 1 1 1299 . 8 1 1 A 130 130 GLU CB C 130 30.860 29.147 1.713 1 1 1301 . 8 1 1 A 130 130 GLU N N 130 123.180 118.298 4.882 1 1 1302 . 8 1 1 A 131 131 GLY H H 131 9.170 8.585 0.585 1 1 1303 . 8 1 1 A 131 131 GLY HA2 H 131 3.560 4.035 -0.475 1 1 1304 . 8 1 1 A 131 131 GLY HA3 H 131 3.750 4.041 -0.291 1 1 1305 . 8 1 1 A 131 131 GLY C C 131 174.550 174.557 -0.007 1 1 1306 . 8 1 1 A 131 131 GLY CA C 131 47.660 45.115 2.545 1 1 1307 . 8 1 1 A 131 131 GLY N N 131 115.530 114.004 1.526 1 1 1308 . 8 1 1 A 132 132 SER H H 132 8.430 8.433 -0.003 1 1 1309 . 8 1 1 A 132 132 SER HA H 132 4.170 4.485 -0.315 1 1 1312 . 8 1 1 A 132 132 SER C C 132 175.350 173.621 1.729 1 1 1313 . 8 1 1 A 132 132 SER CA C 132 59.050 58.432 0.618 1 1 1314 . 8 1 1 A 132 132 SER CB C 132 64.880 63.254 1.626 1 1 1315 . 8 1 1 A 132 132 SER N N 132 115.930 117.253 -1.323 1 1 1316 . 8 1 1 A 133 133 ASN H H 133 8.850 8.346 0.504 1 1 1317 . 8 1 1 A 133 133 ASN HA H 133 4.910 5.687 -0.777 1 1 1322 . 8 1 1 A 133 133 ASN C C 133 175.450 175.075 0.375 1 1 1323 . 8 1 1 A 133 133 ASN CA C 133 54.920 52.915 2.005 1 1 1324 . 8 1 1 A 133 133 ASN CB C 133 41.060 39.268 1.792 1 1 1325 . 8 1 1 A 133 133 ASN N N 133 125.590 125.630 -0.040 1 1 1327 . 8 1 1 A 134 134 LEU H H 134 9.070 9.524 -0.454 1 1 1328 . 8 1 1 A 134 134 LEU HA H 134 5.230 5.449 -0.219 1 1 1338 . 8 1 1 A 134 134 LEU C C 134 175.240 176.296 -1.056 1 1 1339 . 8 1 1 A 134 134 LEU CA C 134 53.470 53.448 0.022 1 1 1340 . 8 1 1 A 134 134 LEU CB C 134 45.090 44.081 1.009 1 1 1344 . 8 1 1 A 134 134 LEU N N 134 129.210 124.774 4.436 1 1 1345 . 8 1 1 A 135 135 SER H H 135 8.690 9.920 -1.230 1 1 1346 . 8 1 1 A 135 135 SER HA H 135 5.280 5.125 0.155 1 1 1349 . 8 1 1 A 135 135 SER C C 135 173.590 173.105 0.485 1 1 1350 . 8 1 1 A 135 135 SER CA C 135 56.220 57.818 -1.598 1 1 1351 . 8 1 1 A 135 135 SER CB C 135 66.510 64.754 1.756 1 1 1352 . 8 1 1 A 135 135 SER N N 135 113.020 122.757 -9.737 1 1 1353 . 8 1 1 A 136 136 VAL H H 136 8.940 8.800 0.140 1 1 1354 . 8 1 1 A 136 136 VAL HA H 136 5.500 4.846 0.654 1 1 1362 . 8 1 1 A 136 136 VAL C C 136 175.730 175.268 0.462 1 1 1363 . 8 1 1 A 136 136 VAL CA C 136 60.960 61.010 -0.050 1 1 1364 . 8 1 1 A 136 136 VAL CB C 136 33.630 32.557 1.073 1 1 1367 . 8 1 1 A 136 136 VAL N N 136 124.340 121.490 2.850 1 1 1368 . 8 1 1 A 137 137 THR H H 137 9.240 8.549 0.691 1 1 1369 . 8 1 1 A 137 137 THR HA H 137 4.920 4.791 0.129 1 1 1374 . 8 1 1 A 137 137 THR C C 137 173.500 174.392 -0.892 1 1 1375 . 8 1 1 A 137 137 THR CA C 137 59.120 60.292 -1.172 1 1 1376 . 8 1 1 A 137 137 THR CB C 137 72.500 70.775 1.725 1 1 1378 . 8 1 1 A 137 137 THR N N 137 117.010 118.251 -1.241 1 1 1379 . 8 1 1 A 138 138 ASN H H 138 9.190 8.783 0.407 1 1 1380 . 8 1 1 A 138 138 ASN HA H 138 4.420 4.366 0.054 1 1 1385 . 8 1 1 A 138 138 ASN C C 138 175.550 174.500 1.050 1 1 1386 . 8 1 1 A 138 138 ASN CA C 138 54.350 53.886 0.464 1 1 1387 . 8 1 1 A 138 138 ASN CB C 138 37.380 36.503 0.877 1 1 1388 . 8 1 1 A 138 138 ASN N N 138 115.270 120.517 -5.247 1 1 1390 . 8 1 1 A 139 139 SER H H 139 8.560 7.925 0.635 1 1 1391 . 8 1 1 A 139 139 SER HA H 139 5.800 4.383 1.417 1 1 1394 . 8 1 1 A 139 139 SER C C 139 175.750 174.178 1.572 1 1 1395 . 8 1 1 A 139 139 SER CA C 139 56.020 60.189 -4.169 1 1 1396 . 8 1 1 A 139 139 SER CB C 139 65.320 63.700 1.620 1 1 1397 . 8 1 1 A 139 139 SER N N 139 112.360 115.323 -2.963 1 1 1398 . 8 1 1 A 140 140 SER H H 140 9.900 8.548 1.352 1 1 1399 . 8 1 1 A 140 140 SER HA H 140 5.360 5.198 0.162 1 1 1402 . 8 1 1 A 140 140 SER C C 140 172.620 173.859 -1.239 1 1 1403 . 8 1 1 A 140 140 SER CA C 140 57.400 56.825 0.575 1 1 1404 . 8 1 1 A 140 140 SER CB C 140 66.550 65.628 0.922 1 1 1405 . 8 1 1 A 140 140 SER N N 140 119.130 120.522 -1.392 1 1 1406 . 8 1 1 A 141 141 VAL H H 141 9.030 8.552 0.478 1 1 1407 . 8 1 1 A 141 141 VAL HA H 141 5.520 5.159 0.361 1 1 1415 . 8 1 1 A 141 141 VAL C C 141 174.750 174.777 -0.027 1 1 1416 . 8 1 1 A 141 141 VAL CA C 141 58.310 59.474 -1.164 1 1 1417 . 8 1 1 A 141 141 VAL CB C 141 35.030 36.225 -1.195 1 1 1420 . 8 1 1 A 141 141 VAL N N 141 111.410 113.969 -2.559 1 1 1421 . 8 1 1 A 142 142 GLY H H 142 8.790 8.562 0.228 1 1 1422 . 8 1 1 A 142 142 GLY HA2 H 142 3.600 4.300 -0.700 1 1 1423 . 8 1 1 A 142 142 GLY HA3 H 142 5.310 4.330 0.980 1 1 1424 . 8 1 1 A 142 142 GLY C C 142 174.180 173.563 0.617 1 1 1425 . 8 1 1 A 142 142 GLY CA C 142 44.110 45.666 -1.556 1 1 1426 . 8 1 1 A 142 142 GLY N N 142 109.330 109.290 0.040 1 1 1427 . 8 1 1 A 143 143 ASP H H 143 8.840 8.821 0.019 1 1 1428 . 8 1 1 A 143 143 ASP HA H 143 5.790 5.238 0.552 1 1 1431 . 8 1 1 A 143 143 ASP C C 143 178.860 178.156 0.704 1 1 1432 . 8 1 1 A 143 143 ASP CA C 143 53.040 55.096 -2.056 1 1 1433 . 8 1 1 A 143 143 ASP CB C 143 43.660 42.668 0.992 1 1 1434 . 8 1 1 A 143 143 ASP N N 143 125.390 126.275 -0.885 1 1 1435 . 8 1 1 A 144 144 GLY H H 144 9.150 8.889 0.261 1 1 1436 . 8 1 1 A 144 144 GLY HA2 H 144 3.450 3.703 -0.253 1 1 1437 . 8 1 1 A 144 144 GLY HA3 H 144 3.720 3.993 -0.273 1 1 1438 . 8 1 1 A 144 144 GLY C C 144 174.770 176.047 -1.277 1 1 1439 . 8 1 1 A 144 144 GLY CA C 144 46.930 47.857 -0.927 1 1 1440 . 8 1 1 A 144 144 GLY N N 144 106.470 110.338 -3.868 1 1 1441 . 8 1 1 A 145 145 GLU H H 145 8.470 7.905 0.565 1 1 1442 . 8 1 1 A 145 145 GLU HA H 145 4.460 4.303 0.157 1 1 1447 . 8 1 1 A 145 145 GLU C C 145 176.520 176.272 0.248 1 1 1448 . 8 1 1 A 145 145 GLU CA C 145 55.330 56.965 -1.635 1 1 1449 . 8 1 1 A 145 145 GLU CB C 145 30.620 29.946 0.674 1 1 1451 . 8 1 1 A 145 145 GLU N N 145 119.170 121.325 -2.155 1 1 1452 . 8 1 1 A 146 146 GLY H H 146 7.950 7.909 0.041 1 1 1453 . 8 1 1 A 146 146 GLY HA2 H 146 3.630 4.032 -0.402 1 1 1454 . 8 1 1 A 146 146 GLY HA3 H 146 4.130 4.044 0.086 1 1 1455 . 8 1 1 A 146 146 GLY C C 146 174.350 174.843 -0.493 1 1 1456 . 8 1 1 A 146 146 GLY CA C 146 45.330 45.312 0.018 1 1 1457 . 8 1 1 A 146 146 GLY N N 146 108.130 106.340 1.790 1 1 1458 . 8 1 1 A 147 147 LEU H H 147 8.440 7.993 0.447 1 1 1459 . 8 1 1 A 147 147 LEU HA H 147 4.340 4.438 -0.098 1 1 1469 . 8 1 1 A 147 147 LEU C C 147 175.950 175.530 0.420 1 1 1470 . 8 1 1 A 147 147 LEU CA C 147 54.860 55.071 -0.211 1 1 1471 . 8 1 1 A 147 147 LEU CB C 147 41.590 42.374 -0.784 1 1 1475 . 8 1 1 A 147 147 LEU N N 147 124.000 122.571 1.429 1 1 1476 . 8 1 1 A 148 148 VAL H H 148 7.780 8.311 -0.531 1 1 1477 . 8 1 1 A 148 148 VAL HA H 148 4.830 4.886 -0.056 1 1 1485 . 8 1 1 A 148 148 VAL C C 148 175.740 174.826 0.914 1 1 1486 . 8 1 1 A 148 148 VAL CA C 148 61.140 61.065 0.075 1 1 1487 . 8 1 1 A 148 148 VAL CB C 148 33.640 35.406 -1.766 1 1 1490 . 8 1 1 A 148 148 VAL N N 148 120.440 119.304 1.136 1 1 1491 . 8 1 1 A 149 149 HIS H H 149 9.170 8.645 0.525 1 1 1492 . 8 1 1 A 149 149 HIS HA H 149 4.950 5.429 -0.479 1 1 1496 . 8 1 1 A 149 149 HIS C C 149 174.780 173.878 0.902 1 1 1497 . 8 1 1 A 149 149 HIS CA C 149 53.900 53.992 -0.092 1 1 1498 . 8 1 1 A 149 149 HIS CB C 149 32.200 31.461 0.739 1 1 1499 . 8 1 1 A 149 149 HIS N N 149 124.700 123.065 1.635 1 1 1500 . 8 1 1 A 150 150 GLU H H 150 9.060 8.758 0.302 1 1 1501 . 8 1 1 A 150 150 GLU HA H 150 4.420 4.219 0.201 1 1 1506 . 8 1 1 A 150 150 GLU C C 150 176.520 175.948 0.572 1 1 1507 . 8 1 1 A 150 150 GLU CA C 150 57.630 57.476 0.154 1 1 1508 . 8 1 1 A 150 150 GLU CB C 150 30.370 30.257 0.113 1 1 1510 . 8 1 1 A 150 150 GLU N N 150 125.540 125.119 0.421 1 1 1511 . 8 1 1 A 151 151 ILE H H 151 8.150 7.713 0.437 1 1 1512 . 8 1 1 A 151 151 ILE HA H 151 4.780 4.510 0.270 1 1 1522 . 8 1 1 A 151 151 ILE C C 151 174.570 176.284 -1.714 1 1 1523 . 8 1 1 A 151 151 ILE CA C 151 59.390 59.419 -0.029 1 1 1524 . 8 1 1 A 151 151 ILE CB C 151 42.040 39.269 2.771 1 1 1528 . 8 1 1 A 151 151 ILE N N 151 115.880 123.349 -7.469 1 1 1529 . 8 1 1 A 152 152 ALA H H 152 8.010 8.333 -0.323 1 1 1530 . 8 1 1 A 152 152 ALA HA H 152 4.310 4.423 -0.113 1 1 1534 . 8 1 1 A 152 152 ALA C C 152 177.500 176.711 0.789 1 1 1535 . 8 1 1 A 152 152 ALA CA C 152 53.680 51.695 1.985 1 1 1536 . 8 1 1 A 152 152 ALA CB C 152 20.050 19.821 0.229 1 1 1537 . 8 1 1 A 152 152 ALA N N 152 126.640 124.383 2.257 1 1 1538 . 8 1 1 A 153 153 GLY H H 153 8.340 8.319 0.021 1 1 1539 . 8 1 1 A 153 153 GLY HA2 H 153 4.050 4.293 -0.243 1 1 1540 . 8 1 1 A 153 153 GLY HA3 H 153 4.140 4.303 -0.163 1 1 1541 . 8 1 1 A 153 153 GLY C C 153 173.140 171.810 1.330 1 1 1542 . 8 1 1 A 153 153 GLY CA C 153 44.130 45.676 -1.546 1 1 1543 . 8 1 1 A 153 153 GLY N N 153 107.490 105.342 2.148 1 1 1544 . 8 1 1 A 154 154 THR H H 154 7.380 8.383 -1.003 1 1 1545 . 8 1 1 A 154 154 THR HA H 154 4.700 5.097 -0.397 1 1 1550 . 8 1 1 A 154 154 THR C C 154 171.120 173.432 -2.312 1 1 1551 . 8 1 1 A 154 154 THR CA C 154 60.830 60.648 0.182 1 1 1552 . 8 1 1 A 154 154 THR CB C 154 68.850 73.149 -4.299 1 1 1554 . 8 1 1 A 154 154 THR N N 154 109.340 113.883 -4.543 1 1 1555 . 8 1 1 A 155 155 GLU H H 155 8.020 8.675 -0.655 1 1 1556 . 8 1 1 A 155 155 GLU HA H 155 5.370 5.302 0.068 1 1 1561 . 8 1 1 A 155 155 GLU C C 155 174.240 174.068 0.172 1 1 1562 . 8 1 1 A 155 155 GLU CA C 155 54.830 54.286 0.544 1 1 1563 . 8 1 1 A 155 155 GLU CB C 155 33.620 33.797 -0.177 1 1 1565 . 8 1 1 A 155 155 GLU N N 155 118.690 119.942 -1.252 1 1 1566 . 8 1 1 A 156 156 LYS H H 156 9.230 9.242 -0.012 1 1 1567 . 8 1 1 A 156 156 LYS HA H 156 4.650 4.826 -0.176 1 1 1576 . 8 1 1 A 156 156 LYS C C 156 174.000 174.432 -0.432 1 1 1577 . 8 1 1 A 156 156 LYS CA C 156 55.840 55.282 0.558 1 1 1578 . 8 1 1 A 156 156 LYS CB C 156 37.550 36.307 1.243 1 1 1582 . 8 1 1 A 156 156 LYS N N 156 121.940 121.406 0.534 1 1 1583 . 8 1 1 A 157 157 THR H H 157 8.160 8.648 -0.488 1 1 1584 . 8 1 1 A 157 157 THR HA H 157 5.440 5.110 0.330 1 1 1589 . 8 1 1 A 157 157 THR C C 157 174.360 173.737 0.623 1 1 1590 . 8 1 1 A 157 157 THR CA C 157 60.410 60.958 -0.548 1 1 1591 . 8 1 1 A 157 157 THR CB C 157 71.500 71.187 0.313 1 1 1593 . 8 1 1 A 157 157 THR N N 157 113.240 112.886 0.354 1 1 1594 . 8 1 1 A 158 158 VAL H H 158 9.120 8.661 0.459 1 1 1595 . 8 1 1 A 158 158 VAL HA H 158 4.580 4.971 -0.391 1 1 1603 . 8 1 1 A 158 158 VAL C C 158 172.800 175.030 -2.230 1 1 1604 . 8 1 1 A 158 158 VAL CA C 158 59.980 59.971 0.009 1 1 1605 . 8 1 1 A 158 158 VAL CB C 158 36.290 33.822 2.468 1 1 1608 . 8 1 1 A 158 158 VAL N N 158 121.710 122.658 -0.948 1 1 1609 . 8 1 1 A 159 159 ASN H H 159 8.240 8.836 -0.596 1 1 1610 . 8 1 1 A 159 159 ASN HA H 159 5.420 5.234 0.186 1 1 1615 . 8 1 1 A 159 159 ASN C C 159 173.800 174.186 -0.386 1 1 1616 . 8 1 1 A 159 159 ASN CA C 159 51.740 52.267 -0.527 1 1 1617 . 8 1 1 A 159 159 ASN CB C 159 40.380 39.585 0.795 1 1 1618 . 8 1 1 A 159 159 ASN N N 159 122.730 122.904 -0.174 1 1 1620 . 8 1 1 A 160 160 ILE H H 160 9.160 8.726 0.434 1 1 1621 . 8 1 1 A 160 160 ILE HA H 160 5.130 4.956 0.174 1 1 1631 . 8 1 1 A 160 160 ILE C C 160 177.320 175.626 1.694 1 1 1632 . 8 1 1 A 160 160 ILE CA C 160 60.640 60.761 -0.121 1 1 1633 . 8 1 1 A 160 160 ILE CB C 160 38.520 37.665 0.855 1 1 1637 . 8 1 1 A 160 160 ILE N N 160 123.690 125.252 -1.562 1 1 1638 . 8 1 1 A 161 161 ILE H H 161 8.780 8.947 -0.167 1 1 1639 . 8 1 1 A 161 161 ILE HA H 161 4.590 4.642 -0.052 1 1 1649 . 8 1 1 A 161 161 ILE C C 161 174.960 175.741 -0.781 1 1 1650 . 8 1 1 A 161 161 ILE CA C 161 59.320 60.115 -0.795 1 1 1651 . 8 1 1 A 161 161 ILE CB C 161 41.030 40.310 0.720 1 1 1655 . 8 1 1 A 161 161 ILE N N 161 122.490 129.104 -6.614 1 1 1656 . 8 1 1 A 162 162 GLU H H 162 8.620 8.476 0.144 1 1 1657 . 8 1 1 A 162 162 GLU HA H 162 4.290 4.446 -0.156 1 1 1662 . 8 1 1 A 162 162 GLU C C 162 176.660 176.634 0.026 1 1 1663 . 8 1 1 A 162 162 GLU CA C 162 56.470 56.939 -0.469 1 1 1664 . 8 1 1 A 162 162 GLU CB C 162 31.150 30.583 0.567 1 1 1666 . 8 1 1 A 162 162 GLU N N 162 120.520 125.845 -5.325 1 1 1667 . 8 1 1 A 163 163 GLY H H 163 8.480 8.440 0.040 1 1 1668 . 8 1 1 A 163 163 GLY HA2 H 163 3.910 4.329 -0.419 1 1 1669 . 8 1 1 A 163 163 GLY HA3 H 163 4.150 4.330 -0.180 1 1 1670 . 8 1 1 A 163 163 GLY C C 163 174.000 172.110 1.890 1 1 1671 . 8 1 1 A 163 163 GLY CA C 163 45.270 45.757 -0.487 1 1 1672 . 8 1 1 A 163 163 GLY N N 163 110.210 109.396 0.814 1 1 1673 . 8 1 1 A 164 164 THR H H 164 8.170 8.509 -0.339 1 1 1674 . 8 1 1 A 164 164 THR HA H 164 4.410 4.903 -0.493 1 1 1679 . 8 1 1 A 164 164 THR C C 164 174.100 173.426 0.674 1 1 1680 . 8 1 1 A 164 164 THR CA C 164 61.620 60.874 0.746 1 1 1681 . 8 1 1 A 164 164 THR CB C 164 70.060 71.579 -1.519 1 1 1683 . 8 1 1 A 164 164 THR N N 164 113.480 115.754 -2.274 1 1 1 . 9 1 1 A 13 13 GLY H H 13 8.350 7.427 0.923 1 1 2 . 9 1 1 A 13 13 GLY HA2 H 13 3.920 4.094 -0.174 1 1 3 . 9 1 1 A 13 13 GLY HA3 H 13 3.920 4.112 -0.192 1 1 4 . 9 1 1 A 13 13 GLY CA C 13 45.290 45.782 -0.492 1 1 5 . 9 1 1 A 13 13 GLY N N 13 110.450 106.890 3.560 1 1 6 . 9 1 1 A 14 14 LEU H H 14 8.050 8.688 -0.638 1 1 7 . 9 1 1 A 14 14 LEU N N 14 121.500 121.867 -0.367 1 1 8 . 9 1 1 A 15 15 VAL H H 15 8.070 7.905 0.165 1 1 9 . 9 1 1 A 15 15 VAL N N 15 122.390 120.077 2.313 1 1 10 . 9 1 1 A 16 16 PRO HA H 16 4.360 4.270 0.090 1 1 17 . 9 1 1 A 16 16 PRO CA C 16 62.770 65.885 -3.115 1 1 18 . 9 1 1 A 16 16 PRO CB C 16 32.020 31.370 0.650 1 1 21 . 9 1 1 A 21 21 MET H H 21 8.180 7.779 0.401 1 1 22 . 9 1 1 A 21 21 MET N N 21 121.310 114.586 6.724 1 1 23 . 9 1 1 A 22 22 ALA H H 22 8.290 8.573 -0.283 1 1 24 . 9 1 1 A 22 22 ALA N N 22 124.800 125.594 -0.794 1 1 25 . 9 1 1 A 23 23 SER H H 23 8.210 7.715 0.495 1 1 26 . 9 1 1 A 23 23 SER N N 23 114.830 113.160 1.670 1 1 27 . 9 1 1 A 24 24 LYS H H 24 8.250 8.943 -0.693 1 1 28 . 9 1 1 A 24 24 LYS N N 24 122.980 125.210 -2.230 1 1 29 . 9 1 1 A 25 25 LEU H H 25 8.140 7.944 0.196 1 1 30 . 9 1 1 A 25 25 LEU HA H 25 4.290 4.772 -0.482 1 1 40 . 9 1 1 A 25 25 LEU C C 25 177.410 174.971 2.439 1 1 41 . 9 1 1 A 25 25 LEU CA C 25 55.430 53.654 1.776 1 1 42 . 9 1 1 A 25 25 LEU CB C 25 42.350 46.023 -3.673 1 1 46 . 9 1 1 A 25 25 LEU N N 25 122.580 115.661 6.919 1 1 47 . 9 1 1 A 26 26 LYS H H 26 8.200 8.658 -0.458 1 1 48 . 9 1 1 A 26 26 LYS HA H 26 4.260 4.982 -0.722 1 1 57 . 9 1 1 A 26 26 LYS C C 26 176.520 174.873 1.647 1 1 58 . 9 1 1 A 26 26 LYS CA C 26 56.700 55.532 1.168 1 1 59 . 9 1 1 A 26 26 LYS CB C 26 33.060 35.477 -2.417 1 1 63 . 9 1 1 A 26 26 LYS N N 26 121.800 119.849 1.951 1 1 64 . 9 1 1 A 27 27 GLU H H 27 8.380 8.751 -0.371 1 1 65 . 9 1 1 A 27 27 GLU HA H 27 4.240 4.786 -0.546 1 1 70 . 9 1 1 A 27 27 GLU C C 27 176.130 175.412 0.718 1 1 71 . 9 1 1 A 27 27 GLU CA C 27 56.700 54.474 2.226 1 1 72 . 9 1 1 A 27 27 GLU CB C 27 30.370 33.279 -2.909 1 1 74 . 9 1 1 A 27 27 GLU N N 27 121.700 124.015 -2.315 1 1 75 . 9 1 1 A 28 28 ALA H H 28 8.230 8.528 -0.298 1 1 76 . 9 1 1 A 28 28 ALA HA H 28 4.280 3.882 0.398 1 1 80 . 9 1 1 A 28 28 ALA C C 28 177.090 176.070 1.020 1 1 81 . 9 1 1 A 28 28 ALA CA C 28 52.530 53.212 -0.682 1 1 82 . 9 1 1 A 28 28 ALA CB C 28 19.360 17.940 1.420 1 1 83 . 9 1 1 A 28 28 ALA N N 28 124.640 120.934 3.706 1 1 84 . 9 1 1 A 29 29 ALA H H 29 8.150 7.405 0.745 1 1 85 . 9 1 1 A 29 29 ALA HA H 29 4.320 4.683 -0.363 1 1 89 . 9 1 1 A 29 29 ALA C C 29 177.120 175.966 1.154 1 1 90 . 9 1 1 A 29 29 ALA CA C 29 52.040 51.920 0.120 1 1 91 . 9 1 1 A 29 29 ALA CB C 29 19.430 18.832 0.598 1 1 92 . 9 1 1 A 29 29 ALA N N 29 123.430 116.953 6.477 1 1 93 . 9 1 1 A 30 30 GLU H H 30 8.310 8.503 -0.193 1 1 94 . 9 1 1 A 30 30 GLU HA H 30 4.220 4.826 -0.606 1 1 99 . 9 1 1 A 30 30 GLU C C 30 176.310 175.936 0.374 1 1 100 . 9 1 1 A 30 30 GLU CA C 30 56.630 55.687 0.943 1 1 101 . 9 1 1 A 30 30 GLU CB C 30 30.320 30.071 0.249 1 1 103 . 9 1 1 A 30 30 GLU N N 30 120.630 119.283 1.347 1 1 104 . 9 1 1 A 31 31 VAL H H 31 8.630 8.751 -0.121 1 1 105 . 9 1 1 A 31 31 VAL HA H 31 4.430 4.719 -0.289 1 1 113 . 9 1 1 A 31 31 VAL C C 31 176.510 176.141 0.369 1 1 114 . 9 1 1 A 31 31 VAL CA C 31 62.360 63.316 -0.956 1 1 115 . 9 1 1 A 31 31 VAL CB C 31 32.370 31.715 0.655 1 1 118 . 9 1 1 A 31 31 VAL N N 31 127.110 125.301 1.809 1 1 119 . 9 1 1 A 32 32 THR H H 32 7.640 8.660 -1.020 1 1 120 . 9 1 1 A 32 32 THR HA H 32 4.870 4.042 0.828 1 1 125 . 9 1 1 A 32 32 THR C C 32 172.220 174.770 -2.550 1 1 126 . 9 1 1 A 32 32 THR CA C 32 59.510 64.226 -4.716 1 1 127 . 9 1 1 A 32 32 THR CB C 32 71.630 69.966 1.664 1 1 129 . 9 1 1 A 32 32 THR N N 32 118.860 121.022 -2.162 1 1 130 . 9 1 1 A 33 33 GLY H H 33 8.350 7.963 0.387 1 1 131 . 9 1 1 A 33 33 GLY HA2 H 33 4.160 4.061 0.099 1 1 132 . 9 1 1 A 33 33 GLY HA3 H 33 4.250 4.070 0.180 1 1 133 . 9 1 1 A 33 33 GLY C C 33 172.820 172.807 0.013 1 1 134 . 9 1 1 A 33 33 GLY CA C 33 46.680 44.787 1.893 1 1 135 . 9 1 1 A 33 33 GLY N N 33 106.720 108.762 -2.042 1 1 136 . 9 1 1 A 34 34 SER H H 34 8.810 8.090 0.720 1 1 137 . 9 1 1 A 34 34 SER HA H 34 5.390 4.947 0.443 1 1 140 . 9 1 1 A 34 34 SER C C 34 173.780 172.833 0.947 1 1 141 . 9 1 1 A 34 34 SER CA C 34 57.380 57.534 -0.154 1 1 142 . 9 1 1 A 34 34 SER CB C 34 65.730 65.860 -0.130 1 1 143 . 9 1 1 A 34 34 SER N N 34 112.690 119.193 -6.503 1 1 144 . 9 1 1 A 35 35 VAL H H 35 8.470 8.723 -0.253 1 1 145 . 9 1 1 A 35 35 VAL HA H 35 4.120 4.741 -0.621 1 1 153 . 9 1 1 A 35 35 VAL C C 35 174.750 175.260 -0.510 1 1 154 . 9 1 1 A 35 35 VAL CA C 35 62.310 60.778 1.532 1 1 155 . 9 1 1 A 35 35 VAL CB C 35 34.550 33.226 1.324 1 1 158 . 9 1 1 A 35 35 VAL N N 35 123.150 122.414 0.736 1 1 159 . 9 1 1 A 36 36 SER H H 36 8.240 8.858 -0.618 1 1 160 . 9 1 1 A 36 36 SER HA H 36 4.690 4.901 -0.211 1 1 163 . 9 1 1 A 36 36 SER C C 36 171.860 172.838 -0.978 1 1 164 . 9 1 1 A 36 36 SER CA C 36 56.020 58.100 -2.080 1 1 165 . 9 1 1 A 36 36 SER CB C 36 66.050 63.633 2.417 1 1 166 . 9 1 1 A 36 36 SER N N 36 118.760 122.768 -4.008 1 1 167 . 9 1 1 A 37 37 LEU H H 37 8.310 9.094 -0.784 1 1 168 . 9 1 1 A 37 37 LEU HA H 37 4.870 5.148 -0.278 1 1 178 . 9 1 1 A 37 37 LEU C C 37 174.190 175.099 -0.909 1 1 179 . 9 1 1 A 37 37 LEU CA C 37 53.870 53.604 0.266 1 1 180 . 9 1 1 A 37 37 LEU CB C 37 47.000 44.809 2.191 1 1 184 . 9 1 1 A 37 37 LEU N N 37 124.790 129.568 -4.778 1 1 185 . 9 1 1 A 38 38 GLU H H 38 9.270 8.880 0.390 1 1 186 . 9 1 1 A 38 38 GLU HA H 38 4.650 5.153 -0.503 1 1 191 . 9 1 1 A 38 38 GLU C C 38 173.970 175.250 -1.280 1 1 192 . 9 1 1 A 38 38 GLU CA C 38 54.410 55.642 -1.232 1 1 193 . 9 1 1 A 38 38 GLU CB C 38 32.460 32.487 -0.027 1 1 195 . 9 1 1 A 38 38 GLU N N 38 126.550 127.755 -1.205 1 1 196 . 9 1 1 A 39 39 ALA H H 39 8.120 8.504 -0.384 1 1 197 . 9 1 1 A 39 39 ALA HA H 39 4.600 4.756 -0.156 1 1 201 . 9 1 1 A 39 39 ALA C C 39 175.930 177.873 -1.943 1 1 202 . 9 1 1 A 39 39 ALA CA C 39 51.570 50.382 1.188 1 1 203 . 9 1 1 A 39 39 ALA CB C 39 21.780 22.827 -1.047 1 1 204 . 9 1 1 A 39 39 ALA N N 39 124.410 129.157 -4.747 1 1 205 . 9 1 1 A 40 40 LEU H H 40 7.860 8.962 -1.102 1 1 206 . 9 1 1 A 40 40 LEU HA H 40 4.230 4.050 0.180 1 1 216 . 9 1 1 A 40 40 LEU C C 40 175.940 176.581 -0.641 1 1 217 . 9 1 1 A 40 40 LEU CA C 40 55.360 57.865 -2.505 1 1 218 . 9 1 1 A 40 40 LEU CB C 40 42.990 42.630 0.360 1 1 222 . 9 1 1 A 40 40 LEU N N 40 120.640 122.334 -1.694 1 1 223 . 9 1 1 A 41 41 GLU H H 41 8.210 7.878 0.332 1 1 224 . 9 1 1 A 41 41 GLU HA H 41 4.240 4.006 0.234 1 1 229 . 9 1 1 A 41 41 GLU C C 41 176.920 174.802 2.118 1 1 230 . 9 1 1 A 41 41 GLU CA C 41 58.090 57.675 0.415 1 1 231 . 9 1 1 A 41 41 GLU CB C 41 30.530 27.147 3.383 1 1 233 . 9 1 1 A 41 41 GLU N N 41 114.680 117.928 -3.248 1 1 234 . 9 1 1 A 42 42 GLU H H 42 7.490 7.750 -0.260 1 1 235 . 9 1 1 A 42 42 GLU HA H 42 5.680 4.803 0.877 1 1 240 . 9 1 1 A 42 42 GLU C C 42 173.790 174.171 -0.381 1 1 241 . 9 1 1 A 42 42 GLU CA C 42 54.360 56.284 -1.924 1 1 242 . 9 1 1 A 42 42 GLU CB C 42 33.850 33.247 0.603 1 1 244 . 9 1 1 A 42 42 GLU N N 42 116.670 118.232 -1.562 1 1 245 . 9 1 1 A 43 43 VAL H H 43 8.550 8.815 -0.265 1 1 246 . 9 1 1 A 43 43 VAL HA H 43 4.550 4.652 -0.102 1 1 254 . 9 1 1 A 43 43 VAL C C 43 172.220 173.780 -1.560 1 1 255 . 9 1 1 A 43 43 VAL CA C 43 59.470 60.517 -1.047 1 1 256 . 9 1 1 A 43 43 VAL CB C 43 35.470 34.561 0.909 1 1 259 . 9 1 1 A 43 43 VAL N N 43 120.030 125.226 -5.196 1 1 260 . 9 1 1 A 44 44 GLN H H 44 8.470 8.569 -0.099 1 1 261 . 9 1 1 A 44 44 GLN HA H 44 4.890 4.682 0.208 1 1 268 . 9 1 1 A 44 44 GLN C C 44 176.130 175.979 0.151 1 1 269 . 9 1 1 A 44 44 GLN CA C 44 54.360 55.865 -1.505 1 1 270 . 9 1 1 A 44 44 GLN CB C 44 30.610 28.955 1.655 1 1 272 . 9 1 1 A 44 44 GLN N N 44 124.690 130.170 -5.480 1 1 274 . 9 1 1 A 45 45 VAL H H 45 8.130 8.294 -0.164 1 1 275 . 9 1 1 A 45 45 VAL HA H 45 3.030 3.918 -0.888 1 1 283 . 9 1 1 A 45 45 VAL C C 45 176.710 177.125 -0.415 1 1 284 . 9 1 1 A 45 45 VAL CA C 45 65.810 64.815 0.995 1 1 285 . 9 1 1 A 45 45 VAL CB C 45 31.960 31.488 0.472 1 1 288 . 9 1 1 A 45 45 VAL N N 45 120.450 127.243 -6.793 1 1 289 . 9 1 1 A 46 46 GLY H H 46 8.950 9.829 -0.879 1 1 290 . 9 1 1 A 46 46 GLY HA2 H 46 3.590 3.984 -0.394 1 1 291 . 9 1 1 A 46 46 GLY HA3 H 46 4.410 3.986 0.424 1 1 292 . 9 1 1 A 46 46 GLY C C 46 174.390 174.632 -0.242 1 1 293 . 9 1 1 A 46 46 GLY CA C 46 44.730 45.069 -0.339 1 1 294 . 9 1 1 A 46 46 GLY N N 46 116.490 115.078 1.412 1 1 295 . 9 1 1 A 47 47 GLU H H 47 8.260 7.711 0.549 1 1 296 . 9 1 1 A 47 47 GLU HA H 47 4.460 4.782 -0.322 1 1 301 . 9 1 1 A 47 47 GLU C C 47 174.780 174.845 -0.065 1 1 302 . 9 1 1 A 47 47 GLU CA C 47 54.830 55.108 -0.278 1 1 303 . 9 1 1 A 47 47 GLU CB C 47 31.140 32.406 -1.266 1 1 305 . 9 1 1 A 47 47 GLU N N 47 120.520 119.956 0.564 1 1 306 . 9 1 1 A 48 48 ASN H H 48 8.440 8.964 -0.524 1 1 307 . 9 1 1 A 48 48 ASN HA H 48 5.380 5.528 -0.148 1 1 312 . 9 1 1 A 48 48 ASN C C 48 174.770 174.172 0.598 1 1 313 . 9 1 1 A 48 48 ASN CA C 48 51.570 51.338 0.232 1 1 314 . 9 1 1 A 48 48 ASN CB C 48 39.010 42.673 -3.663 1 1 315 . 9 1 1 A 48 48 ASN N N 48 117.180 116.643 0.537 1 1 317 . 9 1 1 A 49 49 LEU H H 49 9.810 8.699 1.111 1 1 318 . 9 1 1 A 49 49 LEU HA H 49 4.510 4.968 -0.458 1 1 328 . 9 1 1 A 49 49 LEU C C 49 174.560 175.790 -1.230 1 1 329 . 9 1 1 A 49 49 LEU CA C 49 53.460 52.901 0.559 1 1 330 . 9 1 1 A 49 49 LEU CB C 49 45.520 43.991 1.529 1 1 333 . 9 1 1 A 49 49 LEU N N 49 125.620 119.055 6.565 1 1 334 . 9 1 1 A 50 50 GLU H H 50 8.750 8.796 -0.046 1 1 335 . 9 1 1 A 50 50 GLU HA H 50 4.360 4.917 -0.557 1 1 340 . 9 1 1 A 50 50 GLU C C 50 175.340 174.604 0.736 1 1 341 . 9 1 1 A 50 50 GLU CA C 50 55.550 55.312 0.238 1 1 342 . 9 1 1 A 50 50 GLU CB C 50 29.890 30.893 -1.003 1 1 344 . 9 1 1 A 50 50 GLU N N 50 125.420 119.139 6.281 1 1 345 . 9 1 1 A 51 51 VAL H H 51 9.230 9.001 0.229 1 1 346 . 9 1 1 A 51 51 VAL HA H 51 4.190 4.732 -0.542 1 1 354 . 9 1 1 A 51 51 VAL C C 51 175.310 174.909 0.401 1 1 355 . 9 1 1 A 51 51 VAL CA C 51 62.520 61.122 1.398 1 1 356 . 9 1 1 A 51 51 VAL CB C 51 31.470 33.145 -1.675 1 1 359 . 9 1 1 A 51 51 VAL N N 51 129.810 125.410 4.400 1 1 360 . 9 1 1 A 52 52 GLY H H 52 9.410 8.999 0.411 1 1 361 . 9 1 1 A 52 52 GLY HA2 H 52 3.460 3.939 -0.479 1 1 362 . 9 1 1 A 52 52 GLY HA3 H 52 4.680 3.972 0.708 1 1 363 . 9 1 1 A 52 52 GLY C C 52 173.000 173.100 -0.100 1 1 364 . 9 1 1 A 52 52 GLY CA C 52 46.470 46.926 -0.456 1 1 365 . 9 1 1 A 52 52 GLY N N 52 116.600 116.718 -0.118 1 1 366 . 9 1 1 A 53 53 VAL H H 53 9.130 8.500 0.630 1 1 367 . 9 1 1 A 53 53 VAL HA H 53 4.840 4.927 -0.087 1 1 375 . 9 1 1 A 53 53 VAL C C 53 175.470 175.299 0.171 1 1 376 . 9 1 1 A 53 53 VAL CA C 53 61.350 61.456 -0.106 1 1 377 . 9 1 1 A 53 53 VAL CB C 53 34.300 31.916 2.384 1 1 380 . 9 1 1 A 53 53 VAL N N 53 129.050 125.380 3.670 1 1 381 . 9 1 1 A 54 54 GLY H H 54 8.420 8.877 -0.457 1 1 382 . 9 1 1 A 54 54 GLY HA2 H 54 3.850 4.027 -0.177 1 1 383 . 9 1 1 A 54 54 GLY HA3 H 54 3.850 4.130 -0.280 1 1 384 . 9 1 1 A 54 54 GLY C C 54 173.310 172.815 0.495 1 1 385 . 9 1 1 A 54 54 GLY CA C 54 45.180 44.460 0.720 1 1 386 . 9 1 1 A 54 54 GLY N N 54 116.890 115.547 1.343 1 1 387 . 9 1 1 A 55 55 ILE H H 55 10.190 8.150 2.040 1 1 388 . 9 1 1 A 55 55 ILE HA H 55 4.010 4.654 -0.644 1 1 398 . 9 1 1 A 55 55 ILE C C 55 174.380 175.223 -0.843 1 1 399 . 9 1 1 A 55 55 ILE CA C 55 61.350 60.101 1.249 1 1 400 . 9 1 1 A 55 55 ILE CB C 55 40.840 39.636 1.204 1 1 404 . 9 1 1 A 55 55 ILE N N 55 129.330 121.959 7.371 1 1 405 . 9 1 1 A 56 56 ASP H H 56 8.810 9.842 -1.032 1 1 406 . 9 1 1 A 56 56 ASP HA H 56 4.440 5.073 -0.633 1 1 409 . 9 1 1 A 56 56 ASP C C 56 175.530 175.384 0.146 1 1 410 . 9 1 1 A 56 56 ASP CA C 56 56.460 55.353 1.107 1 1 411 . 9 1 1 A 56 56 ASP CB C 56 42.720 42.785 -0.065 1 1 412 . 9 1 1 A 56 56 ASP N N 56 128.310 127.970 0.340 1 1 413 . 9 1 1 A 57 57 GLU H H 57 7.270 7.682 -0.412 1 1 414 . 9 1 1 A 57 57 GLU HA H 57 4.290 4.818 -0.528 1 1 419 . 9 1 1 A 57 57 GLU C C 57 173.370 174.464 -1.094 1 1 420 . 9 1 1 A 57 57 GLU CA C 57 54.840 55.458 -0.618 1 1 421 . 9 1 1 A 57 57 GLU CB C 57 33.190 33.523 -0.333 1 1 423 . 9 1 1 A 57 57 GLU N N 57 112.810 115.938 -3.128 1 1 424 . 9 1 1 A 58 58 LEU H H 58 8.370 8.521 -0.151 1 1 425 . 9 1 1 A 58 58 LEU HA H 58 4.830 4.664 0.166 1 1 434 . 9 1 1 A 58 58 LEU C C 58 174.180 174.552 -0.372 1 1 435 . 9 1 1 A 58 58 LEU CA C 58 55.320 54.914 0.406 1 1 436 . 9 1 1 A 58 58 LEU CB C 58 44.300 42.917 1.383 1 1 439 . 9 1 1 A 58 58 LEU N N 58 123.130 124.993 -1.863 1 1 440 . 9 1 1 A 59 59 VAL H H 59 9.120 8.875 0.245 1 1 441 . 9 1 1 A 59 59 VAL HA H 59 4.240 4.636 -0.396 1 1 449 . 9 1 1 A 59 59 VAL C C 59 174.960 175.524 -0.564 1 1 450 . 9 1 1 A 59 59 VAL CA C 59 61.760 59.973 1.787 1 1 451 . 9 1 1 A 59 59 VAL CB C 59 33.760 33.223 0.537 1 1 454 . 9 1 1 A 59 59 VAL N N 59 127.930 125.790 2.140 1 1 455 . 9 1 1 A 60 60 ASN H H 60 8.770 8.439 0.331 1 1 456 . 9 1 1 A 60 60 ASN HA H 60 4.250 4.793 -0.543 1 1 461 . 9 1 1 A 60 60 ASN C C 60 172.810 173.790 -0.980 1 1 462 . 9 1 1 A 60 60 ASN CA C 60 54.830 54.626 0.204 1 1 463 . 9 1 1 A 60 60 ASN CB C 60 36.030 36.535 -0.505 1 1 464 . 9 1 1 A 60 60 ASN N N 60 115.500 122.132 -6.632 1 1 466 . 9 1 1 A 61 61 ALA H H 61 7.330 7.325 0.005 1 1 467 . 9 1 1 A 61 61 ALA HA H 61 4.520 4.551 -0.031 1 1 471 . 9 1 1 A 61 61 ALA C C 61 174.580 175.200 -0.620 1 1 472 . 9 1 1 A 61 61 ALA CA C 61 51.560 50.979 0.581 1 1 473 . 9 1 1 A 61 61 ALA CB C 61 22.870 22.090 0.780 1 1 474 . 9 1 1 A 61 61 ALA N N 61 115.640 117.976 -2.336 1 1 475 . 9 1 1 A 62 62 GLU H H 62 7.900 8.764 -0.864 1 1 476 . 9 1 1 A 62 62 GLU HA H 62 4.310 4.742 -0.432 1 1 481 . 9 1 1 A 62 62 GLU C C 62 173.790 175.406 -1.616 1 1 482 . 9 1 1 A 62 62 GLU CA C 62 55.080 55.389 -0.309 1 1 483 . 9 1 1 A 62 62 GLU CB C 62 32.610 30.334 2.276 1 1 485 . 9 1 1 A 62 62 GLU N N 62 117.400 117.255 0.145 1 1 486 . 9 1 1 A 63 63 ALA H H 63 8.910 8.774 0.136 1 1 487 . 9 1 1 A 63 63 ALA HA H 63 4.690 4.534 0.156 1 1 491 . 9 1 1 A 63 63 ALA C C 63 175.720 176.724 -1.004 1 1 492 . 9 1 1 A 63 63 ALA CA C 63 50.600 53.177 -2.577 1 1 493 . 9 1 1 A 63 63 ALA CB C 63 20.660 19.029 1.631 1 1 494 . 9 1 1 A 63 63 ALA N N 63 122.480 128.403 -5.923 1 1 495 . 9 1 1 A 64 64 PHE H H 64 9.220 9.029 0.191 1 1 496 . 9 1 1 A 64 64 PHE HA H 64 4.320 4.720 -0.400 1 1 501 . 9 1 1 A 64 64 PHE C C 64 174.380 175.903 -1.523 1 1 502 . 9 1 1 A 64 64 PHE CA C 64 59.770 58.927 0.843 1 1 503 . 9 1 1 A 64 64 PHE CB C 64 40.830 41.348 -0.518 1 1 504 . 9 1 1 A 64 64 PHE N N 64 120.870 122.828 -1.958 1 1 505 . 9 1 1 A 65 65 ALA H H 65 8.150 7.989 0.161 1 1 506 . 9 1 1 A 65 65 ALA HA H 65 5.280 4.867 0.413 1 1 510 . 9 1 1 A 65 65 ALA C C 65 175.950 175.622 0.328 1 1 511 . 9 1 1 A 65 65 ALA CA C 65 51.120 51.050 0.070 1 1 512 . 9 1 1 A 65 65 ALA CB C 65 22.850 21.603 1.247 1 1 513 . 9 1 1 A 65 65 ALA N N 65 122.350 119.984 2.366 1 1 514 . 9 1 1 A 66 66 TYR H H 66 9.260 9.294 -0.034 1 1 515 . 9 1 1 A 66 66 TYR HA H 66 5.710 4.947 0.763 1 1 520 . 9 1 1 A 66 66 TYR C C 66 175.690 174.275 1.415 1 1 521 . 9 1 1 A 66 66 TYR CA C 66 54.390 58.522 -4.132 1 1 522 . 9 1 1 A 66 66 TYR CB C 66 41.560 39.980 1.580 1 1 523 . 9 1 1 A 66 66 TYR N N 66 124.350 126.768 -2.418 1 1 524 . 9 1 1 A 67 67 ASP H H 67 9.070 8.517 0.553 1 1 525 . 9 1 1 A 67 67 ASP HA H 67 5.630 5.245 0.385 1 1 528 . 9 1 1 A 67 67 ASP C C 67 174.300 174.141 0.159 1 1 529 . 9 1 1 A 67 67 ASP CA C 67 51.590 53.207 -1.617 1 1 530 . 9 1 1 A 67 67 ASP CB C 67 44.380 43.175 1.205 1 1 531 . 9 1 1 A 67 67 ASP N N 67 130.490 126.000 4.490 1 1 532 . 9 1 1 A 68 68 PHE H H 68 8.670 8.101 0.569 1 1 533 . 9 1 1 A 68 68 PHE HA H 68 4.890 5.401 -0.511 1 1 538 . 9 1 1 A 68 68 PHE C C 68 172.220 173.456 -1.236 1 1 539 . 9 1 1 A 68 68 PHE CA C 68 57.360 54.985 2.375 1 1 540 . 9 1 1 A 68 68 PHE CB C 68 40.360 41.823 -1.463 1 1 541 . 9 1 1 A 68 68 PHE N N 68 118.200 119.207 -1.007 1 1 542 . 9 1 1 A 69 69 THR H H 69 8.390 8.402 -0.012 1 1 543 . 9 1 1 A 69 69 THR HA H 69 5.170 5.055 0.115 1 1 548 . 9 1 1 A 69 69 THR C C 69 172.620 173.782 -1.162 1 1 549 . 9 1 1 A 69 69 THR CA C 69 61.370 61.442 -0.072 1 1 550 . 9 1 1 A 69 69 THR CB C 69 64.880 71.018 -6.138 1 1 552 . 9 1 1 A 69 69 THR N N 69 115.810 114.105 1.705 1 1 553 . 9 1 1 A 70 70 LEU H H 70 9.560 9.019 0.541 1 1 554 . 9 1 1 A 70 70 LEU HA H 70 5.270 4.591 0.679 1 1 564 . 9 1 1 A 70 70 LEU C C 70 173.800 175.475 -1.675 1 1 565 . 9 1 1 A 70 70 LEU CA C 70 53.460 55.639 -2.179 1 1 566 . 9 1 1 A 70 70 LEU CB C 70 45.040 43.024 2.016 1 1 570 . 9 1 1 A 70 70 LEU N N 70 129.220 130.096 -0.876 1 1 571 . 9 1 1 A 71 71 ASN H H 71 9.590 8.690 0.900 1 1 572 . 9 1 1 A 71 71 ASN HA H 71 5.880 5.799 0.081 1 1 577 . 9 1 1 A 71 71 ASN C C 71 177.970 174.126 3.844 1 1 578 . 9 1 1 A 71 71 ASN CA C 71 52.060 52.049 0.011 1 1 579 . 9 1 1 A 71 71 ASN CB C 71 41.020 40.865 0.155 1 1 580 . 9 1 1 A 71 71 ASN N N 71 125.970 123.378 2.592 1 1 582 . 9 1 1 A 72 72 TYR H H 72 8.740 9.187 -0.447 1 1 583 . 9 1 1 A 72 72 TYR HA H 72 5.110 5.249 -0.139 1 1 588 . 9 1 1 A 72 72 TYR C C 72 177.720 173.538 4.182 1 1 589 . 9 1 1 A 72 72 TYR CA C 72 55.310 55.245 0.065 1 1 590 . 9 1 1 A 72 72 TYR CB C 72 41.510 41.372 0.138 1 1 591 . 9 1 1 A 72 72 TYR N N 72 119.640 120.727 -1.087 1 1 592 . 9 1 1 A 73 73 ASP H H 73 9.780 8.932 0.848 1 1 593 . 9 1 1 A 73 73 ASP HA H 73 4.680 5.117 -0.437 1 1 596 . 9 1 1 A 73 73 ASP C C 73 177.290 176.575 0.715 1 1 597 . 9 1 1 A 73 73 ASP CA C 73 53.650 53.478 0.172 1 1 598 . 9 1 1 A 73 73 ASP CB C 73 40.900 42.939 -2.039 1 1 599 . 9 1 1 A 73 73 ASP N N 73 119.290 119.494 -0.204 1 1 600 . 9 1 1 A 74 74 GLU H H 74 9.430 8.538 0.892 1 1 601 . 9 1 1 A 74 74 GLU HA H 74 4.740 4.444 0.296 1 1 606 . 9 1 1 A 74 74 GLU C C 74 176.320 178.375 -2.055 1 1 607 . 9 1 1 A 74 74 GLU CA C 74 57.410 57.853 -0.443 1 1 608 . 9 1 1 A 74 74 GLU CB C 74 29.490 30.819 -1.329 1 1 610 . 9 1 1 A 74 74 GLU N N 74 130.930 120.336 10.594 1 1 611 . 9 1 1 A 75 75 ASN H H 75 8.680 8.145 0.535 1 1 612 . 9 1 1 A 75 75 ASN HA H 75 4.600 4.510 0.090 1 1 617 . 9 1 1 A 75 75 ASN C C 75 175.340 176.780 -1.440 1 1 618 . 9 1 1 A 75 75 ASN CA C 75 54.620 55.768 -1.148 1 1 619 . 9 1 1 A 75 75 ASN CB C 75 38.770 38.563 0.207 1 1 620 . 9 1 1 A 75 75 ASN N N 75 115.040 118.576 -3.536 1 1 622 . 9 1 1 A 76 76 ALA H H 76 7.740 7.874 -0.134 1 1 623 . 9 1 1 A 76 76 ALA HA H 76 4.310 4.483 -0.173 1 1 627 . 9 1 1 A 76 76 ALA C C 76 175.550 176.984 -1.434 1 1 628 . 9 1 1 A 76 76 ALA CA C 76 53.260 52.989 0.271 1 1 629 . 9 1 1 A 76 76 ALA CB C 76 21.450 21.143 0.307 1 1 630 . 9 1 1 A 76 76 ALA N N 76 122.200 119.989 2.211 1 1 631 . 9 1 1 A 77 77 PHE H H 77 8.070 7.955 0.115 1 1 632 . 9 1 1 A 77 77 PHE HA H 77 5.650 5.265 0.385 1 1 637 . 9 1 1 A 77 77 PHE C C 77 174.570 175.392 -0.822 1 1 638 . 9 1 1 A 77 77 PHE CA C 77 56.360 57.516 -1.156 1 1 639 . 9 1 1 A 77 77 PHE CB C 77 46.080 40.974 5.106 1 1 640 . 9 1 1 A 77 77 PHE N N 77 114.160 114.466 -0.306 1 1 641 . 9 1 1 A 78 78 GLU H H 78 8.800 8.962 -0.162 1 1 642 . 9 1 1 A 78 78 GLU HA H 78 4.900 4.997 -0.097 1 1 647 . 9 1 1 A 78 78 GLU C C 78 175.950 174.901 1.049 1 1 648 . 9 1 1 A 78 78 GLU CA C 78 53.670 56.514 -2.844 1 1 649 . 9 1 1 A 78 78 GLU CB C 78 33.600 32.522 1.078 1 1 651 . 9 1 1 A 78 78 GLU N N 78 117.590 120.709 -3.119 1 1 652 . 9 1 1 A 79 79 TYR H H 79 8.770 9.865 -1.095 1 1 653 . 9 1 1 A 79 79 TYR HA H 79 4.250 4.171 0.079 1 1 658 . 9 1 1 A 79 79 TYR C C 79 174.580 175.254 -0.674 1 1 659 . 9 1 1 A 79 79 TYR CA C 79 59.250 59.558 -0.308 1 1 660 . 9 1 1 A 79 79 TYR CB C 79 38.310 39.117 -0.807 1 1 661 . 9 1 1 A 79 79 TYR N N 79 126.560 129.348 -2.788 1 1 662 . 9 1 1 A 80 80 VAL H H 80 8.220 8.325 -0.105 1 1 663 . 9 1 1 A 80 80 VAL HA H 80 3.690 3.790 -0.100 1 1 671 . 9 1 1 A 80 80 VAL C C 80 174.780 174.989 -0.209 1 1 672 . 9 1 1 A 80 80 VAL CA C 80 64.400 63.434 0.966 1 1 673 . 9 1 1 A 80 80 VAL CB C 80 33.510 32.066 1.444 1 1 676 . 9 1 1 A 80 80 VAL N N 80 129.460 126.605 2.855 1 1 677 . 9 1 1 A 81 81 GLU H H 81 6.920 6.944 -0.024 1 1 678 . 9 1 1 A 81 81 GLU HA H 81 4.260 4.508 -0.248 1 1 683 . 9 1 1 A 81 81 GLU C C 81 171.840 175.377 -3.537 1 1 684 . 9 1 1 A 81 81 GLU CA C 81 55.310 54.938 0.372 1 1 685 . 9 1 1 A 81 81 GLU CB C 81 30.520 33.631 -3.111 1 1 687 . 9 1 1 A 81 81 GLU N N 81 112.430 117.271 -4.841 1 1 688 . 9 1 1 A 82 82 ALA H H 82 8.310 8.172 0.138 1 1 689 . 9 1 1 A 82 82 ALA HA H 82 5.650 5.106 0.544 1 1 693 . 9 1 1 A 82 82 ALA C C 82 176.110 176.913 -0.803 1 1 694 . 9 1 1 A 82 82 ALA CA C 82 50.620 51.652 -1.032 1 1 695 . 9 1 1 A 82 82 ALA CB C 82 21.770 19.920 1.850 1 1 696 . 9 1 1 A 82 82 ALA N N 82 121.240 126.123 -4.883 1 1 697 . 9 1 1 A 83 83 ILE H H 83 9.150 9.245 -0.095 1 1 698 . 9 1 1 A 83 83 ILE HA H 83 4.600 4.797 -0.197 1 1 708 . 9 1 1 A 83 83 ILE C C 83 174.810 174.398 0.412 1 1 709 . 9 1 1 A 83 83 ILE CA C 83 60.060 59.149 0.911 1 1 710 . 9 1 1 A 83 83 ILE CB C 83 42.440 41.720 0.720 1 1 714 . 9 1 1 A 83 83 ILE N N 83 119.720 120.055 -0.335 1 1 715 . 9 1 1 A 84 84 SER H H 84 8.350 8.823 -0.473 1 1 716 . 9 1 1 A 84 84 SER HA H 84 4.660 4.967 -0.307 1 1 719 . 9 1 1 A 84 84 SER C C 84 177.550 172.342 5.208 1 1 720 . 9 1 1 A 84 84 SER CA C 84 57.330 55.965 1.365 1 1 721 . 9 1 1 A 84 84 SER CB C 84 66.490 66.121 0.369 1 1 722 . 9 1 1 A 84 84 SER N N 84 116.740 119.650 -2.910 1 1 723 . 9 1 1 A 85 85 ASP H H 85 8.740 8.736 0.004 1 1 724 . 9 1 1 A 85 85 ASP HA H 85 4.820 4.676 0.144 1 1 727 . 9 1 1 A 85 85 ASP C C 85 176.090 176.157 -0.067 1 1 728 . 9 1 1 A 85 85 ASP CA C 85 53.480 53.296 0.184 1 1 729 . 9 1 1 A 85 85 ASP CB C 85 42.480 42.404 0.076 1 1 730 . 9 1 1 A 85 85 ASP N N 85 120.960 123.615 -2.655 1 1 731 . 9 1 1 A 86 86 ASP H H 86 8.380 8.637 -0.257 1 1 732 . 9 1 1 A 86 86 ASP HA H 86 4.450 4.903 -0.453 1 1 735 . 9 1 1 A 86 86 ASP C C 86 177.100 177.124 -0.024 1 1 736 . 9 1 1 A 86 86 ASP CA C 86 56.240 53.279 2.961 1 1 737 . 9 1 1 A 86 86 ASP CB C 86 41.100 41.405 -0.305 1 1 738 . 9 1 1 A 86 86 ASP N N 86 117.710 121.951 -4.241 1 1 739 . 9 1 1 A 87 87 GLY H H 87 8.690 7.571 1.119 1 1 740 . 9 1 1 A 87 87 GLY HA2 H 87 3.870 4.082 -0.212 1 1 741 . 9 1 1 A 87 87 GLY HA3 H 87 4.090 4.091 -0.001 1 1 742 . 9 1 1 A 87 87 GLY C C 87 173.800 174.170 -0.370 1 1 743 . 9 1 1 A 87 87 GLY CA C 87 45.770 45.677 0.093 1 1 744 . 9 1 1 A 87 87 GLY N N 87 108.540 107.242 1.298 1 1 745 . 9 1 1 A 88 88 VAL H H 88 7.910 7.657 0.253 1 1 746 . 9 1 1 A 88 88 VAL HA H 88 4.780 4.350 0.430 1 1 754 . 9 1 1 A 88 88 VAL C C 88 173.970 174.716 -0.746 1 1 755 . 9 1 1 A 88 88 VAL CA C 88 60.900 61.207 -0.307 1 1 756 . 9 1 1 A 88 88 VAL CB C 88 35.460 33.321 2.139 1 1 759 . 9 1 1 A 88 88 VAL N N 88 119.790 118.934 0.856 1 1 760 . 9 1 1 A 89 89 PHE H H 89 9.210 9.756 -0.546 1 1 761 . 9 1 1 A 89 89 PHE HA H 89 4.930 5.360 -0.430 1 1 766 . 9 1 1 A 89 89 PHE C C 89 173.970 173.534 0.436 1 1 767 . 9 1 1 A 89 89 PHE CA C 89 56.450 55.935 0.515 1 1 768 . 9 1 1 A 89 89 PHE CB C 89 41.120 42.594 -1.474 1 1 769 . 9 1 1 A 89 89 PHE N N 89 126.780 124.231 2.549 1 1 770 . 9 1 1 A 90 90 VAL H H 90 7.880 8.039 -0.159 1 1 771 . 9 1 1 A 90 90 VAL HA H 90 4.860 4.845 0.015 1 1 779 . 9 1 1 A 90 90 VAL C C 90 173.190 174.530 -1.340 1 1 780 . 9 1 1 A 90 90 VAL CA C 90 59.750 60.275 -0.525 1 1 781 . 9 1 1 A 90 90 VAL CB C 90 34.770 35.750 -0.980 1 1 784 . 9 1 1 A 90 90 VAL N N 90 124.990 125.203 -0.213 1 1 785 . 9 1 1 A 91 91 ASN H H 91 8.670 8.693 -0.023 1 1 786 . 9 1 1 A 91 91 ASN HA H 91 4.730 5.125 -0.395 1 1 791 . 9 1 1 A 91 91 ASN C C 91 173.200 174.212 -1.012 1 1 792 . 9 1 1 A 91 91 ASN CA C 91 51.970 53.268 -1.298 1 1 793 . 9 1 1 A 91 91 ASN CB C 91 41.340 40.910 0.430 1 1 794 . 9 1 1 A 91 91 ASN N N 91 124.860 124.720 0.140 1 1 796 . 9 1 1 A 92 92 ALA H H 92 8.840 9.096 -0.256 1 1 797 . 9 1 1 A 92 92 ALA HA H 92 5.290 4.699 0.591 1 1 801 . 9 1 1 A 92 92 ALA C C 92 176.330 176.620 -0.290 1 1 802 . 9 1 1 A 92 92 ALA CA C 92 50.170 51.286 -1.116 1 1 803 . 9 1 1 A 92 92 ALA CB C 92 23.610 21.208 2.402 1 1 804 . 9 1 1 A 92 92 ALA N N 92 128.510 129.179 -0.669 1 1 805 . 9 1 1 A 93 93 LYS H H 93 8.670 8.911 -0.241 1 1 806 . 9 1 1 A 93 93 LYS HA H 93 4.460 4.876 -0.416 1 1 815 . 9 1 1 A 93 93 LYS C C 93 174.170 175.614 -1.444 1 1 816 . 9 1 1 A 93 93 LYS CA C 93 55.010 54.787 0.223 1 1 817 . 9 1 1 A 93 93 LYS CB C 93 36.430 35.009 1.421 1 1 821 . 9 1 1 A 93 93 LYS N N 93 121.300 117.223 4.077 1 1 822 . 9 1 1 A 94 94 LYS H H 94 8.960 8.698 0.262 1 1 823 . 9 1 1 A 94 94 LYS HA H 94 4.460 4.226 0.234 1 1 832 . 9 1 1 A 94 94 LYS C C 94 176.330 176.792 -0.462 1 1 833 . 9 1 1 A 94 94 LYS CA C 94 56.720 56.728 -0.008 1 1 834 . 9 1 1 A 94 94 LYS CB C 94 31.930 32.757 -0.827 1 1 837 . 9 1 1 A 94 94 LYS N N 94 127.060 125.980 1.080 1 1 838 . 9 1 1 A 95 95 ILE H H 95 8.290 8.687 -0.397 1 1 839 . 9 1 1 A 95 95 ILE HA H 95 4.120 4.096 0.024 1 1 849 . 9 1 1 A 95 95 ILE C C 95 175.740 175.332 0.408 1 1 850 . 9 1 1 A 95 95 ILE CA C 95 62.760 62.654 0.106 1 1 851 . 9 1 1 A 95 95 ILE CB C 95 38.890 39.221 -0.331 1 1 855 . 9 1 1 A 95 95 ILE N N 95 126.530 128.017 -1.487 1 1 856 . 9 1 1 A 96 96 GLU H H 96 8.030 7.302 0.728 1 1 857 . 9 1 1 A 96 96 GLU HA H 96 4.450 4.581 -0.131 1 1 862 . 9 1 1 A 96 96 GLU C C 96 174.380 174.083 0.297 1 1 863 . 9 1 1 A 96 96 GLU CA C 96 54.320 55.576 -1.256 1 1 864 . 9 1 1 A 96 96 GLU CB C 96 32.770 32.779 -0.009 1 1 866 . 9 1 1 A 96 96 GLU N N 96 117.080 120.532 -3.452 1 1 867 . 9 1 1 A 97 97 ASP H H 97 8.730 8.773 -0.043 1 1 868 . 9 1 1 A 97 97 ASP HA H 97 4.360 4.608 -0.248 1 1 871 . 9 1 1 A 97 97 ASP C C 97 177.100 177.193 -0.093 1 1 872 . 9 1 1 A 97 97 ASP CA C 97 57.160 55.031 2.129 1 1 873 . 9 1 1 A 97 97 ASP CB C 97 39.920 41.304 -1.384 1 1 874 . 9 1 1 A 97 97 ASP N N 97 120.570 120.582 -0.012 1 1 875 . 9 1 1 A 98 98 GLY H H 98 8.760 8.548 0.212 1 1 876 . 9 1 1 A 98 98 GLY HA2 H 98 2.120 1.369 0.751 1 1 877 . 9 1 1 A 98 98 GLY HA3 H 98 3.910 3.330 0.580 1 1 878 . 9 1 1 A 98 98 GLY C C 98 174.000 172.892 1.108 1 1 879 . 9 1 1 A 98 98 GLY CA C 98 45.720 45.127 0.593 1 1 880 . 9 1 1 A 98 98 GLY N N 98 112.090 111.825 0.265 1 1 881 . 9 1 1 A 99 99 LYS H H 99 7.890 7.233 0.657 1 1 882 . 9 1 1 A 99 99 LYS HA H 99 5.330 5.153 0.177 1 1 891 . 9 1 1 A 99 99 LYS C C 99 174.750 174.369 0.381 1 1 892 . 9 1 1 A 99 99 LYS CA C 99 55.990 54.855 1.135 1 1 893 . 9 1 1 A 99 99 LYS CB C 99 37.840 35.489 2.351 1 1 897 . 9 1 1 A 99 99 LYS N N 99 118.050 114.875 3.175 1 1 898 . 9 1 1 A 100 100 VAL H H 100 8.980 8.379 0.601 1 1 899 . 9 1 1 A 100 100 VAL HA H 100 4.510 4.754 -0.244 1 1 907 . 9 1 1 A 100 100 VAL C C 100 174.760 173.734 1.026 1 1 908 . 9 1 1 A 100 100 VAL CA C 100 60.130 59.042 1.088 1 1 909 . 9 1 1 A 100 100 VAL CB C 100 35.240 35.790 -0.550 1 1 912 . 9 1 1 A 100 100 VAL N N 100 123.850 119.565 4.285 1 1 913 . 9 1 1 A 101 101 ARG H H 101 8.810 8.134 0.676 1 1 914 . 9 1 1 A 101 101 ARG HA H 101 4.850 4.683 0.167 1 1 921 . 9 1 1 A 101 101 ARG C C 101 174.770 174.434 0.336 1 1 922 . 9 1 1 A 101 101 ARG CA C 101 54.580 54.971 -0.391 1 1 923 . 9 1 1 A 101 101 ARG CB C 101 32.400 31.359 1.041 1 1 926 . 9 1 1 A 101 101 ARG N N 101 129.210 123.678 5.532 1 1 927 . 9 1 1 A 102 102 VAL H H 102 9.100 8.120 0.980 1 1 928 . 9 1 1 A 102 102 VAL HA H 102 4.120 4.800 -0.680 1 1 936 . 9 1 1 A 102 102 VAL C C 102 171.640 173.794 -2.154 1 1 937 . 9 1 1 A 102 102 VAL CA C 102 61.350 59.330 2.020 1 1 938 . 9 1 1 A 102 102 VAL CB C 102 32.530 34.731 -2.201 1 1 941 . 9 1 1 A 102 102 VAL N N 102 130.470 123.376 7.094 1 1 942 . 9 1 1 A 103 103 LEU H H 103 8.110 8.863 -0.753 1 1 943 . 9 1 1 A 103 103 LEU HA H 103 5.120 4.844 0.276 1 1 953 . 9 1 1 A 103 103 LEU C C 103 176.410 175.785 0.625 1 1 954 . 9 1 1 A 103 103 LEU CA C 103 53.380 53.579 -0.199 1 1 955 . 9 1 1 A 103 103 LEU CB C 103 43.680 43.498 0.182 1 1 959 . 9 1 1 A 103 103 LEU N N 103 125.560 128.865 -3.305 1 1 960 . 9 1 1 A 104 104 VAL H H 104 9.580 8.749 0.831 1 1 961 . 9 1 1 A 104 104 VAL HA H 104 5.260 5.421 -0.161 1 1 969 . 9 1 1 A 104 104 VAL C C 104 176.030 175.036 0.994 1 1 970 . 9 1 1 A 104 104 VAL CA C 104 60.220 60.095 0.125 1 1 971 . 9 1 1 A 104 104 VAL CB C 104 34.310 34.042 0.268 1 1 974 . 9 1 1 A 104 104 VAL N N 104 125.790 120.827 4.963 1 1 975 . 9 1 1 A 105 105 SER H H 105 9.340 9.235 0.105 1 1 976 . 9 1 1 A 105 105 SER HA H 105 5.300 5.109 0.191 1 1 979 . 9 1 1 A 105 105 SER C C 105 173.600 173.204 0.396 1 1 980 . 9 1 1 A 105 105 SER CA C 105 57.450 57.352 0.098 1 1 981 . 9 1 1 A 105 105 SER CB C 105 65.600 66.912 -1.312 1 1 982 . 9 1 1 A 105 105 SER N N 105 119.220 117.083 2.137 1 1 983 . 9 1 1 A 106 106 SER H H 106 8.350 9.044 -0.694 1 1 984 . 9 1 1 A 106 106 SER HA H 106 4.720 4.590 0.130 1 1 987 . 9 1 1 A 106 106 SER C C 106 176.930 174.449 2.481 1 1 988 . 9 1 1 A 106 106 SER CA C 106 58.170 59.311 -1.141 1 1 989 . 9 1 1 A 106 106 SER CB C 106 64.170 62.933 1.237 1 1 990 . 9 1 1 A 106 106 SER N N 106 114.800 120.350 -5.550 1 1 991 . 9 1 1 A 107 107 LEU H H 107 8.770 8.986 -0.216 1 1 992 . 9 1 1 A 107 107 LEU HA H 107 4.710 4.654 0.056 1 1 1001 . 9 1 1 A 107 107 LEU C C 107 178.280 177.662 0.618 1 1 1002 . 9 1 1 A 107 107 LEU CA C 107 55.280 54.417 0.863 1 1 1003 . 9 1 1 A 107 107 LEU CB C 107 43.410 42.392 1.018 1 1 1007 . 9 1 1 A 107 107 LEU N N 107 127.210 128.002 -0.792 1 1 1008 . 9 1 1 A 108 108 THR H H 108 8.210 7.839 0.371 1 1 1009 . 9 1 1 A 108 108 THR HA H 108 4.400 4.571 -0.171 1 1 1015 . 9 1 1 A 108 108 THR C C 108 176.130 175.557 0.573 1 1 1016 . 9 1 1 A 108 108 THR CA C 108 62.050 62.357 -0.307 1 1 1017 . 9 1 1 A 108 108 THR CB C 108 70.910 70.984 -0.074 1 1 1019 . 9 1 1 A 108 108 THR N N 108 108.810 111.830 -3.020 1 1 1020 . 9 1 1 A 109 109 GLY H H 109 8.250 7.949 0.301 1 1 1021 . 9 1 1 A 109 109 GLY HA2 H 109 3.780 4.059 -0.279 1 1 1022 . 9 1 1 A 109 109 GLY HA3 H 109 4.290 4.071 0.219 1 1 1023 . 9 1 1 A 109 109 GLY C C 109 173.180 174.363 -1.183 1 1 1024 . 9 1 1 A 109 109 GLY CA C 109 45.340 45.303 0.037 1 1 1025 . 9 1 1 A 109 109 GLY N N 109 110.160 110.652 -0.492 1 1 1026 . 9 1 1 A 110 110 GLU H H 110 7.960 7.506 0.454 1 1 1027 . 9 1 1 A 110 110 GLU HA H 110 4.760 4.793 -0.033 1 1 1032 . 9 1 1 A 110 110 GLU CA C 110 53.450 53.853 -0.403 1 1 1033 . 9 1 1 A 110 110 GLU CB C 110 30.020 30.603 -0.583 1 1 1035 . 9 1 1 A 110 110 GLU N N 110 119.720 118.802 0.918 1 1 1036 . 9 1 1 A 111 111 PRO HA H 111 3.250 4.115 -0.865 1 1 1043 . 9 1 1 A 111 111 PRO C C 111 176.710 176.254 0.456 1 1 1044 . 9 1 1 A 111 111 PRO CA C 111 62.240 61.785 0.455 1 1 1045 . 9 1 1 A 111 111 PRO CB C 111 31.990 32.236 -0.246 1 1 1048 . 9 1 1 A 112 112 LEU H H 112 8.840 8.037 0.803 1 1 1049 . 9 1 1 A 112 112 LEU HA H 112 4.290 4.265 0.025 1 1 1059 . 9 1 1 A 112 112 LEU CA C 112 52.220 53.222 -1.002 1 1 1060 . 9 1 1 A 112 112 LEU CB C 112 41.090 42.948 -1.858 1 1 1063 . 9 1 1 A 112 112 LEU N N 112 122.420 123.221 -0.801 1 1 1064 . 9 1 1 A 113 113 PRO HA H 113 4.380 4.271 0.109 1 1 1071 . 9 1 1 A 113 113 PRO C C 113 176.100 177.513 -1.413 1 1 1072 . 9 1 1 A 113 113 PRO CA C 113 61.930 65.145 -3.215 1 1 1073 . 9 1 1 A 113 113 PRO CB C 113 32.470 31.672 0.798 1 1 1076 . 9 1 1 A 114 114 ALA H H 114 8.070 7.786 0.284 1 1 1077 . 9 1 1 A 114 114 ALA HA H 114 4.550 3.945 0.605 1 1 1081 . 9 1 1 A 114 114 ALA C C 114 177.490 177.023 0.467 1 1 1082 . 9 1 1 A 114 114 ALA CA C 114 51.340 53.778 -2.438 1 1 1083 . 9 1 1 A 114 114 ALA CB C 114 19.940 18.187 1.753 1 1 1084 . 9 1 1 A 114 114 ALA N N 114 121.460 120.899 0.561 1 1 1085 . 9 1 1 A 115 115 LYS H H 115 9.000 8.423 0.577 1 1 1086 . 9 1 1 A 115 115 LYS HA H 115 3.930 3.869 0.061 1 1 1095 . 9 1 1 A 115 115 LYS C C 115 175.740 175.239 0.501 1 1 1096 . 9 1 1 A 115 115 LYS CA C 115 57.580 57.695 -0.115 1 1 1097 . 9 1 1 A 115 115 LYS CB C 115 29.510 30.670 -1.160 1 1 1101 . 9 1 1 A 115 115 LYS N N 115 112.560 115.433 -2.873 1 1 1102 . 9 1 1 A 116 116 GLU H H 116 7.620 7.654 -0.034 1 1 1103 . 9 1 1 A 116 116 GLU HA H 116 4.550 4.944 -0.394 1 1 1108 . 9 1 1 A 116 116 GLU C C 116 176.110 175.251 0.859 1 1 1109 . 9 1 1 A 116 116 GLU CA C 116 54.570 54.309 0.261 1 1 1110 . 9 1 1 A 116 116 GLU CB C 116 33.680 33.608 0.072 1 1 1112 . 9 1 1 A 116 116 GLU N N 116 115.710 117.630 -1.920 1 1 1113 . 9 1 1 A 117 117 VAL H H 117 8.770 8.796 -0.026 1 1 1114 . 9 1 1 A 117 117 VAL HA H 117 3.200 4.047 -0.847 1 1 1122 . 9 1 1 A 117 117 VAL C C 117 175.740 176.065 -0.325 1 1 1123 . 9 1 1 A 117 117 VAL CA C 117 65.340 63.258 2.082 1 1 1124 . 9 1 1 A 117 117 VAL CB C 117 31.290 30.961 0.329 1 1 1127 . 9 1 1 A 117 117 VAL N N 117 124.450 120.282 4.168 1 1 1128 . 9 1 1 A 118 118 LEU H H 118 8.550 9.071 -0.521 1 1 1129 . 9 1 1 A 118 118 LEU HA H 118 4.540 4.439 0.101 1 1 1139 . 9 1 1 A 118 118 LEU C C 118 176.210 176.547 -0.337 1 1 1140 . 9 1 1 A 118 118 LEU CA C 118 55.510 55.966 -0.456 1 1 1141 . 9 1 1 A 118 118 LEU CB C 118 44.600 43.058 1.542 1 1 1145 . 9 1 1 A 118 118 LEU N N 118 128.440 128.950 -0.510 1 1 1146 . 9 1 1 A 119 119 ALA H H 119 7.970 7.665 0.305 1 1 1147 . 9 1 1 A 119 119 ALA HA H 119 4.740 4.835 -0.095 1 1 1151 . 9 1 1 A 119 119 ALA C C 119 174.570 175.180 -0.610 1 1 1152 . 9 1 1 A 119 119 ALA CA C 119 50.770 51.777 -1.007 1 1 1153 . 9 1 1 A 119 119 ALA CB C 119 22.450 22.237 0.213 1 1 1154 . 9 1 1 A 119 119 ALA N N 119 118.100 118.248 -0.148 1 1 1155 . 9 1 1 A 120 120 LYS H H 120 8.760 8.793 -0.033 1 1 1156 . 9 1 1 A 120 120 LYS HA H 120 5.240 5.422 -0.182 1 1 1165 . 9 1 1 A 120 120 LYS C C 120 175.340 175.399 -0.059 1 1 1166 . 9 1 1 A 120 120 LYS CA C 120 54.220 54.940 -0.720 1 1 1167 . 9 1 1 A 120 120 LYS CB C 120 34.340 34.696 -0.356 1 1 1171 . 9 1 1 A 120 120 LYS N N 120 120.010 121.501 -1.491 1 1 1172 . 9 1 1 A 121 121 VAL H H 121 9.410 9.296 0.114 1 1 1173 . 9 1 1 A 121 121 VAL HA H 121 4.230 4.667 -0.437 1 1 1181 . 9 1 1 A 121 121 VAL C C 121 173.980 175.061 -1.081 1 1 1182 . 9 1 1 A 121 121 VAL CA C 121 62.370 61.512 0.858 1 1 1183 . 9 1 1 A 121 121 VAL CB C 121 32.410 31.537 0.873 1 1 1186 . 9 1 1 A 121 121 VAL N N 121 124.960 125.503 -0.543 1 1 1187 . 9 1 1 A 122 122 VAL H H 122 9.280 7.943 1.337 1 1 1188 . 9 1 1 A 122 122 VAL HA H 122 4.360 4.652 -0.292 1 1 1196 . 9 1 1 A 122 122 VAL C C 122 174.190 175.807 -1.617 1 1 1197 . 9 1 1 A 122 122 VAL CA C 122 62.760 61.770 0.990 1 1 1198 . 9 1 1 A 122 122 VAL CB C 122 32.020 32.053 -0.033 1 1 1201 . 9 1 1 A 122 122 VAL N N 122 128.990 125.046 3.944 1 1 1202 . 9 1 1 A 123 123 LEU H H 123 8.610 8.619 -0.009 1 1 1203 . 9 1 1 A 123 123 LEU HA H 123 4.900 4.496 0.404 1 1 1213 . 9 1 1 A 123 123 LEU C C 123 174.950 176.478 -1.528 1 1 1214 . 9 1 1 A 123 123 LEU CA C 123 52.050 53.598 -1.548 1 1 1215 . 9 1 1 A 123 123 LEU CB C 123 45.210 42.015 3.195 1 1 1219 . 9 1 1 A 123 123 LEU N N 123 127.200 127.690 -0.490 1 1 1220 . 9 1 1 A 124 124 ARG H H 124 9.540 8.939 0.601 1 1 1221 . 9 1 1 A 124 124 ARG HA H 124 4.900 4.980 -0.080 1 1 1229 . 9 1 1 A 124 124 ARG C C 124 176.320 175.276 1.044 1 1 1230 . 9 1 1 A 124 124 ARG CA C 124 55.320 54.574 0.746 1 1 1231 . 9 1 1 A 124 124 ARG CB C 124 31.750 32.284 -0.534 1 1 1234 . 9 1 1 A 124 124 ARG N N 124 124.290 122.360 1.930 1 1 1236 . 9 1 1 A 125 125 ALA H H 125 8.880 8.466 0.414 1 1 1237 . 9 1 1 A 125 125 ALA HA H 125 4.380 3.882 0.498 1 1 1241 . 9 1 1 A 125 125 ALA C C 125 177.290 177.666 -0.376 1 1 1242 . 9 1 1 A 125 125 ALA CA C 125 52.530 51.171 1.359 1 1 1243 . 9 1 1 A 125 125 ALA CB C 125 19.870 17.256 2.614 1 1 1244 . 9 1 1 A 125 125 ALA N N 125 130.790 129.273 1.517 1 1 1245 . 9 1 1 A 126 126 GLU H H 126 9.260 8.354 0.906 1 1 1246 . 9 1 1 A 126 126 GLU HA H 126 4.460 4.322 0.138 1 1 1251 . 9 1 1 A 126 126 GLU C C 126 176.120 176.100 0.020 1 1 1252 . 9 1 1 A 126 126 GLU CA C 126 56.940 57.105 -0.165 1 1 1253 . 9 1 1 A 126 126 GLU CB C 126 32.450 30.200 2.250 1 1 1255 . 9 1 1 A 126 126 GLU N N 126 125.740 123.228 2.512 1 1 1256 . 9 1 1 A 127 127 ALA H H 127 7.460 7.459 0.001 1 1 1257 . 9 1 1 A 127 127 ALA HA H 127 4.360 4.597 -0.237 1 1 1261 . 9 1 1 A 127 127 ALA C C 127 173.400 175.810 -2.410 1 1 1262 . 9 1 1 A 127 127 ALA CA C 127 51.360 51.589 -0.229 1 1 1263 . 9 1 1 A 127 127 ALA CB C 127 22.180 22.077 0.103 1 1 1264 . 9 1 1 A 127 127 ALA N N 127 120.910 119.440 1.470 1 1 1265 . 9 1 1 A 128 128 LYS H H 128 7.940 8.658 -0.718 1 1 1266 . 9 1 1 A 128 128 LYS HA H 128 3.580 4.118 -0.538 1 1 1275 . 9 1 1 A 128 128 LYS C C 128 176.080 175.767 0.313 1 1 1276 . 9 1 1 A 128 128 LYS CA C 128 56.860 57.051 -0.191 1 1 1277 . 9 1 1 A 128 128 LYS CB C 128 33.170 33.145 0.025 1 1 1281 . 9 1 1 A 128 128 LYS N N 128 116.520 124.536 -8.016 1 1 1282 . 9 1 1 A 129 129 ALA H H 129 8.590 8.784 -0.194 1 1 1283 . 9 1 1 A 129 129 ALA HA H 129 4.390 4.680 -0.290 1 1 1287 . 9 1 1 A 129 129 ALA C C 129 174.970 175.513 -0.543 1 1 1288 . 9 1 1 A 129 129 ALA CA C 129 52.970 51.388 1.582 1 1 1289 . 9 1 1 A 129 129 ALA CB C 129 21.500 18.879 2.621 1 1 1290 . 9 1 1 A 129 129 ALA N N 129 124.710 127.862 -3.152 1 1 1291 . 9 1 1 A 130 130 GLU H H 130 8.660 8.181 0.479 1 1 1292 . 9 1 1 A 130 130 GLU HA H 130 4.660 4.186 0.474 1 1 1297 . 9 1 1 A 130 130 GLU C C 130 177.390 177.090 0.300 1 1 1298 . 9 1 1 A 130 130 GLU CA C 130 55.070 57.619 -2.549 1 1 1299 . 9 1 1 A 130 130 GLU CB C 130 30.860 29.169 1.691 1 1 1301 . 9 1 1 A 130 130 GLU N N 130 123.180 118.057 5.123 1 1 1302 . 9 1 1 A 131 131 GLY H H 131 9.170 9.129 0.041 1 1 1303 . 9 1 1 A 131 131 GLY HA2 H 131 3.560 3.990 -0.430 1 1 1304 . 9 1 1 A 131 131 GLY HA3 H 131 3.750 3.996 -0.246 1 1 1305 . 9 1 1 A 131 131 GLY C C 131 174.550 174.437 0.113 1 1 1306 . 9 1 1 A 131 131 GLY CA C 131 47.660 45.745 1.915 1 1 1307 . 9 1 1 A 131 131 GLY N N 131 115.530 113.386 2.144 1 1 1308 . 9 1 1 A 132 132 SER H H 132 8.430 8.169 0.261 1 1 1309 . 9 1 1 A 132 132 SER HA H 132 4.170 4.549 -0.379 1 1 1312 . 9 1 1 A 132 132 SER C C 132 175.350 173.741 1.609 1 1 1313 . 9 1 1 A 132 132 SER CA C 132 59.050 57.179 1.871 1 1 1314 . 9 1 1 A 132 132 SER CB C 132 64.880 61.618 3.262 1 1 1315 . 9 1 1 A 132 132 SER N N 132 115.930 116.724 -0.794 1 1 1316 . 9 1 1 A 133 133 ASN H H 133 8.850 9.067 -0.217 1 1 1317 . 9 1 1 A 133 133 ASN HA H 133 4.910 5.165 -0.255 1 1 1322 . 9 1 1 A 133 133 ASN C C 133 175.450 174.889 0.561 1 1 1323 . 9 1 1 A 133 133 ASN CA C 133 54.920 53.886 1.034 1 1 1324 . 9 1 1 A 133 133 ASN CB C 133 41.060 39.107 1.953 1 1 1325 . 9 1 1 A 133 133 ASN N N 133 125.590 125.577 0.013 1 1 1327 . 9 1 1 A 134 134 LEU H H 134 9.070 9.508 -0.438 1 1 1328 . 9 1 1 A 134 134 LEU HA H 134 5.230 5.437 -0.207 1 1 1338 . 9 1 1 A 134 134 LEU C C 134 175.240 176.245 -1.005 1 1 1339 . 9 1 1 A 134 134 LEU CA C 134 53.470 53.326 0.144 1 1 1340 . 9 1 1 A 134 134 LEU CB C 134 45.090 45.234 -0.144 1 1 1344 . 9 1 1 A 134 134 LEU N N 134 129.210 126.546 2.664 1 1 1345 . 9 1 1 A 135 135 SER H H 135 8.690 9.031 -0.341 1 1 1346 . 9 1 1 A 135 135 SER HA H 135 5.280 5.344 -0.064 1 1 1349 . 9 1 1 A 135 135 SER C C 135 173.590 173.431 0.159 1 1 1350 . 9 1 1 A 135 135 SER CA C 135 56.220 56.713 -0.493 1 1 1351 . 9 1 1 A 135 135 SER CB C 135 66.510 65.963 0.547 1 1 1352 . 9 1 1 A 135 135 SER N N 135 113.020 116.935 -3.915 1 1 1353 . 9 1 1 A 136 136 VAL H H 136 8.940 8.504 0.436 1 1 1354 . 9 1 1 A 136 136 VAL HA H 136 5.500 4.907 0.593 1 1 1362 . 9 1 1 A 136 136 VAL C C 136 175.730 175.024 0.706 1 1 1363 . 9 1 1 A 136 136 VAL CA C 136 60.960 60.772 0.188 1 1 1364 . 9 1 1 A 136 136 VAL CB C 136 33.630 32.898 0.732 1 1 1367 . 9 1 1 A 136 136 VAL N N 136 124.340 119.302 5.038 1 1 1368 . 9 1 1 A 137 137 THR H H 137 9.240 8.505 0.735 1 1 1369 . 9 1 1 A 137 137 THR HA H 137 4.920 4.774 0.146 1 1 1374 . 9 1 1 A 137 137 THR C C 137 173.500 174.599 -1.099 1 1 1375 . 9 1 1 A 137 137 THR CA C 137 59.120 60.327 -1.207 1 1 1376 . 9 1 1 A 137 137 THR CB C 137 72.500 70.414 2.086 1 1 1378 . 9 1 1 A 137 137 THR N N 137 117.010 118.371 -1.361 1 1 1379 . 9 1 1 A 138 138 ASN H H 138 9.190 8.892 0.298 1 1 1380 . 9 1 1 A 138 138 ASN HA H 138 4.420 4.325 0.095 1 1 1385 . 9 1 1 A 138 138 ASN C C 138 175.550 175.217 0.333 1 1 1386 . 9 1 1 A 138 138 ASN CA C 138 54.350 54.148 0.202 1 1 1387 . 9 1 1 A 138 138 ASN CB C 138 37.380 36.332 1.048 1 1 1388 . 9 1 1 A 138 138 ASN N N 138 115.270 119.122 -3.852 1 1 1390 . 9 1 1 A 139 139 SER H H 139 8.560 7.830 0.730 1 1 1391 . 9 1 1 A 139 139 SER HA H 139 5.800 4.367 1.433 1 1 1394 . 9 1 1 A 139 139 SER C C 139 175.750 173.900 1.850 1 1 1395 . 9 1 1 A 139 139 SER CA C 139 56.020 57.976 -1.956 1 1 1396 . 9 1 1 A 139 139 SER CB C 139 65.320 62.362 2.958 1 1 1397 . 9 1 1 A 139 139 SER N N 139 112.360 115.799 -3.439 1 1 1398 . 9 1 1 A 140 140 SER H H 140 9.900 9.006 0.894 1 1 1399 . 9 1 1 A 140 140 SER HA H 140 5.360 5.219 0.141 1 1 1402 . 9 1 1 A 140 140 SER C C 140 172.620 172.977 -0.357 1 1 1403 . 9 1 1 A 140 140 SER CA C 140 57.400 57.592 -0.192 1 1 1404 . 9 1 1 A 140 140 SER CB C 140 66.550 64.832 1.718 1 1 1405 . 9 1 1 A 140 140 SER N N 140 119.130 121.275 -2.145 1 1 1406 . 9 1 1 A 141 141 VAL H H 141 9.030 9.008 0.022 1 1 1407 . 9 1 1 A 141 141 VAL HA H 141 5.520 5.176 0.344 1 1 1415 . 9 1 1 A 141 141 VAL C C 141 174.750 174.427 0.323 1 1 1416 . 9 1 1 A 141 141 VAL CA C 141 58.310 59.760 -1.450 1 1 1417 . 9 1 1 A 141 141 VAL CB C 141 35.030 35.381 -0.351 1 1 1420 . 9 1 1 A 141 141 VAL N N 141 111.410 123.683 -12.273 1 1 1421 . 9 1 1 A 142 142 GLY H H 142 8.790 9.080 -0.290 1 1 1422 . 9 1 1 A 142 142 GLY HA2 H 142 3.600 4.030 -0.430 1 1 1423 . 9 1 1 A 142 142 GLY HA3 H 142 5.310 4.045 1.265 1 1 1424 . 9 1 1 A 142 142 GLY C C 142 174.180 173.689 0.491 1 1 1425 . 9 1 1 A 142 142 GLY CA C 142 44.110 45.761 -1.651 1 1 1426 . 9 1 1 A 142 142 GLY N N 142 109.330 115.620 -6.290 1 1 1427 . 9 1 1 A 143 143 ASP H H 143 8.840 9.116 -0.276 1 1 1428 . 9 1 1 A 143 143 ASP HA H 143 5.790 5.167 0.623 1 1 1431 . 9 1 1 A 143 143 ASP C C 143 178.860 178.129 0.731 1 1 1432 . 9 1 1 A 143 143 ASP CA C 143 53.040 54.809 -1.769 1 1 1433 . 9 1 1 A 143 143 ASP CB C 143 43.660 42.552 1.108 1 1 1434 . 9 1 1 A 143 143 ASP N N 143 125.390 126.423 -1.033 1 1 1435 . 9 1 1 A 144 144 GLY H H 144 9.150 8.868 0.282 1 1 1436 . 9 1 1 A 144 144 GLY HA2 H 144 3.450 3.590 -0.140 1 1 1437 . 9 1 1 A 144 144 GLY HA3 H 144 3.720 3.937 -0.217 1 1 1438 . 9 1 1 A 144 144 GLY C C 144 174.770 175.913 -1.143 1 1 1439 . 9 1 1 A 144 144 GLY CA C 144 46.930 47.780 -0.850 1 1 1440 . 9 1 1 A 144 144 GLY N N 144 106.470 110.383 -3.913 1 1 1441 . 9 1 1 A 145 145 GLU H H 145 8.470 7.883 0.587 1 1 1442 . 9 1 1 A 145 145 GLU HA H 145 4.460 4.256 0.204 1 1 1447 . 9 1 1 A 145 145 GLU C C 145 176.520 176.297 0.223 1 1 1448 . 9 1 1 A 145 145 GLU CA C 145 55.330 57.250 -1.920 1 1 1449 . 9 1 1 A 145 145 GLU CB C 145 30.620 30.031 0.589 1 1 1451 . 9 1 1 A 145 145 GLU N N 145 119.170 121.166 -1.996 1 1 1452 . 9 1 1 A 146 146 GLY H H 146 7.950 7.865 0.085 1 1 1453 . 9 1 1 A 146 146 GLY HA2 H 146 3.630 4.010 -0.380 1 1 1454 . 9 1 1 A 146 146 GLY HA3 H 146 4.130 4.010 0.120 1 1 1455 . 9 1 1 A 146 146 GLY C C 146 174.350 174.811 -0.461 1 1 1456 . 9 1 1 A 146 146 GLY CA C 146 45.330 45.290 0.040 1 1 1457 . 9 1 1 A 146 146 GLY N N 146 108.130 106.301 1.829 1 1 1458 . 9 1 1 A 147 147 LEU H H 147 8.440 7.955 0.485 1 1 1459 . 9 1 1 A 147 147 LEU HA H 147 4.340 4.383 -0.043 1 1 1469 . 9 1 1 A 147 147 LEU C C 147 175.950 175.400 0.550 1 1 1470 . 9 1 1 A 147 147 LEU CA C 147 54.860 54.850 0.010 1 1 1471 . 9 1 1 A 147 147 LEU CB C 147 41.590 42.234 -0.644 1 1 1475 . 9 1 1 A 147 147 LEU N N 147 124.000 122.465 1.535 1 1 1476 . 9 1 1 A 148 148 VAL H H 148 7.780 8.312 -0.532 1 1 1477 . 9 1 1 A 148 148 VAL HA H 148 4.830 5.281 -0.451 1 1 1485 . 9 1 1 A 148 148 VAL C C 148 175.740 173.484 2.256 1 1 1486 . 9 1 1 A 148 148 VAL CA C 148 61.140 59.435 1.705 1 1 1487 . 9 1 1 A 148 148 VAL CB C 148 33.640 35.242 -1.602 1 1 1490 . 9 1 1 A 148 148 VAL N N 148 120.440 119.519 0.921 1 1 1491 . 9 1 1 A 149 149 HIS H H 149 9.170 8.563 0.607 1 1 1492 . 9 1 1 A 149 149 HIS HA H 149 4.950 5.092 -0.142 1 1 1496 . 9 1 1 A 149 149 HIS C C 149 174.780 174.723 0.057 1 1 1497 . 9 1 1 A 149 149 HIS CA C 149 53.900 54.280 -0.380 1 1 1498 . 9 1 1 A 149 149 HIS CB C 149 32.200 30.667 1.533 1 1 1499 . 9 1 1 A 149 149 HIS N N 149 124.700 125.823 -1.123 1 1 1500 . 9 1 1 A 150 150 GLU H H 150 9.060 8.633 0.427 1 1 1501 . 9 1 1 A 150 150 GLU HA H 150 4.420 4.414 0.006 1 1 1506 . 9 1 1 A 150 150 GLU C C 150 176.520 176.712 -0.192 1 1 1507 . 9 1 1 A 150 150 GLU CA C 150 57.630 56.884 0.746 1 1 1508 . 9 1 1 A 150 150 GLU CB C 150 30.370 30.133 0.237 1 1 1510 . 9 1 1 A 150 150 GLU N N 150 125.540 123.684 1.856 1 1 1511 . 9 1 1 A 151 151 ILE H H 151 8.150 8.238 -0.088 1 1 1512 . 9 1 1 A 151 151 ILE HA H 151 4.780 4.502 0.278 1 1 1522 . 9 1 1 A 151 151 ILE C C 151 174.570 176.382 -1.812 1 1 1523 . 9 1 1 A 151 151 ILE CA C 151 59.390 59.580 -0.190 1 1 1524 . 9 1 1 A 151 151 ILE CB C 151 42.040 39.338 2.702 1 1 1528 . 9 1 1 A 151 151 ILE N N 151 115.880 122.724 -6.844 1 1 1529 . 9 1 1 A 152 152 ALA H H 152 8.010 8.430 -0.420 1 1 1530 . 9 1 1 A 152 152 ALA HA H 152 4.310 4.374 -0.064 1 1 1534 . 9 1 1 A 152 152 ALA C C 152 177.500 176.820 0.680 1 1 1535 . 9 1 1 A 152 152 ALA CA C 152 53.680 51.932 1.748 1 1 1536 . 9 1 1 A 152 152 ALA CB C 152 20.050 19.791 0.259 1 1 1537 . 9 1 1 A 152 152 ALA N N 152 126.640 124.445 2.195 1 1 1538 . 9 1 1 A 153 153 GLY H H 153 8.340 8.344 -0.004 1 1 1539 . 9 1 1 A 153 153 GLY HA2 H 153 4.050 4.315 -0.265 1 1 1540 . 9 1 1 A 153 153 GLY HA3 H 153 4.140 4.316 -0.176 1 1 1541 . 9 1 1 A 153 153 GLY C C 153 173.140 171.930 1.210 1 1 1542 . 9 1 1 A 153 153 GLY CA C 153 44.130 45.776 -1.646 1 1 1543 . 9 1 1 A 153 153 GLY N N 153 107.490 105.453 2.037 1 1 1544 . 9 1 1 A 154 154 THR H H 154 7.380 8.397 -1.017 1 1 1545 . 9 1 1 A 154 154 THR HA H 154 4.700 5.026 -0.326 1 1 1550 . 9 1 1 A 154 154 THR C C 154 171.120 173.798 -2.678 1 1 1551 . 9 1 1 A 154 154 THR CA C 154 60.830 61.021 -0.191 1 1 1552 . 9 1 1 A 154 154 THR CB C 154 68.850 72.256 -3.406 1 1 1554 . 9 1 1 A 154 154 THR N N 154 109.340 114.028 -4.688 1 1 1555 . 9 1 1 A 155 155 GLU H H 155 8.020 8.669 -0.649 1 1 1556 . 9 1 1 A 155 155 GLU HA H 155 5.370 5.317 0.053 1 1 1561 . 9 1 1 A 155 155 GLU C C 155 174.240 174.485 -0.245 1 1 1562 . 9 1 1 A 155 155 GLU CA C 155 54.830 54.894 -0.064 1 1 1563 . 9 1 1 A 155 155 GLU CB C 155 33.620 32.474 1.146 1 1 1565 . 9 1 1 A 155 155 GLU N N 155 118.690 122.731 -4.041 1 1 1566 . 9 1 1 A 156 156 LYS H H 156 9.230 9.106 0.124 1 1 1567 . 9 1 1 A 156 156 LYS HA H 156 4.650 5.144 -0.494 1 1 1576 . 9 1 1 A 156 156 LYS C C 156 174.000 174.373 -0.373 1 1 1577 . 9 1 1 A 156 156 LYS CA C 156 55.840 54.885 0.955 1 1 1578 . 9 1 1 A 156 156 LYS CB C 156 37.550 36.580 0.970 1 1 1582 . 9 1 1 A 156 156 LYS N N 156 121.940 120.962 0.978 1 1 1583 . 9 1 1 A 157 157 THR H H 157 8.160 8.734 -0.574 1 1 1584 . 9 1 1 A 157 157 THR HA H 157 5.440 5.126 0.314 1 1 1589 . 9 1 1 A 157 157 THR C C 157 174.360 173.561 0.799 1 1 1590 . 9 1 1 A 157 157 THR CA C 157 60.410 60.702 -0.292 1 1 1591 . 9 1 1 A 157 157 THR CB C 157 71.500 71.153 0.347 1 1 1593 . 9 1 1 A 157 157 THR N N 157 113.240 112.923 0.317 1 1 1594 . 9 1 1 A 158 158 VAL H H 158 9.120 9.051 0.069 1 1 1595 . 9 1 1 A 158 158 VAL HA H 158 4.580 5.020 -0.440 1 1 1603 . 9 1 1 A 158 158 VAL C C 158 172.800 174.855 -2.055 1 1 1604 . 9 1 1 A 158 158 VAL CA C 158 59.980 59.724 0.256 1 1 1605 . 9 1 1 A 158 158 VAL CB C 158 36.290 34.356 1.934 1 1 1608 . 9 1 1 A 158 158 VAL N N 158 121.710 122.385 -0.675 1 1 1609 . 9 1 1 A 159 159 ASN H H 159 8.240 8.867 -0.627 1 1 1610 . 9 1 1 A 159 159 ASN HA H 159 5.420 5.041 0.379 1 1 1615 . 9 1 1 A 159 159 ASN C C 159 173.800 174.112 -0.312 1 1 1616 . 9 1 1 A 159 159 ASN CA C 159 51.740 52.412 -0.672 1 1 1617 . 9 1 1 A 159 159 ASN CB C 159 40.380 39.195 1.185 1 1 1618 . 9 1 1 A 159 159 ASN N N 159 122.730 123.597 -0.867 1 1 1620 . 9 1 1 A 160 160 ILE H H 160 9.160 8.761 0.399 1 1 1621 . 9 1 1 A 160 160 ILE HA H 160 5.130 4.945 0.185 1 1 1631 . 9 1 1 A 160 160 ILE C C 160 177.320 175.679 1.641 1 1 1632 . 9 1 1 A 160 160 ILE CA C 160 60.640 60.735 -0.095 1 1 1633 . 9 1 1 A 160 160 ILE CB C 160 38.520 37.570 0.950 1 1 1637 . 9 1 1 A 160 160 ILE N N 160 123.690 125.860 -2.170 1 1 1638 . 9 1 1 A 161 161 ILE H H 161 8.780 8.918 -0.138 1 1 1639 . 9 1 1 A 161 161 ILE HA H 161 4.590 4.595 -0.005 1 1 1649 . 9 1 1 A 161 161 ILE C C 161 174.960 175.953 -0.993 1 1 1650 . 9 1 1 A 161 161 ILE CA C 161 59.320 60.567 -1.247 1 1 1651 . 9 1 1 A 161 161 ILE CB C 161 41.030 39.855 1.175 1 1 1655 . 9 1 1 A 161 161 ILE N N 161 122.490 128.863 -6.373 1 1 1656 . 9 1 1 A 162 162 GLU H H 162 8.620 8.408 0.212 1 1 1657 . 9 1 1 A 162 162 GLU HA H 162 4.290 4.360 -0.070 1 1 1662 . 9 1 1 A 162 162 GLU C C 162 176.660 176.402 0.258 1 1 1663 . 9 1 1 A 162 162 GLU CA C 162 56.470 57.153 -0.683 1 1 1664 . 9 1 1 A 162 162 GLU CB C 162 31.150 30.446 0.704 1 1 1666 . 9 1 1 A 162 162 GLU N N 162 120.520 126.046 -5.526 1 1 1667 . 9 1 1 A 163 163 GLY H H 163 8.480 8.315 0.165 1 1 1668 . 9 1 1 A 163 163 GLY HA2 H 163 3.910 4.190 -0.280 1 1 1669 . 9 1 1 A 163 163 GLY HA3 H 163 4.150 4.192 -0.042 1 1 1670 . 9 1 1 A 163 163 GLY C C 163 174.000 172.901 1.099 1 1 1671 . 9 1 1 A 163 163 GLY CA C 163 45.270 44.542 0.728 1 1 1672 . 9 1 1 A 163 163 GLY N N 163 110.210 108.959 1.251 1 1 1673 . 9 1 1 A 164 164 THR H H 164 8.170 8.192 -0.022 1 1 1674 . 9 1 1 A 164 164 THR HA H 164 4.410 4.244 0.166 1 1 1679 . 9 1 1 A 164 164 THR C C 164 174.100 175.103 -1.003 1 1 1680 . 9 1 1 A 164 164 THR CA C 164 61.620 62.329 -0.709 1 1 1681 . 9 1 1 A 164 164 THR CB C 164 70.060 69.576 0.484 1 1 1683 . 9 1 1 A 164 164 THR N N 164 113.480 115.991 -2.511 1 1 1 . 10 1 1 A 13 13 GLY H H 13 8.350 8.623 -0.273 1 1 2 . 10 1 1 A 13 13 GLY HA2 H 13 3.920 4.083 -0.163 1 1 3 . 10 1 1 A 13 13 GLY HA3 H 13 3.920 4.085 -0.165 1 1 4 . 10 1 1 A 13 13 GLY CA C 13 45.290 45.614 -0.324 1 1 5 . 10 1 1 A 13 13 GLY N N 13 110.450 108.088 2.362 1 1 6 . 10 1 1 A 14 14 LEU H H 14 8.050 8.390 -0.340 1 1 7 . 10 1 1 A 14 14 LEU N N 14 121.500 121.870 -0.370 1 1 8 . 10 1 1 A 15 15 VAL H H 15 8.070 8.084 -0.014 1 1 9 . 10 1 1 A 15 15 VAL N N 15 122.390 120.801 1.589 1 1 10 . 10 1 1 A 16 16 PRO HA H 16 4.360 4.377 -0.017 1 1 17 . 10 1 1 A 16 16 PRO CA C 16 62.770 63.727 -0.957 1 1 18 . 10 1 1 A 16 16 PRO CB C 16 32.020 31.908 0.112 1 1 21 . 10 1 1 A 21 21 MET H H 21 8.180 8.092 0.088 1 1 22 . 10 1 1 A 21 21 MET N N 21 121.310 117.709 3.601 1 1 23 . 10 1 1 A 22 22 ALA H H 22 8.290 8.290 0.000 1 1 24 . 10 1 1 A 22 22 ALA N N 22 124.800 124.046 0.754 1 1 25 . 10 1 1 A 23 23 SER H H 23 8.210 8.876 -0.666 1 1 26 . 10 1 1 A 23 23 SER N N 23 114.830 112.476 2.354 1 1 27 . 10 1 1 A 24 24 LYS H H 24 8.250 7.741 0.509 1 1 28 . 10 1 1 A 24 24 LYS N N 24 122.980 119.898 3.082 1 1 29 . 10 1 1 A 25 25 LEU H H 25 8.140 9.083 -0.943 1 1 30 . 10 1 1 A 25 25 LEU HA H 25 4.290 4.503 -0.213 1 1 40 . 10 1 1 A 25 25 LEU C C 25 177.410 177.352 0.058 1 1 41 . 10 1 1 A 25 25 LEU CA C 25 55.430 56.312 -0.882 1 1 42 . 10 1 1 A 25 25 LEU CB C 25 42.350 44.603 -2.253 1 1 46 . 10 1 1 A 25 25 LEU N N 25 122.580 124.661 -2.081 1 1 47 . 10 1 1 A 26 26 LYS H H 26 8.200 7.778 0.422 1 1 48 . 10 1 1 A 26 26 LYS HA H 26 4.260 4.459 -0.199 1 1 57 . 10 1 1 A 26 26 LYS C C 26 176.520 176.435 0.085 1 1 58 . 10 1 1 A 26 26 LYS CA C 26 56.700 57.046 -0.346 1 1 59 . 10 1 1 A 26 26 LYS CB C 26 33.060 34.298 -1.238 1 1 63 . 10 1 1 A 26 26 LYS N N 26 121.800 113.675 8.125 1 1 64 . 10 1 1 A 27 27 GLU H H 27 8.380 8.111 0.269 1 1 65 . 10 1 1 A 27 27 GLU HA H 27 4.240 4.424 -0.184 1 1 70 . 10 1 1 A 27 27 GLU C C 27 176.130 175.166 0.964 1 1 71 . 10 1 1 A 27 27 GLU CA C 27 56.700 56.400 0.300 1 1 72 . 10 1 1 A 27 27 GLU CB C 27 30.370 31.410 -1.040 1 1 74 . 10 1 1 A 27 27 GLU N N 27 121.700 119.956 1.744 1 1 75 . 10 1 1 A 28 28 ALA H H 28 8.230 8.569 -0.339 1 1 76 . 10 1 1 A 28 28 ALA HA H 28 4.280 5.154 -0.874 1 1 80 . 10 1 1 A 28 28 ALA C C 28 177.090 175.750 1.340 1 1 81 . 10 1 1 A 28 28 ALA CA C 28 52.530 51.021 1.509 1 1 82 . 10 1 1 A 28 28 ALA CB C 28 19.360 23.711 -4.351 1 1 83 . 10 1 1 A 28 28 ALA N N 28 124.640 120.942 3.698 1 1 84 . 10 1 1 A 29 29 ALA H H 29 8.150 8.405 -0.255 1 1 85 . 10 1 1 A 29 29 ALA HA H 29 4.320 4.915 -0.595 1 1 89 . 10 1 1 A 29 29 ALA C C 29 177.120 175.704 1.416 1 1 90 . 10 1 1 A 29 29 ALA CA C 29 52.040 51.962 0.078 1 1 91 . 10 1 1 A 29 29 ALA CB C 29 19.430 18.875 0.555 1 1 92 . 10 1 1 A 29 29 ALA N N 29 123.430 121.429 2.001 1 1 93 . 10 1 1 A 30 30 GLU H H 30 8.310 8.810 -0.500 1 1 94 . 10 1 1 A 30 30 GLU HA H 30 4.220 4.835 -0.615 1 1 99 . 10 1 1 A 30 30 GLU C C 30 176.310 176.324 -0.014 1 1 100 . 10 1 1 A 30 30 GLU CA C 30 56.630 55.659 0.971 1 1 101 . 10 1 1 A 30 30 GLU CB C 30 30.320 31.013 -0.693 1 1 103 . 10 1 1 A 30 30 GLU N N 30 120.630 122.298 -1.668 1 1 104 . 10 1 1 A 31 31 VAL H H 31 8.630 8.896 -0.266 1 1 105 . 10 1 1 A 31 31 VAL HA H 31 4.430 4.733 -0.303 1 1 113 . 10 1 1 A 31 31 VAL C C 31 176.510 176.420 0.090 1 1 114 . 10 1 1 A 31 31 VAL CA C 31 62.360 63.022 -0.662 1 1 115 . 10 1 1 A 31 31 VAL CB C 31 32.370 31.845 0.525 1 1 118 . 10 1 1 A 31 31 VAL N N 31 127.110 124.773 2.337 1 1 119 . 10 1 1 A 32 32 THR H H 32 7.640 8.693 -1.053 1 1 120 . 10 1 1 A 32 32 THR HA H 32 4.870 3.961 0.909 1 1 125 . 10 1 1 A 32 32 THR C C 32 172.220 174.787 -2.567 1 1 126 . 10 1 1 A 32 32 THR CA C 32 59.510 65.121 -5.611 1 1 127 . 10 1 1 A 32 32 THR CB C 32 71.630 69.812 1.818 1 1 129 . 10 1 1 A 32 32 THR N N 32 118.860 121.211 -2.351 1 1 130 . 10 1 1 A 33 33 GLY H H 33 8.350 8.009 0.341 1 1 131 . 10 1 1 A 33 33 GLY HA2 H 33 4.160 4.019 0.141 1 1 132 . 10 1 1 A 33 33 GLY HA3 H 33 4.250 4.020 0.230 1 1 133 . 10 1 1 A 33 33 GLY C C 33 172.820 173.012 -0.192 1 1 134 . 10 1 1 A 33 33 GLY CA C 33 46.680 45.113 1.567 1 1 135 . 10 1 1 A 33 33 GLY N N 33 106.720 108.633 -1.913 1 1 136 . 10 1 1 A 34 34 SER H H 34 8.810 8.092 0.718 1 1 137 . 10 1 1 A 34 34 SER HA H 34 5.390 4.941 0.449 1 1 140 . 10 1 1 A 34 34 SER C C 34 173.780 172.847 0.933 1 1 141 . 10 1 1 A 34 34 SER CA C 34 57.380 57.493 -0.113 1 1 142 . 10 1 1 A 34 34 SER CB C 34 65.730 65.945 -0.215 1 1 143 . 10 1 1 A 34 34 SER N N 34 112.690 119.919 -7.229 1 1 144 . 10 1 1 A 35 35 VAL H H 35 8.470 8.770 -0.300 1 1 145 . 10 1 1 A 35 35 VAL HA H 35 4.120 4.977 -0.857 1 1 153 . 10 1 1 A 35 35 VAL C C 35 174.750 174.200 0.550 1 1 154 . 10 1 1 A 35 35 VAL CA C 35 62.310 60.163 2.147 1 1 155 . 10 1 1 A 35 35 VAL CB C 35 34.550 33.434 1.116 1 1 158 . 10 1 1 A 35 35 VAL N N 35 123.150 121.857 1.293 1 1 159 . 10 1 1 A 36 36 SER H H 36 8.240 8.774 -0.534 1 1 160 . 10 1 1 A 36 36 SER HA H 36 4.690 4.910 -0.220 1 1 163 . 10 1 1 A 36 36 SER C C 36 171.860 172.956 -1.096 1 1 164 . 10 1 1 A 36 36 SER CA C 36 56.020 56.605 -0.585 1 1 165 . 10 1 1 A 36 36 SER CB C 36 66.050 64.480 1.570 1 1 166 . 10 1 1 A 36 36 SER N N 36 118.760 119.833 -1.073 1 1 167 . 10 1 1 A 37 37 LEU H H 37 8.310 8.992 -0.682 1 1 168 . 10 1 1 A 37 37 LEU HA H 37 4.870 4.996 -0.126 1 1 178 . 10 1 1 A 37 37 LEU C C 37 174.190 175.753 -1.563 1 1 179 . 10 1 1 A 37 37 LEU CA C 37 53.870 53.539 0.331 1 1 180 . 10 1 1 A 37 37 LEU CB C 37 47.000 43.496 3.504 1 1 184 . 10 1 1 A 37 37 LEU N N 37 124.790 127.976 -3.186 1 1 185 . 10 1 1 A 38 38 GLU H H 38 9.270 8.794 0.476 1 1 186 . 10 1 1 A 38 38 GLU HA H 38 4.650 4.986 -0.336 1 1 191 . 10 1 1 A 38 38 GLU C C 38 173.970 174.589 -0.619 1 1 192 . 10 1 1 A 38 38 GLU CA C 38 54.410 55.195 -0.785 1 1 193 . 10 1 1 A 38 38 GLU CB C 38 32.460 31.330 1.130 1 1 195 . 10 1 1 A 38 38 GLU N N 38 126.550 124.298 2.252 1 1 196 . 10 1 1 A 39 39 ALA H H 39 8.120 8.517 -0.397 1 1 197 . 10 1 1 A 39 39 ALA HA H 39 4.600 4.744 -0.144 1 1 201 . 10 1 1 A 39 39 ALA C C 39 175.930 177.233 -1.303 1 1 202 . 10 1 1 A 39 39 ALA CA C 39 51.570 50.673 0.897 1 1 203 . 10 1 1 A 39 39 ALA CB C 39 21.780 22.761 -0.981 1 1 204 . 10 1 1 A 39 39 ALA N N 39 124.410 127.829 -3.419 1 1 205 . 10 1 1 A 40 40 LEU H H 40 7.860 9.098 -1.238 1 1 206 . 10 1 1 A 40 40 LEU HA H 40 4.230 3.981 0.249 1 1 216 . 10 1 1 A 40 40 LEU C C 40 175.940 176.651 -0.711 1 1 217 . 10 1 1 A 40 40 LEU CA C 40 55.360 57.316 -1.956 1 1 218 . 10 1 1 A 40 40 LEU CB C 40 42.990 42.230 0.760 1 1 222 . 10 1 1 A 40 40 LEU N N 40 120.640 122.340 -1.700 1 1 223 . 10 1 1 A 41 41 GLU H H 41 8.210 7.879 0.331 1 1 224 . 10 1 1 A 41 41 GLU HA H 41 4.240 4.009 0.231 1 1 229 . 10 1 1 A 41 41 GLU C C 41 176.920 174.811 2.109 1 1 230 . 10 1 1 A 41 41 GLU CA C 41 58.090 57.644 0.446 1 1 231 . 10 1 1 A 41 41 GLU CB C 41 30.530 27.113 3.417 1 1 233 . 10 1 1 A 41 41 GLU N N 41 114.680 116.707 -2.027 1 1 234 . 10 1 1 A 42 42 GLU H H 42 7.490 7.753 -0.263 1 1 235 . 10 1 1 A 42 42 GLU HA H 42 5.680 4.806 0.874 1 1 240 . 10 1 1 A 42 42 GLU C C 42 173.790 174.177 -0.387 1 1 241 . 10 1 1 A 42 42 GLU CA C 42 54.360 56.145 -1.785 1 1 242 . 10 1 1 A 42 42 GLU CB C 42 33.850 33.173 0.677 1 1 244 . 10 1 1 A 42 42 GLU N N 42 116.670 118.236 -1.566 1 1 245 . 10 1 1 A 43 43 VAL H H 43 8.550 8.417 0.133 1 1 246 . 10 1 1 A 43 43 VAL HA H 43 4.550 4.714 -0.164 1 1 254 . 10 1 1 A 43 43 VAL C C 43 172.220 173.678 -1.458 1 1 255 . 10 1 1 A 43 43 VAL CA C 43 59.470 60.502 -1.032 1 1 256 . 10 1 1 A 43 43 VAL CB C 43 35.470 34.571 0.899 1 1 259 . 10 1 1 A 43 43 VAL N N 43 120.030 125.229 -5.199 1 1 260 . 10 1 1 A 44 44 GLN H H 44 8.470 8.617 -0.147 1 1 261 . 10 1 1 A 44 44 GLN HA H 44 4.890 4.431 0.459 1 1 268 . 10 1 1 A 44 44 GLN C C 44 176.130 176.023 0.107 1 1 269 . 10 1 1 A 44 44 GLN CA C 44 54.360 55.706 -1.346 1 1 270 . 10 1 1 A 44 44 GLN CB C 44 30.610 28.942 1.668 1 1 272 . 10 1 1 A 44 44 GLN N N 44 124.690 130.177 -5.487 1 1 274 . 10 1 1 A 45 45 VAL H H 45 8.130 8.368 -0.238 1 1 275 . 10 1 1 A 45 45 VAL HA H 45 3.030 3.941 -0.911 1 1 283 . 10 1 1 A 45 45 VAL C C 45 176.710 177.197 -0.487 1 1 284 . 10 1 1 A 45 45 VAL CA C 45 65.810 64.722 1.088 1 1 285 . 10 1 1 A 45 45 VAL CB C 45 31.960 31.450 0.510 1 1 288 . 10 1 1 A 45 45 VAL N N 45 120.450 126.482 -6.032 1 1 289 . 10 1 1 A 46 46 GLY H H 46 8.950 9.972 -1.022 1 1 290 . 10 1 1 A 46 46 GLY HA2 H 46 3.590 4.013 -0.423 1 1 291 . 10 1 1 A 46 46 GLY HA3 H 46 4.410 4.014 0.396 1 1 292 . 10 1 1 A 46 46 GLY C C 46 174.390 173.755 0.635 1 1 293 . 10 1 1 A 46 46 GLY CA C 46 44.730 44.955 -0.225 1 1 294 . 10 1 1 A 46 46 GLY N N 46 116.490 115.182 1.308 1 1 295 . 10 1 1 A 47 47 GLU H H 47 8.260 7.802 0.458 1 1 296 . 10 1 1 A 47 47 GLU HA H 47 4.460 4.706 -0.246 1 1 301 . 10 1 1 A 47 47 GLU C C 47 174.780 174.953 -0.173 1 1 302 . 10 1 1 A 47 47 GLU CA C 47 54.830 54.983 -0.153 1 1 303 . 10 1 1 A 47 47 GLU CB C 47 31.140 32.174 -1.034 1 1 305 . 10 1 1 A 47 47 GLU N N 47 120.520 121.499 -0.979 1 1 306 . 10 1 1 A 48 48 ASN H H 48 8.440 8.710 -0.270 1 1 307 . 10 1 1 A 48 48 ASN HA H 48 5.380 5.519 -0.139 1 1 312 . 10 1 1 A 48 48 ASN C C 48 174.770 174.959 -0.189 1 1 313 . 10 1 1 A 48 48 ASN CA C 48 51.570 51.976 -0.406 1 1 314 . 10 1 1 A 48 48 ASN CB C 48 39.010 41.739 -2.729 1 1 315 . 10 1 1 A 48 48 ASN N N 48 117.180 119.879 -2.699 1 1 317 . 10 1 1 A 49 49 LEU H H 49 9.810 8.340 1.470 1 1 318 . 10 1 1 A 49 49 LEU HA H 49 4.510 5.334 -0.824 1 1 328 . 10 1 1 A 49 49 LEU C C 49 174.560 175.583 -1.023 1 1 329 . 10 1 1 A 49 49 LEU CA C 49 53.460 52.504 0.956 1 1 330 . 10 1 1 A 49 49 LEU CB C 49 45.520 46.116 -0.596 1 1 333 . 10 1 1 A 49 49 LEU N N 49 125.620 116.564 9.056 1 1 334 . 10 1 1 A 50 50 GLU H H 50 8.750 8.777 -0.027 1 1 335 . 10 1 1 A 50 50 GLU HA H 50 4.360 5.066 -0.706 1 1 340 . 10 1 1 A 50 50 GLU C C 50 175.340 175.486 -0.146 1 1 341 . 10 1 1 A 50 50 GLU CA C 50 55.550 54.954 0.596 1 1 342 . 10 1 1 A 50 50 GLU CB C 50 29.890 31.921 -2.031 1 1 344 . 10 1 1 A 50 50 GLU N N 50 125.420 118.895 6.525 1 1 345 . 10 1 1 A 51 51 VAL H H 51 9.230 9.090 0.140 1 1 346 . 10 1 1 A 51 51 VAL HA H 51 4.190 4.412 -0.222 1 1 354 . 10 1 1 A 51 51 VAL C C 51 175.310 175.458 -0.148 1 1 355 . 10 1 1 A 51 51 VAL CA C 51 62.520 61.175 1.345 1 1 356 . 10 1 1 A 51 51 VAL CB C 51 31.470 31.732 -0.262 1 1 359 . 10 1 1 A 51 51 VAL N N 51 129.810 125.330 4.480 1 1 360 . 10 1 1 A 52 52 GLY H H 52 9.410 8.798 0.612 1 1 361 . 10 1 1 A 52 52 GLY HA2 H 52 3.460 3.893 -0.433 1 1 362 . 10 1 1 A 52 52 GLY HA3 H 52 4.680 3.926 0.754 1 1 363 . 10 1 1 A 52 52 GLY C C 52 173.000 173.231 -0.231 1 1 364 . 10 1 1 A 52 52 GLY CA C 52 46.470 47.450 -0.980 1 1 365 . 10 1 1 A 52 52 GLY N N 52 116.600 114.701 1.899 1 1 366 . 10 1 1 A 53 53 VAL H H 53 9.130 8.733 0.397 1 1 367 . 10 1 1 A 53 53 VAL HA H 53 4.840 4.762 0.078 1 1 375 . 10 1 1 A 53 53 VAL C C 53 175.470 175.194 0.276 1 1 376 . 10 1 1 A 53 53 VAL CA C 53 61.350 61.540 -0.190 1 1 377 . 10 1 1 A 53 53 VAL CB C 53 34.300 31.517 2.783 1 1 380 . 10 1 1 A 53 53 VAL N N 53 129.050 123.066 5.984 1 1 381 . 10 1 1 A 54 54 GLY H H 54 8.420 8.708 -0.288 1 1 382 . 10 1 1 A 54 54 GLY HA2 H 54 3.850 3.786 0.064 1 1 383 . 10 1 1 A 54 54 GLY HA3 H 54 3.850 3.900 -0.050 1 1 384 . 10 1 1 A 54 54 GLY C C 54 173.310 172.995 0.315 1 1 385 . 10 1 1 A 54 54 GLY CA C 54 45.180 44.282 0.898 1 1 386 . 10 1 1 A 54 54 GLY N N 54 116.890 115.247 1.643 1 1 387 . 10 1 1 A 55 55 ILE H H 55 10.190 8.203 1.987 1 1 388 . 10 1 1 A 55 55 ILE HA H 55 4.010 4.784 -0.774 1 1 398 . 10 1 1 A 55 55 ILE C C 55 174.380 175.348 -0.968 1 1 399 . 10 1 1 A 55 55 ILE CA C 55 61.350 59.807 1.543 1 1 400 . 10 1 1 A 55 55 ILE CB C 55 40.840 40.310 0.530 1 1 404 . 10 1 1 A 55 55 ILE N N 55 129.330 121.755 7.575 1 1 405 . 10 1 1 A 56 56 ASP H H 56 8.810 9.824 -1.014 1 1 406 . 10 1 1 A 56 56 ASP HA H 56 4.440 4.696 -0.256 1 1 409 . 10 1 1 A 56 56 ASP C C 56 175.530 175.499 0.031 1 1 410 . 10 1 1 A 56 56 ASP CA C 56 56.460 55.210 1.250 1 1 411 . 10 1 1 A 56 56 ASP CB C 56 42.720 42.934 -0.214 1 1 412 . 10 1 1 A 56 56 ASP N N 56 128.310 127.583 0.727 1 1 413 . 10 1 1 A 57 57 GLU H H 57 7.270 7.954 -0.684 1 1 414 . 10 1 1 A 57 57 GLU HA H 57 4.290 4.799 -0.509 1 1 419 . 10 1 1 A 57 57 GLU C C 57 173.370 174.669 -1.299 1 1 420 . 10 1 1 A 57 57 GLU CA C 57 54.840 55.435 -0.595 1 1 421 . 10 1 1 A 57 57 GLU CB C 57 33.190 33.530 -0.340 1 1 423 . 10 1 1 A 57 57 GLU N N 57 112.810 116.149 -3.339 1 1 424 . 10 1 1 A 58 58 LEU H H 58 8.370 8.451 -0.081 1 1 425 . 10 1 1 A 58 58 LEU HA H 58 4.830 4.688 0.142 1 1 434 . 10 1 1 A 58 58 LEU C C 58 174.180 174.724 -0.544 1 1 435 . 10 1 1 A 58 58 LEU CA C 58 55.320 54.875 0.445 1 1 436 . 10 1 1 A 58 58 LEU CB C 58 44.300 43.042 1.258 1 1 439 . 10 1 1 A 58 58 LEU N N 58 123.130 125.171 -2.041 1 1 440 . 10 1 1 A 59 59 VAL H H 59 9.120 8.826 0.294 1 1 441 . 10 1 1 A 59 59 VAL HA H 59 4.240 4.622 -0.382 1 1 449 . 10 1 1 A 59 59 VAL C C 59 174.960 175.433 -0.473 1 1 450 . 10 1 1 A 59 59 VAL CA C 59 61.760 59.730 2.030 1 1 451 . 10 1 1 A 59 59 VAL CB C 59 33.760 33.880 -0.120 1 1 454 . 10 1 1 A 59 59 VAL N N 59 127.930 125.443 2.487 1 1 455 . 10 1 1 A 60 60 ASN H H 60 8.770 8.503 0.267 1 1 456 . 10 1 1 A 60 60 ASN HA H 60 4.250 4.753 -0.503 1 1 461 . 10 1 1 A 60 60 ASN C C 60 172.810 173.786 -0.976 1 1 462 . 10 1 1 A 60 60 ASN CA C 60 54.830 54.758 0.072 1 1 463 . 10 1 1 A 60 60 ASN CB C 60 36.030 36.627 -0.597 1 1 464 . 10 1 1 A 60 60 ASN N N 60 115.500 122.340 -6.840 1 1 466 . 10 1 1 A 61 61 ALA H H 61 7.330 7.348 -0.018 1 1 467 . 10 1 1 A 61 61 ALA HA H 61 4.520 4.634 -0.114 1 1 471 . 10 1 1 A 61 61 ALA C C 61 174.580 174.919 -0.339 1 1 472 . 10 1 1 A 61 61 ALA CA C 61 51.560 50.926 0.634 1 1 473 . 10 1 1 A 61 61 ALA CB C 61 22.870 22.978 -0.108 1 1 474 . 10 1 1 A 61 61 ALA N N 61 115.640 119.067 -3.427 1 1 475 . 10 1 1 A 62 62 GLU H H 62 7.900 9.010 -1.110 1 1 476 . 10 1 1 A 62 62 GLU HA H 62 4.310 4.823 -0.513 1 1 481 . 10 1 1 A 62 62 GLU C C 62 173.790 175.389 -1.599 1 1 482 . 10 1 1 A 62 62 GLU CA C 62 55.080 55.037 0.043 1 1 483 . 10 1 1 A 62 62 GLU CB C 62 32.610 30.701 1.909 1 1 485 . 10 1 1 A 62 62 GLU N N 62 117.400 117.511 -0.111 1 1 486 . 10 1 1 A 63 63 ALA H H 63 8.910 8.546 0.364 1 1 487 . 10 1 1 A 63 63 ALA HA H 63 4.690 4.521 0.169 1 1 491 . 10 1 1 A 63 63 ALA C C 63 175.720 176.602 -0.882 1 1 492 . 10 1 1 A 63 63 ALA CA C 63 50.600 53.142 -2.542 1 1 493 . 10 1 1 A 63 63 ALA CB C 63 20.660 18.886 1.774 1 1 494 . 10 1 1 A 63 63 ALA N N 63 122.480 127.764 -5.284 1 1 495 . 10 1 1 A 64 64 PHE H H 64 9.220 9.089 0.131 1 1 496 . 10 1 1 A 64 64 PHE HA H 64 4.320 4.716 -0.396 1 1 501 . 10 1 1 A 64 64 PHE C C 64 174.380 175.425 -1.045 1 1 502 . 10 1 1 A 64 64 PHE CA C 64 59.770 59.224 0.546 1 1 503 . 10 1 1 A 64 64 PHE CB C 64 40.830 40.792 0.038 1 1 504 . 10 1 1 A 64 64 PHE N N 64 120.870 123.180 -2.310 1 1 505 . 10 1 1 A 65 65 ALA H H 65 8.150 8.106 0.044 1 1 506 . 10 1 1 A 65 65 ALA HA H 65 5.280 4.732 0.548 1 1 510 . 10 1 1 A 65 65 ALA C C 65 175.950 175.808 0.142 1 1 511 . 10 1 1 A 65 65 ALA CA C 65 51.120 50.477 0.643 1 1 512 . 10 1 1 A 65 65 ALA CB C 65 22.850 20.531 2.319 1 1 513 . 10 1 1 A 65 65 ALA N N 65 122.350 119.591 2.759 1 1 514 . 10 1 1 A 66 66 TYR H H 66 9.260 9.248 0.012 1 1 515 . 10 1 1 A 66 66 TYR HA H 66 5.710 4.956 0.754 1 1 520 . 10 1 1 A 66 66 TYR C C 66 175.690 174.717 0.973 1 1 521 . 10 1 1 A 66 66 TYR CA C 66 54.390 58.626 -4.236 1 1 522 . 10 1 1 A 66 66 TYR CB C 66 41.560 39.947 1.613 1 1 523 . 10 1 1 A 66 66 TYR N N 66 124.350 127.004 -2.654 1 1 524 . 10 1 1 A 67 67 ASP H H 67 9.070 8.627 0.443 1 1 525 . 10 1 1 A 67 67 ASP HA H 67 5.630 5.474 0.156 1 1 528 . 10 1 1 A 67 67 ASP C C 67 174.300 174.471 -0.171 1 1 529 . 10 1 1 A 67 67 ASP CA C 67 51.590 53.264 -1.674 1 1 530 . 10 1 1 A 67 67 ASP CB C 67 44.380 43.601 0.779 1 1 531 . 10 1 1 A 67 67 ASP N N 67 130.490 125.807 4.683 1 1 532 . 10 1 1 A 68 68 PHE H H 68 8.670 8.476 0.194 1 1 533 . 10 1 1 A 68 68 PHE HA H 68 4.890 5.294 -0.404 1 1 538 . 10 1 1 A 68 68 PHE C C 68 172.220 172.847 -0.627 1 1 539 . 10 1 1 A 68 68 PHE CA C 68 57.360 55.462 1.898 1 1 540 . 10 1 1 A 68 68 PHE CB C 68 40.360 42.435 -2.075 1 1 541 . 10 1 1 A 68 68 PHE N N 68 118.200 119.729 -1.529 1 1 542 . 10 1 1 A 69 69 THR H H 69 8.390 8.727 -0.337 1 1 543 . 10 1 1 A 69 69 THR HA H 69 5.170 5.086 0.084 1 1 548 . 10 1 1 A 69 69 THR C C 69 172.620 173.532 -0.912 1 1 549 . 10 1 1 A 69 69 THR CA C 69 61.370 61.115 0.255 1 1 550 . 10 1 1 A 69 69 THR CB C 69 64.880 70.745 -5.865 1 1 552 . 10 1 1 A 69 69 THR N N 69 115.810 112.193 3.617 1 1 553 . 10 1 1 A 70 70 LEU H H 70 9.560 9.242 0.318 1 1 554 . 10 1 1 A 70 70 LEU HA H 70 5.270 4.483 0.787 1 1 564 . 10 1 1 A 70 70 LEU C C 70 173.800 176.435 -2.635 1 1 565 . 10 1 1 A 70 70 LEU CA C 70 53.460 55.073 -1.613 1 1 566 . 10 1 1 A 70 70 LEU CB C 70 45.040 42.727 2.313 1 1 570 . 10 1 1 A 70 70 LEU N N 70 129.220 127.890 1.330 1 1 571 . 10 1 1 A 71 71 ASN H H 71 9.590 8.657 0.933 1 1 572 . 10 1 1 A 71 71 ASN HA H 71 5.880 5.749 0.131 1 1 577 . 10 1 1 A 71 71 ASN C C 71 177.970 174.389 3.581 1 1 578 . 10 1 1 A 71 71 ASN CA C 71 52.060 52.317 -0.257 1 1 579 . 10 1 1 A 71 71 ASN CB C 71 41.020 40.226 0.794 1 1 580 . 10 1 1 A 71 71 ASN N N 71 125.970 118.602 7.368 1 1 582 . 10 1 1 A 72 72 TYR H H 72 8.740 9.173 -0.433 1 1 583 . 10 1 1 A 72 72 TYR HA H 72 5.110 5.376 -0.266 1 1 588 . 10 1 1 A 72 72 TYR C C 72 177.720 172.941 4.779 1 1 589 . 10 1 1 A 72 72 TYR CA C 72 55.310 55.343 -0.033 1 1 590 . 10 1 1 A 72 72 TYR CB C 72 41.510 41.222 0.288 1 1 591 . 10 1 1 A 72 72 TYR N N 72 119.640 121.360 -1.720 1 1 592 . 10 1 1 A 73 73 ASP H H 73 9.780 9.025 0.755 1 1 593 . 10 1 1 A 73 73 ASP HA H 73 4.680 5.130 -0.450 1 1 596 . 10 1 1 A 73 73 ASP C C 73 177.290 176.544 0.746 1 1 597 . 10 1 1 A 73 73 ASP CA C 73 53.650 52.799 0.851 1 1 598 . 10 1 1 A 73 73 ASP CB C 73 40.900 42.986 -2.086 1 1 599 . 10 1 1 A 73 73 ASP N N 73 119.290 121.077 -1.787 1 1 600 . 10 1 1 A 74 74 GLU H H 74 9.430 9.026 0.404 1 1 601 . 10 1 1 A 74 74 GLU HA H 74 4.740 4.670 0.070 1 1 606 . 10 1 1 A 74 74 GLU C C 74 176.320 178.384 -2.064 1 1 607 . 10 1 1 A 74 74 GLU CA C 74 57.410 58.921 -1.511 1 1 608 . 10 1 1 A 74 74 GLU CB C 74 29.490 29.408 0.082 1 1 610 . 10 1 1 A 74 74 GLU N N 74 130.930 126.217 4.713 1 1 611 . 10 1 1 A 75 75 ASN H H 75 8.680 8.226 0.454 1 1 612 . 10 1 1 A 75 75 ASN HA H 75 4.600 4.495 0.105 1 1 617 . 10 1 1 A 75 75 ASN C C 75 175.340 176.884 -1.544 1 1 618 . 10 1 1 A 75 75 ASN CA C 75 54.620 56.132 -1.512 1 1 619 . 10 1 1 A 75 75 ASN CB C 75 38.770 38.638 0.132 1 1 620 . 10 1 1 A 75 75 ASN N N 75 115.040 118.030 -2.990 1 1 622 . 10 1 1 A 76 76 ALA H H 76 7.740 7.862 -0.122 1 1 623 . 10 1 1 A 76 76 ALA HA H 76 4.310 4.477 -0.167 1 1 627 . 10 1 1 A 76 76 ALA C C 76 175.550 176.848 -1.298 1 1 628 . 10 1 1 A 76 76 ALA CA C 76 53.260 53.059 0.201 1 1 629 . 10 1 1 A 76 76 ALA CB C 76 21.450 21.274 0.176 1 1 630 . 10 1 1 A 76 76 ALA N N 76 122.200 119.818 2.382 1 1 631 . 10 1 1 A 77 77 PHE H H 77 8.070 7.853 0.217 1 1 632 . 10 1 1 A 77 77 PHE HA H 77 5.650 5.202 0.448 1 1 637 . 10 1 1 A 77 77 PHE C C 77 174.570 175.475 -0.905 1 1 638 . 10 1 1 A 77 77 PHE CA C 77 56.360 57.293 -0.933 1 1 639 . 10 1 1 A 77 77 PHE CB C 77 46.080 41.361 4.719 1 1 640 . 10 1 1 A 77 77 PHE N N 77 114.160 114.145 0.015 1 1 641 . 10 1 1 A 78 78 GLU H H 78 8.800 8.887 -0.087 1 1 642 . 10 1 1 A 78 78 GLU HA H 78 4.900 4.952 -0.052 1 1 647 . 10 1 1 A 78 78 GLU C C 78 175.950 174.687 1.263 1 1 648 . 10 1 1 A 78 78 GLU CA C 78 53.670 56.078 -2.408 1 1 649 . 10 1 1 A 78 78 GLU CB C 78 33.600 32.584 1.016 1 1 651 . 10 1 1 A 78 78 GLU N N 78 117.590 120.475 -2.885 1 1 652 . 10 1 1 A 79 79 TYR H H 79 8.770 8.922 -0.152 1 1 653 . 10 1 1 A 79 79 TYR HA H 79 4.250 4.164 0.086 1 1 658 . 10 1 1 A 79 79 TYR C C 79 174.580 174.962 -0.382 1 1 659 . 10 1 1 A 79 79 TYR CA C 79 59.250 59.462 -0.212 1 1 660 . 10 1 1 A 79 79 TYR CB C 79 38.310 39.170 -0.860 1 1 661 . 10 1 1 A 79 79 TYR N N 79 126.560 129.218 -2.658 1 1 662 . 10 1 1 A 80 80 VAL H H 80 8.220 7.933 0.287 1 1 663 . 10 1 1 A 80 80 VAL HA H 80 3.690 3.862 -0.172 1 1 671 . 10 1 1 A 80 80 VAL C C 80 174.780 175.422 -0.642 1 1 672 . 10 1 1 A 80 80 VAL CA C 80 64.400 62.736 1.664 1 1 673 . 10 1 1 A 80 80 VAL CB C 80 33.510 33.039 0.471 1 1 676 . 10 1 1 A 80 80 VAL N N 80 129.460 124.233 5.227 1 1 677 . 10 1 1 A 81 81 GLU H H 81 6.920 7.216 -0.296 1 1 678 . 10 1 1 A 81 81 GLU HA H 81 4.260 4.607 -0.347 1 1 683 . 10 1 1 A 81 81 GLU C C 81 171.840 174.576 -2.736 1 1 684 . 10 1 1 A 81 81 GLU CA C 81 55.310 54.654 0.656 1 1 685 . 10 1 1 A 81 81 GLU CB C 81 30.520 33.074 -2.554 1 1 687 . 10 1 1 A 81 81 GLU N N 81 112.430 114.469 -2.039 1 1 688 . 10 1 1 A 82 82 ALA H H 82 8.310 8.848 -0.538 1 1 689 . 10 1 1 A 82 82 ALA HA H 82 5.650 5.127 0.523 1 1 693 . 10 1 1 A 82 82 ALA C C 82 176.110 177.156 -1.046 1 1 694 . 10 1 1 A 82 82 ALA CA C 82 50.620 51.677 -1.057 1 1 695 . 10 1 1 A 82 82 ALA CB C 82 21.770 20.048 1.722 1 1 696 . 10 1 1 A 82 82 ALA N N 82 121.240 126.221 -4.981 1 1 697 . 10 1 1 A 83 83 ILE H H 83 9.150 9.493 -0.343 1 1 698 . 10 1 1 A 83 83 ILE HA H 83 4.600 5.012 -0.412 1 1 708 . 10 1 1 A 83 83 ILE C C 83 174.810 174.575 0.235 1 1 709 . 10 1 1 A 83 83 ILE CA C 83 60.060 58.941 1.119 1 1 710 . 10 1 1 A 83 83 ILE CB C 83 42.440 42.632 -0.192 1 1 714 . 10 1 1 A 83 83 ILE N N 83 119.720 118.900 0.820 1 1 715 . 10 1 1 A 84 84 SER H H 84 8.350 8.677 -0.327 1 1 716 . 10 1 1 A 84 84 SER HA H 84 4.660 4.802 -0.142 1 1 719 . 10 1 1 A 84 84 SER C C 84 177.550 172.172 5.378 1 1 720 . 10 1 1 A 84 84 SER CA C 84 57.330 55.779 1.551 1 1 721 . 10 1 1 A 84 84 SER CB C 84 66.490 65.328 1.162 1 1 722 . 10 1 1 A 84 84 SER N N 84 116.740 116.848 -0.108 1 1 723 . 10 1 1 A 85 85 ASP H H 85 8.740 8.813 -0.073 1 1 724 . 10 1 1 A 85 85 ASP HA H 85 4.820 4.671 0.149 1 1 727 . 10 1 1 A 85 85 ASP C C 85 176.090 175.927 0.163 1 1 728 . 10 1 1 A 85 85 ASP CA C 85 53.480 53.109 0.371 1 1 729 . 10 1 1 A 85 85 ASP CB C 85 42.480 42.462 0.018 1 1 730 . 10 1 1 A 85 85 ASP N N 85 120.960 122.208 -1.248 1 1 731 . 10 1 1 A 86 86 ASP H H 86 8.380 8.590 -0.210 1 1 732 . 10 1 1 A 86 86 ASP HA H 86 4.450 4.911 -0.461 1 1 735 . 10 1 1 A 86 86 ASP C C 86 177.100 176.968 0.132 1 1 736 . 10 1 1 A 86 86 ASP CA C 86 56.240 53.239 3.001 1 1 737 . 10 1 1 A 86 86 ASP CB C 86 41.100 41.381 -0.281 1 1 738 . 10 1 1 A 86 86 ASP N N 86 117.710 121.899 -4.189 1 1 739 . 10 1 1 A 87 87 GLY H H 87 8.690 7.599 1.091 1 1 740 . 10 1 1 A 87 87 GLY HA2 H 87 3.870 4.090 -0.220 1 1 741 . 10 1 1 A 87 87 GLY HA3 H 87 4.090 4.098 -0.008 1 1 742 . 10 1 1 A 87 87 GLY C C 87 173.800 174.186 -0.386 1 1 743 . 10 1 1 A 87 87 GLY CA C 87 45.770 45.617 0.153 1 1 744 . 10 1 1 A 87 87 GLY N N 87 108.540 107.610 0.930 1 1 745 . 10 1 1 A 88 88 VAL H H 88 7.910 7.574 0.336 1 1 746 . 10 1 1 A 88 88 VAL HA H 88 4.780 4.182 0.598 1 1 754 . 10 1 1 A 88 88 VAL C C 88 173.970 175.338 -1.368 1 1 755 . 10 1 1 A 88 88 VAL CA C 88 60.900 62.382 -1.482 1 1 756 . 10 1 1 A 88 88 VAL CB C 88 35.460 32.740 2.720 1 1 759 . 10 1 1 A 88 88 VAL N N 88 119.790 120.430 -0.640 1 1 760 . 10 1 1 A 89 89 PHE H H 89 9.210 9.368 -0.158 1 1 761 . 10 1 1 A 89 89 PHE HA H 89 4.930 5.314 -0.384 1 1 766 . 10 1 1 A 89 89 PHE C C 89 173.970 173.916 0.054 1 1 767 . 10 1 1 A 89 89 PHE CA C 89 56.450 55.882 0.568 1 1 768 . 10 1 1 A 89 89 PHE CB C 89 41.120 41.019 0.101 1 1 769 . 10 1 1 A 89 89 PHE N N 89 126.780 127.544 -0.764 1 1 770 . 10 1 1 A 90 90 VAL H H 90 7.880 8.924 -1.044 1 1 771 . 10 1 1 A 90 90 VAL HA H 90 4.860 5.088 -0.228 1 1 779 . 10 1 1 A 90 90 VAL C C 90 173.190 174.868 -1.678 1 1 780 . 10 1 1 A 90 90 VAL CA C 90 59.750 61.336 -1.586 1 1 781 . 10 1 1 A 90 90 VAL CB C 90 34.770 33.536 1.234 1 1 784 . 10 1 1 A 90 90 VAL N N 90 124.990 128.247 -3.257 1 1 785 . 10 1 1 A 91 91 ASN H H 91 8.670 9.163 -0.493 1 1 786 . 10 1 1 A 91 91 ASN HA H 91 4.730 5.307 -0.577 1 1 791 . 10 1 1 A 91 91 ASN C C 91 173.200 174.549 -1.349 1 1 792 . 10 1 1 A 91 91 ASN CA C 91 51.970 52.429 -0.459 1 1 793 . 10 1 1 A 91 91 ASN CB C 91 41.340 42.117 -0.777 1 1 794 . 10 1 1 A 91 91 ASN N N 91 124.860 125.719 -0.859 1 1 796 . 10 1 1 A 92 92 ALA H H 92 8.840 9.096 -0.256 1 1 797 . 10 1 1 A 92 92 ALA HA H 92 5.290 5.111 0.179 1 1 801 . 10 1 1 A 92 92 ALA C C 92 176.330 176.570 -0.240 1 1 802 . 10 1 1 A 92 92 ALA CA C 92 50.170 51.279 -1.109 1 1 803 . 10 1 1 A 92 92 ALA CB C 92 23.610 21.312 2.298 1 1 804 . 10 1 1 A 92 92 ALA N N 92 128.510 129.096 -0.586 1 1 805 . 10 1 1 A 93 93 LYS H H 93 8.670 8.748 -0.078 1 1 806 . 10 1 1 A 93 93 LYS HA H 93 4.460 4.760 -0.300 1 1 815 . 10 1 1 A 93 93 LYS C C 93 174.170 174.868 -0.698 1 1 816 . 10 1 1 A 93 93 LYS CA C 93 55.010 55.371 -0.361 1 1 817 . 10 1 1 A 93 93 LYS CB C 93 36.430 35.827 0.603 1 1 821 . 10 1 1 A 93 93 LYS N N 93 121.300 118.528 2.772 1 1 822 . 10 1 1 A 94 94 LYS H H 94 8.960 8.805 0.155 1 1 823 . 10 1 1 A 94 94 LYS HA H 94 4.460 4.221 0.239 1 1 832 . 10 1 1 A 94 94 LYS C C 94 176.330 176.566 -0.236 1 1 833 . 10 1 1 A 94 94 LYS CA C 94 56.720 57.015 -0.295 1 1 834 . 10 1 1 A 94 94 LYS CB C 94 31.930 32.636 -0.706 1 1 837 . 10 1 1 A 94 94 LYS N N 94 127.060 127.291 -0.231 1 1 838 . 10 1 1 A 95 95 ILE H H 95 8.290 8.945 -0.655 1 1 839 . 10 1 1 A 95 95 ILE HA H 95 4.120 4.324 -0.204 1 1 849 . 10 1 1 A 95 95 ILE C C 95 175.740 175.159 0.581 1 1 850 . 10 1 1 A 95 95 ILE CA C 95 62.760 61.785 0.975 1 1 851 . 10 1 1 A 95 95 ILE CB C 95 38.890 40.281 -1.391 1 1 855 . 10 1 1 A 95 95 ILE N N 95 126.530 128.913 -2.383 1 1 856 . 10 1 1 A 96 96 GLU H H 96 8.030 7.428 0.602 1 1 857 . 10 1 1 A 96 96 GLU HA H 96 4.450 4.574 -0.124 1 1 862 . 10 1 1 A 96 96 GLU C C 96 174.380 175.408 -1.028 1 1 863 . 10 1 1 A 96 96 GLU CA C 96 54.320 55.282 -0.962 1 1 864 . 10 1 1 A 96 96 GLU CB C 96 32.770 32.862 -0.092 1 1 866 . 10 1 1 A 96 96 GLU N N 96 117.080 120.008 -2.928 1 1 867 . 10 1 1 A 97 97 ASP H H 97 8.730 8.526 0.204 1 1 868 . 10 1 1 A 97 97 ASP HA H 97 4.360 4.517 -0.157 1 1 871 . 10 1 1 A 97 97 ASP C C 97 177.100 177.458 -0.358 1 1 872 . 10 1 1 A 97 97 ASP CA C 97 57.160 56.667 0.493 1 1 873 . 10 1 1 A 97 97 ASP CB C 97 39.920 40.693 -0.773 1 1 874 . 10 1 1 A 97 97 ASP N N 97 120.570 121.098 -0.528 1 1 875 . 10 1 1 A 98 98 GLY H H 98 8.760 7.839 0.921 1 1 876 . 10 1 1 A 98 98 GLY HA2 H 98 2.120 2.152 -0.032 1 1 877 . 10 1 1 A 98 98 GLY HA3 H 98 3.910 3.359 0.551 1 1 878 . 10 1 1 A 98 98 GLY C C 98 174.000 173.120 0.880 1 1 879 . 10 1 1 A 98 98 GLY CA C 98 45.720 45.658 0.062 1 1 880 . 10 1 1 A 98 98 GLY N N 98 112.090 106.554 5.536 1 1 881 . 10 1 1 A 99 99 LYS H H 99 7.890 7.483 0.407 1 1 882 . 10 1 1 A 99 99 LYS HA H 99 5.330 5.161 0.169 1 1 891 . 10 1 1 A 99 99 LYS C C 99 174.750 174.429 0.321 1 1 892 . 10 1 1 A 99 99 LYS CA C 99 55.990 55.036 0.954 1 1 893 . 10 1 1 A 99 99 LYS CB C 99 37.840 36.179 1.661 1 1 897 . 10 1 1 A 99 99 LYS N N 99 118.050 116.378 1.672 1 1 898 . 10 1 1 A 100 100 VAL H H 100 8.980 8.820 0.160 1 1 899 . 10 1 1 A 100 100 VAL HA H 100 4.510 4.706 -0.196 1 1 907 . 10 1 1 A 100 100 VAL C C 100 174.760 173.859 0.901 1 1 908 . 10 1 1 A 100 100 VAL CA C 100 60.130 59.067 1.063 1 1 909 . 10 1 1 A 100 100 VAL CB C 100 35.240 35.749 -0.509 1 1 912 . 10 1 1 A 100 100 VAL N N 100 123.850 119.274 4.576 1 1 913 . 10 1 1 A 101 101 ARG H H 101 8.810 8.069 0.741 1 1 914 . 10 1 1 A 101 101 ARG HA H 101 4.850 4.447 0.403 1 1 921 . 10 1 1 A 101 101 ARG C C 101 174.770 174.550 0.220 1 1 922 . 10 1 1 A 101 101 ARG CA C 101 54.580 55.674 -1.094 1 1 923 . 10 1 1 A 101 101 ARG CB C 101 32.400 31.202 1.198 1 1 926 . 10 1 1 A 101 101 ARG N N 101 129.210 124.055 5.155 1 1 927 . 10 1 1 A 102 102 VAL H H 102 9.100 8.154 0.946 1 1 928 . 10 1 1 A 102 102 VAL HA H 102 4.120 4.582 -0.462 1 1 936 . 10 1 1 A 102 102 VAL C C 102 171.640 173.489 -1.849 1 1 937 . 10 1 1 A 102 102 VAL CA C 102 61.350 60.062 1.288 1 1 938 . 10 1 1 A 102 102 VAL CB C 102 32.530 33.865 -1.335 1 1 941 . 10 1 1 A 102 102 VAL N N 102 130.470 123.889 6.581 1 1 942 . 10 1 1 A 103 103 LEU H H 103 8.110 9.813 -1.703 1 1 943 . 10 1 1 A 103 103 LEU HA H 103 5.120 4.819 0.301 1 1 953 . 10 1 1 A 103 103 LEU C C 103 176.410 175.909 0.501 1 1 954 . 10 1 1 A 103 103 LEU CA C 103 53.380 53.681 -0.301 1 1 955 . 10 1 1 A 103 103 LEU CB C 103 43.680 41.349 2.331 1 1 959 . 10 1 1 A 103 103 LEU N N 103 125.560 130.453 -4.893 1 1 960 . 10 1 1 A 104 104 VAL H H 104 9.580 9.190 0.390 1 1 961 . 10 1 1 A 104 104 VAL HA H 104 5.260 5.004 0.256 1 1 969 . 10 1 1 A 104 104 VAL C C 104 176.030 174.897 1.133 1 1 970 . 10 1 1 A 104 104 VAL CA C 104 60.220 61.305 -1.085 1 1 971 . 10 1 1 A 104 104 VAL CB C 104 34.310 33.756 0.554 1 1 974 . 10 1 1 A 104 104 VAL N N 104 125.790 126.799 -1.009 1 1 975 . 10 1 1 A 105 105 SER H H 105 9.340 8.918 0.422 1 1 976 . 10 1 1 A 105 105 SER HA H 105 5.300 5.123 0.177 1 1 979 . 10 1 1 A 105 105 SER C C 105 173.600 172.954 0.646 1 1 980 . 10 1 1 A 105 105 SER CA C 105 57.450 57.358 0.092 1 1 981 . 10 1 1 A 105 105 SER CB C 105 65.600 66.807 -1.207 1 1 982 . 10 1 1 A 105 105 SER N N 105 119.220 120.002 -0.782 1 1 983 . 10 1 1 A 106 106 SER H H 106 8.350 8.752 -0.402 1 1 984 . 10 1 1 A 106 106 SER HA H 106 4.720 4.922 -0.202 1 1 987 . 10 1 1 A 106 106 SER C C 106 176.930 174.834 2.096 1 1 988 . 10 1 1 A 106 106 SER CA C 106 58.170 57.499 0.671 1 1 989 . 10 1 1 A 106 106 SER CB C 106 64.170 63.207 0.963 1 1 990 . 10 1 1 A 106 106 SER N N 106 114.800 117.530 -2.730 1 1 991 . 10 1 1 A 107 107 LEU H H 107 8.770 8.914 -0.144 1 1 992 . 10 1 1 A 107 107 LEU HA H 107 4.710 4.206 0.504 1 1 1001 . 10 1 1 A 107 107 LEU C C 107 178.280 178.263 0.017 1 1 1002 . 10 1 1 A 107 107 LEU CA C 107 55.280 57.396 -2.116 1 1 1003 . 10 1 1 A 107 107 LEU CB C 107 43.410 42.148 1.262 1 1 1007 . 10 1 1 A 107 107 LEU N N 107 127.210 126.892 0.318 1 1 1008 . 10 1 1 A 108 108 THR H H 108 8.210 7.829 0.381 1 1 1009 . 10 1 1 A 108 108 THR HA H 108 4.400 4.298 0.102 1 1 1015 . 10 1 1 A 108 108 THR C C 108 176.130 175.727 0.403 1 1 1016 . 10 1 1 A 108 108 THR CA C 108 62.050 63.230 -1.180 1 1 1017 . 10 1 1 A 108 108 THR CB C 108 70.910 70.316 0.594 1 1 1019 . 10 1 1 A 108 108 THR N N 108 108.810 109.590 -0.780 1 1 1020 . 10 1 1 A 109 109 GLY H H 109 8.250 7.802 0.448 1 1 1021 . 10 1 1 A 109 109 GLY HA2 H 109 3.780 4.024 -0.244 1 1 1022 . 10 1 1 A 109 109 GLY HA3 H 109 4.290 4.038 0.252 1 1 1023 . 10 1 1 A 109 109 GLY C C 109 173.180 174.533 -1.353 1 1 1024 . 10 1 1 A 109 109 GLY CA C 109 45.340 45.080 0.260 1 1 1025 . 10 1 1 A 109 109 GLY N N 109 110.160 111.074 -0.914 1 1 1026 . 10 1 1 A 110 110 GLU H H 110 7.960 7.597 0.363 1 1 1027 . 10 1 1 A 110 110 GLU HA H 110 4.760 4.673 0.087 1 1 1032 . 10 1 1 A 110 110 GLU CA C 110 53.450 54.314 -0.864 1 1 1033 . 10 1 1 A 110 110 GLU CB C 110 30.020 29.445 0.575 1 1 1035 . 10 1 1 A 110 110 GLU N N 110 119.720 121.288 -1.568 1 1 1036 . 10 1 1 A 111 111 PRO HA H 111 3.250 4.131 -0.881 1 1 1043 . 10 1 1 A 111 111 PRO C C 111 176.710 176.028 0.682 1 1 1044 . 10 1 1 A 111 111 PRO CA C 111 62.240 62.175 0.065 1 1 1045 . 10 1 1 A 111 111 PRO CB C 111 31.990 31.680 0.310 1 1 1048 . 10 1 1 A 112 112 LEU H H 112 8.840 7.752 1.088 1 1 1049 . 10 1 1 A 112 112 LEU HA H 112 4.290 4.140 0.150 1 1 1059 . 10 1 1 A 112 112 LEU CA C 112 52.220 53.560 -1.340 1 1 1060 . 10 1 1 A 112 112 LEU CB C 112 41.090 41.428 -0.338 1 1 1063 . 10 1 1 A 112 112 LEU N N 112 122.420 122.184 0.236 1 1 1064 . 10 1 1 A 113 113 PRO HA H 113 4.380 4.275 0.105 1 1 1071 . 10 1 1 A 113 113 PRO C C 113 176.100 177.511 -1.411 1 1 1072 . 10 1 1 A 113 113 PRO CA C 113 61.930 64.051 -2.121 1 1 1073 . 10 1 1 A 113 113 PRO CB C 113 32.470 31.774 0.696 1 1 1076 . 10 1 1 A 114 114 ALA H H 114 8.070 7.842 0.228 1 1 1077 . 10 1 1 A 114 114 ALA HA H 114 4.550 3.940 0.610 1 1 1081 . 10 1 1 A 114 114 ALA C C 114 177.490 177.263 0.227 1 1 1082 . 10 1 1 A 114 114 ALA CA C 114 51.340 53.956 -2.616 1 1 1083 . 10 1 1 A 114 114 ALA CB C 114 19.940 18.069 1.871 1 1 1084 . 10 1 1 A 114 114 ALA N N 114 121.460 120.036 1.424 1 1 1085 . 10 1 1 A 115 115 LYS H H 115 9.000 8.676 0.324 1 1 1086 . 10 1 1 A 115 115 LYS HA H 115 3.930 3.876 0.054 1 1 1095 . 10 1 1 A 115 115 LYS C C 115 175.740 175.392 0.348 1 1 1096 . 10 1 1 A 115 115 LYS CA C 115 57.580 57.591 -0.011 1 1 1097 . 10 1 1 A 115 115 LYS CB C 115 29.510 30.531 -1.021 1 1 1101 . 10 1 1 A 115 115 LYS N N 115 112.560 114.926 -2.366 1 1 1102 . 10 1 1 A 116 116 GLU H H 116 7.620 7.670 -0.050 1 1 1103 . 10 1 1 A 116 116 GLU HA H 116 4.550 4.618 -0.068 1 1 1108 . 10 1 1 A 116 116 GLU C C 116 176.110 174.825 1.285 1 1 1109 . 10 1 1 A 116 116 GLU CA C 116 54.570 55.090 -0.520 1 1 1110 . 10 1 1 A 116 116 GLU CB C 116 33.680 32.774 0.906 1 1 1112 . 10 1 1 A 116 116 GLU N N 116 115.710 117.750 -2.040 1 1 1113 . 10 1 1 A 117 117 VAL H H 117 8.770 8.851 -0.081 1 1 1114 . 10 1 1 A 117 117 VAL HA H 117 3.200 4.113 -0.913 1 1 1122 . 10 1 1 A 117 117 VAL C C 117 175.740 175.583 0.157 1 1 1123 . 10 1 1 A 117 117 VAL CA C 117 65.340 62.847 2.493 1 1 1124 . 10 1 1 A 117 117 VAL CB C 117 31.290 31.086 0.204 1 1 1127 . 10 1 1 A 117 117 VAL N N 117 124.450 121.343 3.107 1 1 1128 . 10 1 1 A 118 118 LEU H H 118 8.550 8.898 -0.348 1 1 1129 . 10 1 1 A 118 118 LEU HA H 118 4.540 4.365 0.175 1 1 1139 . 10 1 1 A 118 118 LEU C C 118 176.210 177.041 -0.831 1 1 1140 . 10 1 1 A 118 118 LEU CA C 118 55.510 55.879 -0.369 1 1 1141 . 10 1 1 A 118 118 LEU CB C 118 44.600 42.392 2.208 1 1 1145 . 10 1 1 A 118 118 LEU N N 118 128.440 128.793 -0.353 1 1 1146 . 10 1 1 A 119 119 ALA H H 119 7.970 7.601 0.369 1 1 1147 . 10 1 1 A 119 119 ALA HA H 119 4.740 4.860 -0.120 1 1 1151 . 10 1 1 A 119 119 ALA C C 119 174.570 175.251 -0.681 1 1 1152 . 10 1 1 A 119 119 ALA CA C 119 50.770 51.678 -0.908 1 1 1153 . 10 1 1 A 119 119 ALA CB C 119 22.450 22.486 -0.036 1 1 1154 . 10 1 1 A 119 119 ALA N N 119 118.100 117.447 0.653 1 1 1155 . 10 1 1 A 120 120 LYS H H 120 8.760 9.362 -0.602 1 1 1156 . 10 1 1 A 120 120 LYS HA H 120 5.240 5.383 -0.143 1 1 1165 . 10 1 1 A 120 120 LYS C C 120 175.340 174.858 0.482 1 1 1166 . 10 1 1 A 120 120 LYS CA C 120 54.220 54.904 -0.684 1 1 1167 . 10 1 1 A 120 120 LYS CB C 120 34.340 33.937 0.403 1 1 1171 . 10 1 1 A 120 120 LYS N N 120 120.010 122.031 -2.021 1 1 1172 . 10 1 1 A 121 121 VAL H H 121 9.410 8.946 0.464 1 1 1173 . 10 1 1 A 121 121 VAL HA H 121 4.230 4.544 -0.314 1 1 1181 . 10 1 1 A 121 121 VAL C C 121 173.980 174.355 -0.375 1 1 1182 . 10 1 1 A 121 121 VAL CA C 121 62.370 61.880 0.490 1 1 1183 . 10 1 1 A 121 121 VAL CB C 121 32.410 32.490 -0.080 1 1 1186 . 10 1 1 A 121 121 VAL N N 121 124.960 126.010 -1.050 1 1 1187 . 10 1 1 A 122 122 VAL H H 122 9.280 8.397 0.883 1 1 1188 . 10 1 1 A 122 122 VAL HA H 122 4.360 4.518 -0.158 1 1 1196 . 10 1 1 A 122 122 VAL C C 122 174.190 175.456 -1.266 1 1 1197 . 10 1 1 A 122 122 VAL CA C 122 62.760 62.650 0.110 1 1 1198 . 10 1 1 A 122 122 VAL CB C 122 32.020 31.353 0.667 1 1 1201 . 10 1 1 A 122 122 VAL N N 122 128.990 130.868 -1.878 1 1 1202 . 10 1 1 A 123 123 LEU H H 123 8.610 8.829 -0.219 1 1 1203 . 10 1 1 A 123 123 LEU HA H 123 4.900 4.605 0.295 1 1 1213 . 10 1 1 A 123 123 LEU C C 123 174.950 176.458 -1.508 1 1 1214 . 10 1 1 A 123 123 LEU CA C 123 52.050 53.471 -1.421 1 1 1215 . 10 1 1 A 123 123 LEU CB C 123 45.210 42.185 3.025 1 1 1219 . 10 1 1 A 123 123 LEU N N 123 127.200 128.941 -1.741 1 1 1220 . 10 1 1 A 124 124 ARG H H 124 9.540 8.925 0.615 1 1 1221 . 10 1 1 A 124 124 ARG HA H 124 4.900 5.051 -0.151 1 1 1229 . 10 1 1 A 124 124 ARG C C 124 176.320 175.020 1.300 1 1 1230 . 10 1 1 A 124 124 ARG CA C 124 55.320 54.437 0.883 1 1 1231 . 10 1 1 A 124 124 ARG CB C 124 31.750 33.130 -1.380 1 1 1234 . 10 1 1 A 124 124 ARG N N 124 124.290 122.013 2.277 1 1 1236 . 10 1 1 A 125 125 ALA H H 125 8.880 8.435 0.445 1 1 1237 . 10 1 1 A 125 125 ALA HA H 125 4.380 3.998 0.382 1 1 1241 . 10 1 1 A 125 125 ALA C C 125 177.290 177.752 -0.462 1 1 1242 . 10 1 1 A 125 125 ALA CA C 125 52.530 51.216 1.314 1 1 1243 . 10 1 1 A 125 125 ALA CB C 125 19.870 17.314 2.556 1 1 1244 . 10 1 1 A 125 125 ALA N N 125 130.790 129.099 1.691 1 1 1245 . 10 1 1 A 126 126 GLU H H 126 9.260 8.307 0.953 1 1 1246 . 10 1 1 A 126 126 GLU HA H 126 4.460 4.334 0.126 1 1 1251 . 10 1 1 A 126 126 GLU C C 126 176.120 176.175 -0.055 1 1 1252 . 10 1 1 A 126 126 GLU CA C 126 56.940 57.148 -0.208 1 1 1253 . 10 1 1 A 126 126 GLU CB C 126 32.450 30.174 2.276 1 1 1255 . 10 1 1 A 126 126 GLU N N 126 125.740 123.244 2.496 1 1 1256 . 10 1 1 A 127 127 ALA H H 127 7.460 7.477 -0.017 1 1 1257 . 10 1 1 A 127 127 ALA HA H 127 4.360 4.601 -0.241 1 1 1261 . 10 1 1 A 127 127 ALA C C 127 173.400 175.809 -2.409 1 1 1262 . 10 1 1 A 127 127 ALA CA C 127 51.360 51.627 -0.267 1 1 1263 . 10 1 1 A 127 127 ALA CB C 127 22.180 22.136 0.044 1 1 1264 . 10 1 1 A 127 127 ALA N N 127 120.910 119.457 1.453 1 1 1265 . 10 1 1 A 128 128 LYS H H 128 7.940 8.627 -0.687 1 1 1266 . 10 1 1 A 128 128 LYS HA H 128 3.580 4.114 -0.534 1 1 1275 . 10 1 1 A 128 128 LYS C C 128 176.080 175.723 0.357 1 1 1276 . 10 1 1 A 128 128 LYS CA C 128 56.860 56.968 -0.108 1 1 1277 . 10 1 1 A 128 128 LYS CB C 128 33.170 33.210 -0.040 1 1 1281 . 10 1 1 A 128 128 LYS N N 128 116.520 124.393 -7.873 1 1 1282 . 10 1 1 A 129 129 ALA H H 129 8.590 8.728 -0.138 1 1 1283 . 10 1 1 A 129 129 ALA HA H 129 4.390 4.645 -0.255 1 1 1287 . 10 1 1 A 129 129 ALA C C 129 174.970 176.069 -1.099 1 1 1288 . 10 1 1 A 129 129 ALA CA C 129 52.970 51.400 1.570 1 1 1289 . 10 1 1 A 129 129 ALA CB C 129 21.500 18.823 2.677 1 1 1290 . 10 1 1 A 129 129 ALA N N 129 124.710 127.821 -3.111 1 1 1291 . 10 1 1 A 130 130 GLU H H 130 8.660 7.901 0.759 1 1 1292 . 10 1 1 A 130 130 GLU HA H 130 4.660 4.020 0.640 1 1 1297 . 10 1 1 A 130 130 GLU C C 130 177.390 177.366 0.024 1 1 1298 . 10 1 1 A 130 130 GLU CA C 130 55.070 58.570 -3.500 1 1 1299 . 10 1 1 A 130 130 GLU CB C 130 30.860 29.467 1.393 1 1 1301 . 10 1 1 A 130 130 GLU N N 130 123.180 119.945 3.235 1 1 1302 . 10 1 1 A 131 131 GLY H H 131 9.170 9.035 0.135 1 1 1303 . 10 1 1 A 131 131 GLY HA2 H 131 3.560 3.991 -0.431 1 1 1304 . 10 1 1 A 131 131 GLY HA3 H 131 3.750 3.997 -0.247 1 1 1305 . 10 1 1 A 131 131 GLY C C 131 174.550 174.620 -0.070 1 1 1306 . 10 1 1 A 131 131 GLY CA C 131 47.660 44.943 2.717 1 1 1307 . 10 1 1 A 131 131 GLY N N 131 115.530 113.356 2.174 1 1 1308 . 10 1 1 A 132 132 SER H H 132 8.430 8.401 0.029 1 1 1309 . 10 1 1 A 132 132 SER HA H 132 4.170 4.428 -0.258 1 1 1312 . 10 1 1 A 132 132 SER C C 132 175.350 173.748 1.602 1 1 1313 . 10 1 1 A 132 132 SER CA C 132 59.050 58.895 0.155 1 1 1314 . 10 1 1 A 132 132 SER CB C 132 64.880 62.391 2.489 1 1 1315 . 10 1 1 A 132 132 SER N N 132 115.930 119.450 -3.520 1 1 1316 . 10 1 1 A 133 133 ASN H H 133 8.850 8.442 0.408 1 1 1317 . 10 1 1 A 133 133 ASN HA H 133 4.910 5.239 -0.329 1 1 1322 . 10 1 1 A 133 133 ASN C C 133 175.450 174.562 0.888 1 1 1323 . 10 1 1 A 133 133 ASN CA C 133 54.920 53.941 0.979 1 1 1324 . 10 1 1 A 133 133 ASN CB C 133 41.060 39.120 1.940 1 1 1325 . 10 1 1 A 133 133 ASN N N 133 125.590 123.365 2.225 1 1 1327 . 10 1 1 A 134 134 LEU H H 134 9.070 9.201 -0.131 1 1 1328 . 10 1 1 A 134 134 LEU HA H 134 5.230 5.413 -0.183 1 1 1338 . 10 1 1 A 134 134 LEU C C 134 175.240 175.117 0.123 1 1 1339 . 10 1 1 A 134 134 LEU CA C 134 53.470 54.239 -0.769 1 1 1340 . 10 1 1 A 134 134 LEU CB C 134 45.090 44.787 0.303 1 1 1344 . 10 1 1 A 134 134 LEU N N 134 129.210 121.247 7.963 1 1 1345 . 10 1 1 A 135 135 SER H H 135 8.690 8.674 0.016 1 1 1346 . 10 1 1 A 135 135 SER HA H 135 5.280 5.336 -0.056 1 1 1349 . 10 1 1 A 135 135 SER C C 135 173.590 172.983 0.607 1 1 1350 . 10 1 1 A 135 135 SER CA C 135 56.220 56.638 -0.418 1 1 1351 . 10 1 1 A 135 135 SER CB C 135 66.510 64.544 1.966 1 1 1352 . 10 1 1 A 135 135 SER N N 135 113.020 119.620 -6.600 1 1 1353 . 10 1 1 A 136 136 VAL H H 136 8.940 8.531 0.409 1 1 1354 . 10 1 1 A 136 136 VAL HA H 136 5.500 4.867 0.633 1 1 1362 . 10 1 1 A 136 136 VAL C C 136 175.730 175.083 0.647 1 1 1363 . 10 1 1 A 136 136 VAL CA C 136 60.960 60.881 0.079 1 1 1364 . 10 1 1 A 136 136 VAL CB C 136 33.630 33.023 0.607 1 1 1367 . 10 1 1 A 136 136 VAL N N 136 124.340 125.745 -1.405 1 1 1368 . 10 1 1 A 137 137 THR H H 137 9.240 8.519 0.721 1 1 1369 . 10 1 1 A 137 137 THR HA H 137 4.920 4.778 0.142 1 1 1374 . 10 1 1 A 137 137 THR C C 137 173.500 174.095 -0.595 1 1 1375 . 10 1 1 A 137 137 THR CA C 137 59.120 60.261 -1.141 1 1 1376 . 10 1 1 A 137 137 THR CB C 137 72.500 70.729 1.771 1 1 1378 . 10 1 1 A 137 137 THR N N 137 117.010 119.346 -2.336 1 1 1379 . 10 1 1 A 138 138 ASN H H 138 9.190 8.825 0.365 1 1 1380 . 10 1 1 A 138 138 ASN HA H 138 4.420 4.246 0.174 1 1 1385 . 10 1 1 A 138 138 ASN C C 138 175.550 174.300 1.250 1 1 1386 . 10 1 1 A 138 138 ASN CA C 138 54.350 54.269 0.081 1 1 1387 . 10 1 1 A 138 138 ASN CB C 138 37.380 36.605 0.775 1 1 1388 . 10 1 1 A 138 138 ASN N N 138 115.270 118.337 -3.067 1 1 1390 . 10 1 1 A 139 139 SER H H 139 8.560 7.921 0.639 1 1 1391 . 10 1 1 A 139 139 SER HA H 139 5.800 4.315 1.485 1 1 1394 . 10 1 1 A 139 139 SER C C 139 175.750 173.574 2.176 1 1 1395 . 10 1 1 A 139 139 SER CA C 139 56.020 59.150 -3.130 1 1 1396 . 10 1 1 A 139 139 SER CB C 139 65.320 62.136 3.184 1 1 1397 . 10 1 1 A 139 139 SER N N 139 112.360 115.074 -2.714 1 1 1398 . 10 1 1 A 140 140 SER H H 140 9.900 8.266 1.634 1 1 1399 . 10 1 1 A 140 140 SER HA H 140 5.360 5.294 0.066 1 1 1402 . 10 1 1 A 140 140 SER C C 140 172.620 173.215 -0.595 1 1 1403 . 10 1 1 A 140 140 SER CA C 140 57.400 55.850 1.550 1 1 1404 . 10 1 1 A 140 140 SER CB C 140 66.550 66.055 0.495 1 1 1405 . 10 1 1 A 140 140 SER N N 140 119.130 119.402 -0.272 1 1 1406 . 10 1 1 A 141 141 VAL H H 141 9.030 8.914 0.116 1 1 1407 . 10 1 1 A 141 141 VAL HA H 141 5.520 5.084 0.436 1 1 1415 . 10 1 1 A 141 141 VAL C C 141 174.750 174.261 0.489 1 1 1416 . 10 1 1 A 141 141 VAL CA C 141 58.310 59.806 -1.496 1 1 1417 . 10 1 1 A 141 141 VAL CB C 141 35.030 36.115 -1.085 1 1 1420 . 10 1 1 A 141 141 VAL N N 141 111.410 120.250 -8.840 1 1 1421 . 10 1 1 A 142 142 GLY H H 142 8.790 9.043 -0.253 1 1 1422 . 10 1 1 A 142 142 GLY HA2 H 142 3.600 4.124 -0.524 1 1 1423 . 10 1 1 A 142 142 GLY HA3 H 142 5.310 4.139 1.171 1 1 1424 . 10 1 1 A 142 142 GLY C C 142 174.180 173.895 0.285 1 1 1425 . 10 1 1 A 142 142 GLY CA C 142 44.110 45.969 -1.859 1 1 1426 . 10 1 1 A 142 142 GLY N N 142 109.330 114.254 -4.924 1 1 1427 . 10 1 1 A 143 143 ASP H H 143 8.840 8.653 0.187 1 1 1428 . 10 1 1 A 143 143 ASP HA H 143 5.790 5.146 0.644 1 1 1431 . 10 1 1 A 143 143 ASP C C 143 178.860 178.189 0.671 1 1 1432 . 10 1 1 A 143 143 ASP CA C 143 53.040 54.972 -1.932 1 1 1433 . 10 1 1 A 143 143 ASP CB C 143 43.660 42.563 1.097 1 1 1434 . 10 1 1 A 143 143 ASP N N 143 125.390 126.335 -0.945 1 1 1435 . 10 1 1 A 144 144 GLY H H 144 9.150 8.884 0.266 1 1 1436 . 10 1 1 A 144 144 GLY HA2 H 144 3.450 3.765 -0.315 1 1 1437 . 10 1 1 A 144 144 GLY HA3 H 144 3.720 3.939 -0.219 1 1 1438 . 10 1 1 A 144 144 GLY C C 144 174.770 176.172 -1.402 1 1 1439 . 10 1 1 A 144 144 GLY CA C 144 46.930 47.429 -0.499 1 1 1440 . 10 1 1 A 144 144 GLY N N 144 106.470 110.181 -3.711 1 1 1441 . 10 1 1 A 145 145 GLU H H 145 8.470 8.507 -0.037 1 1 1442 . 10 1 1 A 145 145 GLU HA H 145 4.460 4.356 0.104 1 1 1447 . 10 1 1 A 145 145 GLU C C 145 176.520 176.288 0.232 1 1 1448 . 10 1 1 A 145 145 GLU CA C 145 55.330 56.655 -1.325 1 1 1449 . 10 1 1 A 145 145 GLU CB C 145 30.620 29.936 0.684 1 1 1451 . 10 1 1 A 145 145 GLU N N 145 119.170 119.866 -0.696 1 1 1452 . 10 1 1 A 146 146 GLY H H 146 7.950 7.926 0.024 1 1 1453 . 10 1 1 A 146 146 GLY HA2 H 146 3.630 4.036 -0.406 1 1 1454 . 10 1 1 A 146 146 GLY HA3 H 146 4.130 4.043 0.087 1 1 1455 . 10 1 1 A 146 146 GLY C C 146 174.350 174.781 -0.431 1 1 1456 . 10 1 1 A 146 146 GLY CA C 146 45.330 45.204 0.126 1 1 1457 . 10 1 1 A 146 146 GLY N N 146 108.130 106.465 1.665 1 1 1458 . 10 1 1 A 147 147 LEU H H 147 8.440 7.936 0.504 1 1 1459 . 10 1 1 A 147 147 LEU HA H 147 4.340 4.449 -0.109 1 1 1469 . 10 1 1 A 147 147 LEU C C 147 175.950 175.495 0.455 1 1 1470 . 10 1 1 A 147 147 LEU CA C 147 54.860 54.654 0.206 1 1 1471 . 10 1 1 A 147 147 LEU CB C 147 41.590 42.381 -0.791 1 1 1475 . 10 1 1 A 147 147 LEU N N 147 124.000 122.364 1.636 1 1 1476 . 10 1 1 A 148 148 VAL H H 148 7.780 8.112 -0.332 1 1 1477 . 10 1 1 A 148 148 VAL HA H 148 4.830 5.090 -0.260 1 1 1485 . 10 1 1 A 148 148 VAL C C 148 175.740 174.357 1.383 1 1 1486 . 10 1 1 A 148 148 VAL CA C 148 61.140 60.727 0.413 1 1 1487 . 10 1 1 A 148 148 VAL CB C 148 33.640 35.168 -1.528 1 1 1490 . 10 1 1 A 148 148 VAL N N 148 120.440 119.283 1.157 1 1 1491 . 10 1 1 A 149 149 HIS H H 149 9.170 8.944 0.226 1 1 1492 . 10 1 1 A 149 149 HIS HA H 149 4.950 5.065 -0.115 1 1 1496 . 10 1 1 A 149 149 HIS C C 149 174.780 174.779 0.001 1 1 1497 . 10 1 1 A 149 149 HIS CA C 149 53.900 54.381 -0.481 1 1 1498 . 10 1 1 A 149 149 HIS CB C 149 32.200 30.314 1.886 1 1 1499 . 10 1 1 A 149 149 HIS N N 149 124.700 125.312 -0.612 1 1 1500 . 10 1 1 A 150 150 GLU H H 150 9.060 8.606 0.454 1 1 1501 . 10 1 1 A 150 150 GLU HA H 150 4.420 4.199 0.221 1 1 1506 . 10 1 1 A 150 150 GLU C C 150 176.520 176.613 -0.093 1 1 1507 . 10 1 1 A 150 150 GLU CA C 150 57.630 56.900 0.730 1 1 1508 . 10 1 1 A 150 150 GLU CB C 150 30.370 30.015 0.355 1 1 1510 . 10 1 1 A 150 150 GLU N N 150 125.540 123.937 1.603 1 1 1511 . 10 1 1 A 151 151 ILE H H 151 8.150 7.758 0.392 1 1 1512 . 10 1 1 A 151 151 ILE HA H 151 4.780 4.554 0.226 1 1 1522 . 10 1 1 A 151 151 ILE C C 151 174.570 176.338 -1.768 1 1 1523 . 10 1 1 A 151 151 ILE CA C 151 59.390 59.326 0.064 1 1 1524 . 10 1 1 A 151 151 ILE CB C 151 42.040 39.407 2.633 1 1 1528 . 10 1 1 A 151 151 ILE N N 151 115.880 122.960 -7.080 1 1 1529 . 10 1 1 A 152 152 ALA H H 152 8.010 8.397 -0.387 1 1 1530 . 10 1 1 A 152 152 ALA HA H 152 4.310 4.404 -0.094 1 1 1534 . 10 1 1 A 152 152 ALA C C 152 177.500 176.765 0.735 1 1 1535 . 10 1 1 A 152 152 ALA CA C 152 53.680 51.706 1.974 1 1 1536 . 10 1 1 A 152 152 ALA CB C 152 20.050 19.832 0.218 1 1 1537 . 10 1 1 A 152 152 ALA N N 152 126.640 124.390 2.250 1 1 1538 . 10 1 1 A 153 153 GLY H H 153 8.340 8.326 0.014 1 1 1539 . 10 1 1 A 153 153 GLY HA2 H 153 4.050 4.305 -0.255 1 1 1540 . 10 1 1 A 153 153 GLY HA3 H 153 4.140 4.311 -0.171 1 1 1541 . 10 1 1 A 153 153 GLY C C 153 173.140 171.744 1.396 1 1 1542 . 10 1 1 A 153 153 GLY CA C 153 44.130 45.712 -1.582 1 1 1543 . 10 1 1 A 153 153 GLY N N 153 107.490 105.346 2.144 1 1 1544 . 10 1 1 A 154 154 THR H H 154 7.380 8.410 -1.030 1 1 1545 . 10 1 1 A 154 154 THR HA H 154 4.700 5.062 -0.362 1 1 1550 . 10 1 1 A 154 154 THR C C 154 171.120 172.904 -1.784 1 1 1551 . 10 1 1 A 154 154 THR CA C 154 60.830 61.119 -0.289 1 1 1552 . 10 1 1 A 154 154 THR CB C 154 68.850 72.358 -3.508 1 1 1554 . 10 1 1 A 154 154 THR N N 154 109.340 114.181 -4.841 1 1 1555 . 10 1 1 A 155 155 GLU H H 155 8.020 9.074 -1.054 1 1 1556 . 10 1 1 A 155 155 GLU HA H 155 5.370 5.582 -0.212 1 1 1561 . 10 1 1 A 155 155 GLU C C 155 174.240 174.682 -0.442 1 1 1562 . 10 1 1 A 155 155 GLU CA C 155 54.830 54.747 0.083 1 1 1563 . 10 1 1 A 155 155 GLU CB C 155 33.620 32.839 0.781 1 1 1565 . 10 1 1 A 155 155 GLU N N 155 118.690 126.434 -7.744 1 1 1566 . 10 1 1 A 156 156 LYS H H 156 9.230 9.156 0.074 1 1 1567 . 10 1 1 A 156 156 LYS HA H 156 4.650 5.118 -0.468 1 1 1576 . 10 1 1 A 156 156 LYS C C 156 174.000 174.408 -0.408 1 1 1577 . 10 1 1 A 156 156 LYS CA C 156 55.840 54.566 1.274 1 1 1578 . 10 1 1 A 156 156 LYS CB C 156 37.550 36.545 1.005 1 1 1582 . 10 1 1 A 156 156 LYS N N 156 121.940 125.322 -3.382 1 1 1583 . 10 1 1 A 157 157 THR H H 157 8.160 8.745 -0.585 1 1 1584 . 10 1 1 A 157 157 THR HA H 157 5.440 5.110 0.330 1 1 1589 . 10 1 1 A 157 157 THR C C 157 174.360 173.486 0.874 1 1 1590 . 10 1 1 A 157 157 THR CA C 157 60.410 60.805 -0.395 1 1 1591 . 10 1 1 A 157 157 THR CB C 157 71.500 71.325 0.175 1 1 1593 . 10 1 1 A 157 157 THR N N 157 113.240 112.924 0.316 1 1 1594 . 10 1 1 A 158 158 VAL H H 158 9.120 8.655 0.465 1 1 1595 . 10 1 1 A 158 158 VAL HA H 158 4.580 4.998 -0.418 1 1 1603 . 10 1 1 A 158 158 VAL C C 158 172.800 174.632 -1.832 1 1 1604 . 10 1 1 A 158 158 VAL CA C 158 59.980 59.738 0.242 1 1 1605 . 10 1 1 A 158 158 VAL CB C 158 36.290 34.508 1.782 1 1 1608 . 10 1 1 A 158 158 VAL N N 158 121.710 121.210 0.500 1 1 1609 . 10 1 1 A 159 159 ASN H H 159 8.240 8.907 -0.667 1 1 1610 . 10 1 1 A 159 159 ASN HA H 159 5.420 5.141 0.279 1 1 1615 . 10 1 1 A 159 159 ASN C C 159 173.800 174.174 -0.374 1 1 1616 . 10 1 1 A 159 159 ASN CA C 159 51.740 52.488 -0.748 1 1 1617 . 10 1 1 A 159 159 ASN CB C 159 40.380 39.313 1.067 1 1 1618 . 10 1 1 A 159 159 ASN N N 159 122.730 123.548 -0.818 1 1 1620 . 10 1 1 A 160 160 ILE H H 160 9.160 8.807 0.353 1 1 1621 . 10 1 1 A 160 160 ILE HA H 160 5.130 4.973 0.157 1 1 1631 . 10 1 1 A 160 160 ILE C C 160 177.320 175.618 1.702 1 1 1632 . 10 1 1 A 160 160 ILE CA C 160 60.640 60.573 0.067 1 1 1633 . 10 1 1 A 160 160 ILE CB C 160 38.520 37.476 1.044 1 1 1637 . 10 1 1 A 160 160 ILE N N 160 123.690 125.497 -1.807 1 1 1638 . 10 1 1 A 161 161 ILE H H 161 8.780 8.937 -0.157 1 1 1639 . 10 1 1 A 161 161 ILE HA H 161 4.590 4.598 -0.008 1 1 1649 . 10 1 1 A 161 161 ILE C C 161 174.960 175.963 -1.003 1 1 1650 . 10 1 1 A 161 161 ILE CA C 161 59.320 60.348 -1.028 1 1 1651 . 10 1 1 A 161 161 ILE CB C 161 41.030 39.865 1.165 1 1 1655 . 10 1 1 A 161 161 ILE N N 161 122.490 129.023 -6.533 1 1 1656 . 10 1 1 A 162 162 GLU H H 162 8.620 8.421 0.199 1 1 1657 . 10 1 1 A 162 162 GLU HA H 162 4.290 4.352 -0.062 1 1 1662 . 10 1 1 A 162 162 GLU C C 162 176.660 177.174 -0.514 1 1 1663 . 10 1 1 A 162 162 GLU CA C 162 56.470 57.080 -0.610 1 1 1664 . 10 1 1 A 162 162 GLU CB C 162 31.150 30.505 0.645 1 1 1666 . 10 1 1 A 162 162 GLU N N 162 120.520 125.365 -4.845 1 1 1667 . 10 1 1 A 163 163 GLY H H 163 8.480 8.489 -0.009 1 1 1668 . 10 1 1 A 163 163 GLY HA2 H 163 3.910 4.101 -0.191 1 1 1669 . 10 1 1 A 163 163 GLY HA3 H 163 4.150 4.103 0.047 1 1 1670 . 10 1 1 A 163 163 GLY C C 163 174.000 173.462 0.538 1 1 1671 . 10 1 1 A 163 163 GLY CA C 163 45.270 44.147 1.123 1 1 1672 . 10 1 1 A 163 163 GLY N N 163 110.210 109.837 0.373 1 1 1673 . 10 1 1 A 164 164 THR H H 164 8.170 8.511 -0.341 1 1 1674 . 10 1 1 A 164 164 THR HA H 164 4.410 4.573 -0.163 1 1 1679 . 10 1 1 A 164 164 THR C C 164 174.100 174.468 -0.368 1 1 1680 . 10 1 1 A 164 164 THR CA C 164 61.620 61.998 -0.378 1 1 1681 . 10 1 1 A 164 164 THR CB C 164 70.060 69.307 0.753 1 1 1683 . 10 1 1 A 164 164 THR N N 164 113.480 114.723 -1.243 1 1 1 . 11 1 1 A 13 13 GLY H H 13 8.350 7.866 0.484 1 1 2 . 11 1 1 A 13 13 GLY HA2 H 13 3.920 3.907 0.013 1 1 3 . 11 1 1 A 13 13 GLY HA3 H 13 3.920 3.911 0.009 1 1 4 . 11 1 1 A 13 13 GLY CA C 13 45.290 46.600 -1.310 1 1 5 . 11 1 1 A 13 13 GLY N N 13 110.450 107.982 2.468 1 1 6 . 11 1 1 A 14 14 LEU H H 14 8.050 8.438 -0.388 1 1 7 . 11 1 1 A 14 14 LEU N N 14 121.500 118.285 3.215 1 1 8 . 11 1 1 A 15 15 VAL H H 15 8.070 8.374 -0.304 1 1 9 . 11 1 1 A 15 15 VAL N N 15 122.390 125.168 -2.778 1 1 10 . 11 1 1 A 16 16 PRO HA H 16 4.360 4.322 0.038 1 1 17 . 11 1 1 A 16 16 PRO CA C 16 62.770 63.675 -0.905 1 1 18 . 11 1 1 A 16 16 PRO CB C 16 32.020 31.780 0.240 1 1 21 . 11 1 1 A 21 21 MET H H 21 8.180 9.077 -0.897 1 1 22 . 11 1 1 A 21 21 MET N N 21 121.310 117.364 3.946 1 1 23 . 11 1 1 A 22 22 ALA H H 22 8.290 7.867 0.423 1 1 24 . 11 1 1 A 22 22 ALA N N 22 124.800 118.199 6.601 1 1 25 . 11 1 1 A 23 23 SER H H 23 8.210 8.167 0.043 1 1 26 . 11 1 1 A 23 23 SER N N 23 114.830 108.794 6.036 1 1 27 . 11 1 1 A 24 24 LYS H H 24 8.250 8.327 -0.077 1 1 28 . 11 1 1 A 24 24 LYS N N 24 122.980 123.096 -0.116 1 1 29 . 11 1 1 A 25 25 LEU H H 25 8.140 8.667 -0.527 1 1 30 . 11 1 1 A 25 25 LEU HA H 25 4.290 4.775 -0.485 1 1 40 . 11 1 1 A 25 25 LEU C C 25 177.410 176.772 0.638 1 1 41 . 11 1 1 A 25 25 LEU CA C 25 55.430 53.687 1.743 1 1 42 . 11 1 1 A 25 25 LEU CB C 25 42.350 42.573 -0.223 1 1 46 . 11 1 1 A 25 25 LEU N N 25 122.580 125.479 -2.899 1 1 47 . 11 1 1 A 26 26 LYS H H 26 8.200 8.704 -0.504 1 1 48 . 11 1 1 A 26 26 LYS HA H 26 4.260 4.565 -0.305 1 1 57 . 11 1 1 A 26 26 LYS C C 26 176.520 176.607 -0.087 1 1 58 . 11 1 1 A 26 26 LYS CA C 26 56.700 56.957 -0.257 1 1 59 . 11 1 1 A 26 26 LYS CB C 26 33.060 34.784 -1.724 1 1 63 . 11 1 1 A 26 26 LYS N N 26 121.800 118.825 2.975 1 1 64 . 11 1 1 A 27 27 GLU H H 27 8.380 7.697 0.683 1 1 65 . 11 1 1 A 27 27 GLU HA H 27 4.240 4.846 -0.606 1 1 70 . 11 1 1 A 27 27 GLU C C 27 176.130 174.279 1.851 1 1 71 . 11 1 1 A 27 27 GLU CA C 27 56.700 54.875 1.825 1 1 72 . 11 1 1 A 27 27 GLU CB C 27 30.370 33.880 -3.510 1 1 74 . 11 1 1 A 27 27 GLU N N 27 121.700 118.303 3.397 1 1 75 . 11 1 1 A 28 28 ALA H H 28 8.230 8.666 -0.436 1 1 76 . 11 1 1 A 28 28 ALA HA H 28 4.280 4.694 -0.414 1 1 80 . 11 1 1 A 28 28 ALA C C 28 177.090 176.154 0.936 1 1 81 . 11 1 1 A 28 28 ALA CA C 28 52.530 50.740 1.790 1 1 82 . 11 1 1 A 28 28 ALA CB C 28 19.360 19.336 0.024 1 1 83 . 11 1 1 A 28 28 ALA N N 28 124.640 122.386 2.254 1 1 84 . 11 1 1 A 29 29 ALA H H 29 8.150 8.399 -0.249 1 1 85 . 11 1 1 A 29 29 ALA HA H 29 4.320 5.007 -0.687 1 1 89 . 11 1 1 A 29 29 ALA C C 29 177.120 175.713 1.407 1 1 90 . 11 1 1 A 29 29 ALA CA C 29 52.040 51.110 0.930 1 1 91 . 11 1 1 A 29 29 ALA CB C 29 19.430 19.353 0.077 1 1 92 . 11 1 1 A 29 29 ALA N N 29 123.430 125.030 -1.600 1 1 93 . 11 1 1 A 30 30 GLU H H 30 8.310 8.396 -0.086 1 1 94 . 11 1 1 A 30 30 GLU HA H 30 4.220 4.866 -0.646 1 1 99 . 11 1 1 A 30 30 GLU C C 30 176.310 175.725 0.585 1 1 100 . 11 1 1 A 30 30 GLU CA C 30 56.630 55.115 1.515 1 1 101 . 11 1 1 A 30 30 GLU CB C 30 30.320 31.474 -1.154 1 1 103 . 11 1 1 A 30 30 GLU N N 30 120.630 119.381 1.249 1 1 104 . 11 1 1 A 31 31 VAL H H 31 8.630 8.873 -0.243 1 1 105 . 11 1 1 A 31 31 VAL HA H 31 4.430 4.524 -0.094 1 1 113 . 11 1 1 A 31 31 VAL C C 31 176.510 176.407 0.103 1 1 114 . 11 1 1 A 31 31 VAL CA C 31 62.360 63.554 -1.194 1 1 115 . 11 1 1 A 31 31 VAL CB C 31 32.370 31.903 0.467 1 1 118 . 11 1 1 A 31 31 VAL N N 31 127.110 126.109 1.001 1 1 119 . 11 1 1 A 32 32 THR H H 32 7.640 8.741 -1.101 1 1 120 . 11 1 1 A 32 32 THR HA H 32 4.870 3.968 0.902 1 1 125 . 11 1 1 A 32 32 THR C C 32 172.220 174.814 -2.594 1 1 126 . 11 1 1 A 32 32 THR CA C 32 59.510 65.129 -5.619 1 1 127 . 11 1 1 A 32 32 THR CB C 32 71.630 69.987 1.643 1 1 129 . 11 1 1 A 32 32 THR N N 32 118.860 121.124 -2.264 1 1 130 . 11 1 1 A 33 33 GLY H H 33 8.350 7.998 0.352 1 1 131 . 11 1 1 A 33 33 GLY HA2 H 33 4.160 4.024 0.136 1 1 132 . 11 1 1 A 33 33 GLY HA3 H 33 4.250 4.032 0.218 1 1 133 . 11 1 1 A 33 33 GLY C C 33 172.820 173.456 -0.636 1 1 134 . 11 1 1 A 33 33 GLY CA C 33 46.680 45.202 1.478 1 1 135 . 11 1 1 A 33 33 GLY N N 33 106.720 108.810 -2.090 1 1 136 . 11 1 1 A 34 34 SER H H 34 8.810 8.598 0.212 1 1 137 . 11 1 1 A 34 34 SER HA H 34 5.390 5.212 0.178 1 1 140 . 11 1 1 A 34 34 SER C C 34 173.780 173.075 0.705 1 1 141 . 11 1 1 A 34 34 SER CA C 34 57.380 57.537 -0.157 1 1 142 . 11 1 1 A 34 34 SER CB C 34 65.730 66.752 -1.022 1 1 143 . 11 1 1 A 34 34 SER N N 34 112.690 119.134 -6.444 1 1 144 . 11 1 1 A 35 35 VAL H H 35 8.470 8.746 -0.276 1 1 145 . 11 1 1 A 35 35 VAL HA H 35 4.120 4.954 -0.834 1 1 153 . 11 1 1 A 35 35 VAL C C 35 174.750 174.866 -0.116 1 1 154 . 11 1 1 A 35 35 VAL CA C 35 62.310 60.210 2.100 1 1 155 . 11 1 1 A 35 35 VAL CB C 35 34.550 33.435 1.115 1 1 158 . 11 1 1 A 35 35 VAL N N 35 123.150 120.948 2.202 1 1 159 . 11 1 1 A 36 36 SER H H 36 8.240 8.933 -0.693 1 1 160 . 11 1 1 A 36 36 SER HA H 36 4.690 5.095 -0.405 1 1 163 . 11 1 1 A 36 36 SER C C 36 171.860 173.394 -1.534 1 1 164 . 11 1 1 A 36 36 SER CA C 36 56.020 56.572 -0.552 1 1 165 . 11 1 1 A 36 36 SER CB C 36 66.050 64.228 1.822 1 1 166 . 11 1 1 A 36 36 SER N N 36 118.760 119.571 -0.811 1 1 167 . 11 1 1 A 37 37 LEU H H 37 8.310 8.958 -0.648 1 1 168 . 11 1 1 A 37 37 LEU HA H 37 4.870 4.959 -0.089 1 1 178 . 11 1 1 A 37 37 LEU C C 37 174.190 175.819 -1.629 1 1 179 . 11 1 1 A 37 37 LEU CA C 37 53.870 53.645 0.225 1 1 180 . 11 1 1 A 37 37 LEU CB C 37 47.000 43.564 3.436 1 1 184 . 11 1 1 A 37 37 LEU N N 37 124.790 127.225 -2.435 1 1 185 . 11 1 1 A 38 38 GLU H H 38 9.270 8.748 0.522 1 1 186 . 11 1 1 A 38 38 GLU HA H 38 4.650 4.981 -0.331 1 1 191 . 11 1 1 A 38 38 GLU C C 38 173.970 175.219 -1.249 1 1 192 . 11 1 1 A 38 38 GLU CA C 38 54.410 55.832 -1.422 1 1 193 . 11 1 1 A 38 38 GLU CB C 38 32.460 32.034 0.426 1 1 195 . 11 1 1 A 38 38 GLU N N 38 126.550 126.058 0.492 1 1 196 . 11 1 1 A 39 39 ALA H H 39 8.120 8.515 -0.395 1 1 197 . 11 1 1 A 39 39 ALA HA H 39 4.600 4.783 -0.183 1 1 201 . 11 1 1 A 39 39 ALA C C 39 175.930 177.121 -1.191 1 1 202 . 11 1 1 A 39 39 ALA CA C 39 51.570 51.004 0.566 1 1 203 . 11 1 1 A 39 39 ALA CB C 39 21.780 22.804 -1.024 1 1 204 . 11 1 1 A 39 39 ALA N N 39 124.410 128.774 -4.364 1 1 205 . 11 1 1 A 40 40 LEU H H 40 7.860 9.035 -1.175 1 1 206 . 11 1 1 A 40 40 LEU HA H 40 4.230 3.979 0.251 1 1 216 . 11 1 1 A 40 40 LEU C C 40 175.940 176.674 -0.734 1 1 217 . 11 1 1 A 40 40 LEU CA C 40 55.360 57.045 -1.685 1 1 218 . 11 1 1 A 40 40 LEU CB C 40 42.990 42.293 0.697 1 1 222 . 11 1 1 A 40 40 LEU N N 40 120.640 122.210 -1.570 1 1 223 . 11 1 1 A 41 41 GLU H H 41 8.210 7.880 0.330 1 1 224 . 11 1 1 A 41 41 GLU HA H 41 4.240 4.071 0.169 1 1 229 . 11 1 1 A 41 41 GLU C C 41 176.920 175.077 1.843 1 1 230 . 11 1 1 A 41 41 GLU CA C 41 58.090 57.680 0.410 1 1 231 . 11 1 1 A 41 41 GLU CB C 41 30.530 27.084 3.446 1 1 233 . 11 1 1 A 41 41 GLU N N 41 114.680 116.440 -1.760 1 1 234 . 11 1 1 A 42 42 GLU H H 42 7.490 7.771 -0.281 1 1 235 . 11 1 1 A 42 42 GLU HA H 42 5.680 4.805 0.875 1 1 240 . 11 1 1 A 42 42 GLU C C 42 173.790 174.189 -0.399 1 1 241 . 11 1 1 A 42 42 GLU CA C 42 54.360 56.192 -1.832 1 1 242 . 11 1 1 A 42 42 GLU CB C 42 33.850 33.427 0.423 1 1 244 . 11 1 1 A 42 42 GLU N N 42 116.670 118.022 -1.352 1 1 245 . 11 1 1 A 43 43 VAL H H 43 8.550 8.896 -0.346 1 1 246 . 11 1 1 A 43 43 VAL HA H 43 4.550 4.664 -0.114 1 1 254 . 11 1 1 A 43 43 VAL C C 43 172.220 173.746 -1.526 1 1 255 . 11 1 1 A 43 43 VAL CA C 43 59.470 60.492 -1.022 1 1 256 . 11 1 1 A 43 43 VAL CB C 43 35.470 34.633 0.837 1 1 259 . 11 1 1 A 43 43 VAL N N 43 120.030 125.103 -5.073 1 1 260 . 11 1 1 A 44 44 GLN H H 44 8.470 8.616 -0.146 1 1 261 . 11 1 1 A 44 44 GLN HA H 44 4.890 4.695 0.195 1 1 268 . 11 1 1 A 44 44 GLN C C 44 176.130 176.011 0.119 1 1 269 . 11 1 1 A 44 44 GLN CA C 44 54.360 55.839 -1.479 1 1 270 . 11 1 1 A 44 44 GLN CB C 44 30.610 29.027 1.583 1 1 272 . 11 1 1 A 44 44 GLN N N 44 124.690 130.155 -5.465 1 1 274 . 11 1 1 A 45 45 VAL H H 45 8.130 8.553 -0.423 1 1 275 . 11 1 1 A 45 45 VAL HA H 45 3.030 3.978 -0.948 1 1 283 . 11 1 1 A 45 45 VAL C C 45 176.710 177.190 -0.480 1 1 284 . 11 1 1 A 45 45 VAL CA C 45 65.810 64.776 1.034 1 1 285 . 11 1 1 A 45 45 VAL CB C 45 31.960 31.448 0.512 1 1 288 . 11 1 1 A 45 45 VAL N N 45 120.450 127.265 -6.815 1 1 289 . 11 1 1 A 46 46 GLY H H 46 8.950 9.918 -0.968 1 1 290 . 11 1 1 A 46 46 GLY HA2 H 46 3.590 4.008 -0.418 1 1 291 . 11 1 1 A 46 46 GLY HA3 H 46 4.410 4.009 0.401 1 1 292 . 11 1 1 A 46 46 GLY C C 46 174.390 173.754 0.636 1 1 293 . 11 1 1 A 46 46 GLY CA C 46 44.730 44.900 -0.170 1 1 294 . 11 1 1 A 46 46 GLY N N 46 116.490 115.171 1.319 1 1 295 . 11 1 1 A 47 47 GLU H H 47 8.260 7.659 0.601 1 1 296 . 11 1 1 A 47 47 GLU HA H 47 4.460 4.707 -0.247 1 1 301 . 11 1 1 A 47 47 GLU C C 47 174.780 174.991 -0.211 1 1 302 . 11 1 1 A 47 47 GLU CA C 47 54.830 55.015 -0.185 1 1 303 . 11 1 1 A 47 47 GLU CB C 47 31.140 32.310 -1.170 1 1 305 . 11 1 1 A 47 47 GLU N N 47 120.520 121.336 -0.816 1 1 306 . 11 1 1 A 48 48 ASN H H 48 8.440 8.757 -0.317 1 1 307 . 11 1 1 A 48 48 ASN HA H 48 5.380 5.472 -0.092 1 1 312 . 11 1 1 A 48 48 ASN C C 48 174.770 174.211 0.559 1 1 313 . 11 1 1 A 48 48 ASN CA C 48 51.570 51.763 -0.193 1 1 314 . 11 1 1 A 48 48 ASN CB C 48 39.010 41.373 -2.363 1 1 315 . 11 1 1 A 48 48 ASN N N 48 117.180 120.195 -3.015 1 1 317 . 11 1 1 A 49 49 LEU H H 49 9.810 8.637 1.173 1 1 318 . 11 1 1 A 49 49 LEU HA H 49 4.510 5.211 -0.701 1 1 328 . 11 1 1 A 49 49 LEU C C 49 174.560 175.405 -0.845 1 1 329 . 11 1 1 A 49 49 LEU CA C 49 53.460 53.382 0.078 1 1 330 . 11 1 1 A 49 49 LEU CB C 49 45.520 45.810 -0.290 1 1 333 . 11 1 1 A 49 49 LEU N N 49 125.620 120.406 5.214 1 1 334 . 11 1 1 A 50 50 GLU H H 50 8.750 9.080 -0.330 1 1 335 . 11 1 1 A 50 50 GLU HA H 50 4.360 5.082 -0.722 1 1 340 . 11 1 1 A 50 50 GLU C C 50 175.340 175.407 -0.067 1 1 341 . 11 1 1 A 50 50 GLU CA C 50 55.550 55.358 0.192 1 1 342 . 11 1 1 A 50 50 GLU CB C 50 29.890 30.848 -0.958 1 1 344 . 11 1 1 A 50 50 GLU N N 50 125.420 120.313 5.107 1 1 345 . 11 1 1 A 51 51 VAL H H 51 9.230 8.346 0.884 1 1 346 . 11 1 1 A 51 51 VAL HA H 51 4.190 4.861 -0.671 1 1 354 . 11 1 1 A 51 51 VAL C C 51 175.310 174.525 0.785 1 1 355 . 11 1 1 A 51 51 VAL CA C 51 62.520 60.976 1.544 1 1 356 . 11 1 1 A 51 51 VAL CB C 51 31.470 32.890 -1.420 1 1 359 . 11 1 1 A 51 51 VAL N N 51 129.810 121.399 8.411 1 1 360 . 11 1 1 A 52 52 GLY H H 52 9.410 8.433 0.977 1 1 361 . 11 1 1 A 52 52 GLY HA2 H 52 3.460 3.860 -0.400 1 1 362 . 11 1 1 A 52 52 GLY HA3 H 52 4.680 3.872 0.808 1 1 363 . 11 1 1 A 52 52 GLY C C 52 173.000 173.137 -0.137 1 1 364 . 11 1 1 A 52 52 GLY CA C 52 46.470 47.124 -0.654 1 1 365 . 11 1 1 A 52 52 GLY N N 52 116.600 113.143 3.457 1 1 366 . 11 1 1 A 53 53 VAL H H 53 9.130 8.492 0.638 1 1 367 . 11 1 1 A 53 53 VAL HA H 53 4.840 4.675 0.165 1 1 375 . 11 1 1 A 53 53 VAL C C 53 175.470 175.095 0.375 1 1 376 . 11 1 1 A 53 53 VAL CA C 53 61.350 61.321 0.029 1 1 377 . 11 1 1 A 53 53 VAL CB C 53 34.300 31.519 2.781 1 1 380 . 11 1 1 A 53 53 VAL N N 53 129.050 124.648 4.402 1 1 381 . 11 1 1 A 54 54 GLY H H 54 8.420 8.433 -0.013 1 1 382 . 11 1 1 A 54 54 GLY HA2 H 54 3.850 3.825 0.025 1 1 383 . 11 1 1 A 54 54 GLY HA3 H 54 3.850 3.938 -0.088 1 1 384 . 11 1 1 A 54 54 GLY C C 54 173.310 173.141 0.169 1 1 385 . 11 1 1 A 54 54 GLY CA C 54 45.180 44.226 0.954 1 1 386 . 11 1 1 A 54 54 GLY N N 54 116.890 115.437 1.453 1 1 387 . 11 1 1 A 55 55 ILE H H 55 10.190 8.014 2.176 1 1 388 . 11 1 1 A 55 55 ILE HA H 55 4.010 4.589 -0.579 1 1 398 . 11 1 1 A 55 55 ILE C C 55 174.380 175.380 -1.000 1 1 399 . 11 1 1 A 55 55 ILE CA C 55 61.350 60.057 1.293 1 1 400 . 11 1 1 A 55 55 ILE CB C 55 40.840 39.652 1.188 1 1 404 . 11 1 1 A 55 55 ILE N N 55 129.330 121.635 7.695 1 1 405 . 11 1 1 A 56 56 ASP H H 56 8.810 9.855 -1.045 1 1 406 . 11 1 1 A 56 56 ASP HA H 56 4.440 4.664 -0.224 1 1 409 . 11 1 1 A 56 56 ASP C C 56 175.530 175.281 0.249 1 1 410 . 11 1 1 A 56 56 ASP CA C 56 56.460 55.184 1.276 1 1 411 . 11 1 1 A 56 56 ASP CB C 56 42.720 42.973 -0.253 1 1 412 . 11 1 1 A 56 56 ASP N N 56 128.310 127.976 0.334 1 1 413 . 11 1 1 A 57 57 GLU H H 57 7.270 7.502 -0.232 1 1 414 . 11 1 1 A 57 57 GLU HA H 57 4.290 4.823 -0.533 1 1 419 . 11 1 1 A 57 57 GLU C C 57 173.370 174.593 -1.223 1 1 420 . 11 1 1 A 57 57 GLU CA C 57 54.840 55.510 -0.670 1 1 421 . 11 1 1 A 57 57 GLU CB C 57 33.190 33.779 -0.589 1 1 423 . 11 1 1 A 57 57 GLU N N 57 112.810 116.166 -3.356 1 1 424 . 11 1 1 A 58 58 LEU H H 58 8.370 8.628 -0.258 1 1 425 . 11 1 1 A 58 58 LEU HA H 58 4.830 5.109 -0.279 1 1 434 . 11 1 1 A 58 58 LEU C C 58 174.180 175.151 -0.971 1 1 435 . 11 1 1 A 58 58 LEU CA C 58 55.320 53.417 1.903 1 1 436 . 11 1 1 A 58 58 LEU CB C 58 44.300 44.852 -0.552 1 1 439 . 11 1 1 A 58 58 LEU N N 58 123.130 121.246 1.884 1 1 440 . 11 1 1 A 59 59 VAL H H 59 9.120 8.697 0.423 1 1 441 . 11 1 1 A 59 59 VAL HA H 59 4.240 4.649 -0.409 1 1 449 . 11 1 1 A 59 59 VAL C C 59 174.960 175.318 -0.358 1 1 450 . 11 1 1 A 59 59 VAL CA C 59 61.760 60.087 1.673 1 1 451 . 11 1 1 A 59 59 VAL CB C 59 33.760 33.808 -0.048 1 1 454 . 11 1 1 A 59 59 VAL N N 59 127.930 122.710 5.220 1 1 455 . 11 1 1 A 60 60 ASN H H 60 8.770 8.399 0.371 1 1 456 . 11 1 1 A 60 60 ASN HA H 60 4.250 4.797 -0.547 1 1 461 . 11 1 1 A 60 60 ASN C C 60 172.810 173.847 -1.037 1 1 462 . 11 1 1 A 60 60 ASN CA C 60 54.830 54.732 0.098 1 1 463 . 11 1 1 A 60 60 ASN CB C 60 36.030 36.510 -0.480 1 1 464 . 11 1 1 A 60 60 ASN N N 60 115.500 122.454 -6.954 1 1 466 . 11 1 1 A 61 61 ALA H H 61 7.330 7.396 -0.066 1 1 467 . 11 1 1 A 61 61 ALA HA H 61 4.520 4.483 0.037 1 1 471 . 11 1 1 A 61 61 ALA C C 61 174.580 174.891 -0.311 1 1 472 . 11 1 1 A 61 61 ALA CA C 61 51.560 51.243 0.317 1 1 473 . 11 1 1 A 61 61 ALA CB C 61 22.870 22.343 0.527 1 1 474 . 11 1 1 A 61 61 ALA N N 61 115.640 118.789 -3.149 1 1 475 . 11 1 1 A 62 62 GLU H H 62 7.900 9.105 -1.205 1 1 476 . 11 1 1 A 62 62 GLU HA H 62 4.310 5.037 -0.727 1 1 481 . 11 1 1 A 62 62 GLU C C 62 173.790 175.669 -1.879 1 1 482 . 11 1 1 A 62 62 GLU CA C 62 55.080 55.309 -0.229 1 1 483 . 11 1 1 A 62 62 GLU CB C 62 32.610 30.700 1.910 1 1 485 . 11 1 1 A 62 62 GLU N N 62 117.400 117.927 -0.527 1 1 486 . 11 1 1 A 63 63 ALA H H 63 8.910 8.855 0.055 1 1 487 . 11 1 1 A 63 63 ALA HA H 63 4.690 4.627 0.063 1 1 491 . 11 1 1 A 63 63 ALA C C 63 175.720 176.700 -0.980 1 1 492 . 11 1 1 A 63 63 ALA CA C 63 50.600 53.280 -2.680 1 1 493 . 11 1 1 A 63 63 ALA CB C 63 20.660 18.986 1.674 1 1 494 . 11 1 1 A 63 63 ALA N N 63 122.480 128.341 -5.861 1 1 495 . 11 1 1 A 64 64 PHE H H 64 9.220 9.854 -0.634 1 1 496 . 11 1 1 A 64 64 PHE HA H 64 4.320 4.716 -0.396 1 1 501 . 11 1 1 A 64 64 PHE C C 64 174.380 176.244 -1.864 1 1 502 . 11 1 1 A 64 64 PHE CA C 64 59.770 58.819 0.951 1 1 503 . 11 1 1 A 64 64 PHE CB C 64 40.830 40.965 -0.135 1 1 504 . 11 1 1 A 64 64 PHE N N 64 120.870 123.409 -2.539 1 1 505 . 11 1 1 A 65 65 ALA H H 65 8.150 7.874 0.276 1 1 506 . 11 1 1 A 65 65 ALA HA H 65 5.280 4.849 0.431 1 1 510 . 11 1 1 A 65 65 ALA C C 65 175.950 175.268 0.682 1 1 511 . 11 1 1 A 65 65 ALA CA C 65 51.120 51.298 -0.178 1 1 512 . 11 1 1 A 65 65 ALA CB C 65 22.850 21.378 1.472 1 1 513 . 11 1 1 A 65 65 ALA N N 65 122.350 119.470 2.880 1 1 514 . 11 1 1 A 66 66 TYR H H 66 9.260 9.328 -0.068 1 1 515 . 11 1 1 A 66 66 TYR HA H 66 5.710 5.252 0.458 1 1 520 . 11 1 1 A 66 66 TYR C C 66 175.690 174.052 1.638 1 1 521 . 11 1 1 A 66 66 TYR CA C 66 54.390 57.585 -3.195 1 1 522 . 11 1 1 A 66 66 TYR CB C 66 41.560 41.535 0.025 1 1 523 . 11 1 1 A 66 66 TYR N N 66 124.350 126.722 -2.372 1 1 524 . 11 1 1 A 67 67 ASP H H 67 9.070 8.180 0.890 1 1 525 . 11 1 1 A 67 67 ASP HA H 67 5.630 5.159 0.471 1 1 528 . 11 1 1 A 67 67 ASP C C 67 174.300 174.417 -0.117 1 1 529 . 11 1 1 A 67 67 ASP CA C 67 51.590 52.862 -1.272 1 1 530 . 11 1 1 A 67 67 ASP CB C 67 44.380 43.244 1.136 1 1 531 . 11 1 1 A 67 67 ASP N N 67 130.490 125.176 5.314 1 1 532 . 11 1 1 A 68 68 PHE H H 68 8.670 8.364 0.306 1 1 533 . 11 1 1 A 68 68 PHE HA H 68 4.890 5.698 -0.808 1 1 538 . 11 1 1 A 68 68 PHE C C 68 172.220 173.526 -1.306 1 1 539 . 11 1 1 A 68 68 PHE CA C 68 57.360 54.822 2.538 1 1 540 . 11 1 1 A 68 68 PHE CB C 68 40.360 42.528 -2.168 1 1 541 . 11 1 1 A 68 68 PHE N N 68 118.200 118.666 -0.466 1 1 542 . 11 1 1 A 69 69 THR H H 69 8.390 9.050 -0.660 1 1 543 . 11 1 1 A 69 69 THR HA H 69 5.170 4.828 0.342 1 1 548 . 11 1 1 A 69 69 THR C C 69 172.620 173.812 -1.192 1 1 549 . 11 1 1 A 69 69 THR CA C 69 61.370 61.498 -0.128 1 1 550 . 11 1 1 A 69 69 THR CB C 69 64.880 69.087 -4.207 1 1 552 . 11 1 1 A 69 69 THR N N 69 115.810 116.982 -1.172 1 1 553 . 11 1 1 A 70 70 LEU H H 70 9.560 8.968 0.592 1 1 554 . 11 1 1 A 70 70 LEU HA H 70 5.270 4.847 0.423 1 1 564 . 11 1 1 A 70 70 LEU C C 70 173.800 175.071 -1.271 1 1 565 . 11 1 1 A 70 70 LEU CA C 70 53.460 55.327 -1.867 1 1 566 . 11 1 1 A 70 70 LEU CB C 70 45.040 43.472 1.568 1 1 570 . 11 1 1 A 70 70 LEU N N 70 129.220 129.810 -0.590 1 1 571 . 11 1 1 A 71 71 ASN H H 71 9.590 8.451 1.139 1 1 572 . 11 1 1 A 71 71 ASN HA H 71 5.880 5.601 0.279 1 1 577 . 11 1 1 A 71 71 ASN C C 71 177.970 174.792 3.178 1 1 578 . 11 1 1 A 71 71 ASN CA C 71 52.060 52.269 -0.209 1 1 579 . 11 1 1 A 71 71 ASN CB C 71 41.020 39.407 1.613 1 1 580 . 11 1 1 A 71 71 ASN N N 71 125.970 124.214 1.756 1 1 582 . 11 1 1 A 72 72 TYR H H 72 8.740 8.948 -0.208 1 1 583 . 11 1 1 A 72 72 TYR HA H 72 5.110 5.353 -0.243 1 1 588 . 11 1 1 A 72 72 TYR C C 72 177.720 173.253 4.467 1 1 589 . 11 1 1 A 72 72 TYR CA C 72 55.310 55.610 -0.300 1 1 590 . 11 1 1 A 72 72 TYR CB C 72 41.510 41.435 0.075 1 1 591 . 11 1 1 A 72 72 TYR N N 72 119.640 122.398 -2.758 1 1 592 . 11 1 1 A 73 73 ASP H H 73 9.780 9.021 0.759 1 1 593 . 11 1 1 A 73 73 ASP HA H 73 4.680 4.854 -0.174 1 1 596 . 11 1 1 A 73 73 ASP C C 73 177.290 177.060 0.230 1 1 597 . 11 1 1 A 73 73 ASP CA C 73 53.650 52.926 0.724 1 1 598 . 11 1 1 A 73 73 ASP CB C 73 40.900 42.612 -1.712 1 1 599 . 11 1 1 A 73 73 ASP N N 73 119.290 121.425 -2.135 1 1 600 . 11 1 1 A 74 74 GLU H H 74 9.430 8.774 0.656 1 1 601 . 11 1 1 A 74 74 GLU HA H 74 4.740 4.259 0.481 1 1 606 . 11 1 1 A 74 74 GLU C C 74 176.320 176.720 -0.400 1 1 607 . 11 1 1 A 74 74 GLU CA C 74 57.410 58.098 -0.688 1 1 608 . 11 1 1 A 74 74 GLU CB C 74 29.490 29.616 -0.126 1 1 610 . 11 1 1 A 74 74 GLU N N 74 130.930 124.031 6.899 1 1 611 . 11 1 1 A 75 75 ASN H H 75 8.680 8.015 0.665 1 1 612 . 11 1 1 A 75 75 ASN HA H 75 4.600 4.867 -0.267 1 1 617 . 11 1 1 A 75 75 ASN C C 75 175.340 175.564 -0.224 1 1 618 . 11 1 1 A 75 75 ASN CA C 75 54.620 53.322 1.298 1 1 619 . 11 1 1 A 75 75 ASN CB C 75 38.770 39.338 -0.568 1 1 620 . 11 1 1 A 75 75 ASN N N 75 115.040 117.817 -2.777 1 1 622 . 11 1 1 A 76 76 ALA H H 76 7.740 8.062 -0.322 1 1 623 . 11 1 1 A 76 76 ALA HA H 76 4.310 4.410 -0.100 1 1 627 . 11 1 1 A 76 76 ALA C C 76 175.550 176.956 -1.406 1 1 628 . 11 1 1 A 76 76 ALA CA C 76 53.260 53.486 -0.226 1 1 629 . 11 1 1 A 76 76 ALA CB C 76 21.450 21.020 0.430 1 1 630 . 11 1 1 A 76 76 ALA N N 76 122.200 121.976 0.224 1 1 631 . 11 1 1 A 77 77 PHE H H 77 8.070 8.337 -0.267 1 1 632 . 11 1 1 A 77 77 PHE HA H 77 5.650 4.838 0.812 1 1 637 . 11 1 1 A 77 77 PHE C C 77 174.570 175.390 -0.820 1 1 638 . 11 1 1 A 77 77 PHE CA C 77 56.360 57.550 -1.190 1 1 639 . 11 1 1 A 77 77 PHE CB C 77 46.080 41.183 4.897 1 1 640 . 11 1 1 A 77 77 PHE N N 77 114.160 114.793 -0.633 1 1 641 . 11 1 1 A 78 78 GLU H H 78 8.800 8.951 -0.151 1 1 642 . 11 1 1 A 78 78 GLU HA H 78 4.900 4.974 -0.074 1 1 647 . 11 1 1 A 78 78 GLU C C 78 175.950 174.826 1.124 1 1 648 . 11 1 1 A 78 78 GLU CA C 78 53.670 55.853 -2.183 1 1 649 . 11 1 1 A 78 78 GLU CB C 78 33.600 32.836 0.764 1 1 651 . 11 1 1 A 78 78 GLU N N 78 117.590 120.660 -3.070 1 1 652 . 11 1 1 A 79 79 TYR H H 79 8.770 8.982 -0.212 1 1 653 . 11 1 1 A 79 79 TYR HA H 79 4.250 4.103 0.147 1 1 658 . 11 1 1 A 79 79 TYR C C 79 174.580 174.999 -0.419 1 1 659 . 11 1 1 A 79 79 TYR CA C 79 59.250 59.584 -0.334 1 1 660 . 11 1 1 A 79 79 TYR CB C 79 38.310 39.117 -0.807 1 1 661 . 11 1 1 A 79 79 TYR N N 79 126.560 129.560 -3.000 1 1 662 . 11 1 1 A 80 80 VAL H H 80 8.220 8.802 -0.582 1 1 663 . 11 1 1 A 80 80 VAL HA H 80 3.690 3.845 -0.155 1 1 671 . 11 1 1 A 80 80 VAL C C 80 174.780 175.572 -0.792 1 1 672 . 11 1 1 A 80 80 VAL CA C 80 64.400 63.046 1.354 1 1 673 . 11 1 1 A 80 80 VAL CB C 80 33.510 32.858 0.652 1 1 676 . 11 1 1 A 80 80 VAL N N 80 129.460 125.982 3.478 1 1 677 . 11 1 1 A 81 81 GLU H H 81 6.920 7.544 -0.624 1 1 678 . 11 1 1 A 81 81 GLU HA H 81 4.260 4.585 -0.325 1 1 683 . 11 1 1 A 81 81 GLU C C 81 171.840 174.787 -2.947 1 1 684 . 11 1 1 A 81 81 GLU CA C 81 55.310 55.294 0.016 1 1 685 . 11 1 1 A 81 81 GLU CB C 81 30.520 32.901 -2.381 1 1 687 . 11 1 1 A 81 81 GLU N N 81 112.430 114.625 -2.195 1 1 688 . 11 1 1 A 82 82 ALA H H 82 8.310 8.588 -0.278 1 1 689 . 11 1 1 A 82 82 ALA HA H 82 5.650 4.865 0.785 1 1 693 . 11 1 1 A 82 82 ALA C C 82 176.110 177.106 -0.996 1 1 694 . 11 1 1 A 82 82 ALA CA C 82 50.620 51.924 -1.304 1 1 695 . 11 1 1 A 82 82 ALA CB C 82 21.770 20.056 1.714 1 1 696 . 11 1 1 A 82 82 ALA N N 82 121.240 124.330 -3.090 1 1 697 . 11 1 1 A 83 83 ILE H H 83 9.150 9.327 -0.177 1 1 698 . 11 1 1 A 83 83 ILE HA H 83 4.600 4.865 -0.265 1 1 708 . 11 1 1 A 83 83 ILE C C 83 174.810 174.888 -0.078 1 1 709 . 11 1 1 A 83 83 ILE CA C 83 60.060 59.270 0.790 1 1 710 . 11 1 1 A 83 83 ILE CB C 83 42.440 41.527 0.913 1 1 714 . 11 1 1 A 83 83 ILE N N 83 119.720 120.322 -0.602 1 1 715 . 11 1 1 A 84 84 SER H H 84 8.350 8.913 -0.563 1 1 716 . 11 1 1 A 84 84 SER HA H 84 4.660 5.064 -0.404 1 1 719 . 11 1 1 A 84 84 SER C C 84 177.550 173.581 3.969 1 1 720 . 11 1 1 A 84 84 SER CA C 84 57.330 56.375 0.955 1 1 721 . 11 1 1 A 84 84 SER CB C 84 66.490 66.623 -0.133 1 1 722 . 11 1 1 A 84 84 SER N N 84 116.740 117.706 -0.966 1 1 723 . 11 1 1 A 85 85 ASP H H 85 8.740 8.488 0.252 1 1 724 . 11 1 1 A 85 85 ASP HA H 85 4.820 4.971 -0.151 1 1 727 . 11 1 1 A 85 85 ASP C C 85 176.090 176.849 -0.759 1 1 728 . 11 1 1 A 85 85 ASP CA C 85 53.480 53.547 -0.067 1 1 729 . 11 1 1 A 85 85 ASP CB C 85 42.480 42.117 0.363 1 1 730 . 11 1 1 A 85 85 ASP N N 85 120.960 120.859 0.101 1 1 731 . 11 1 1 A 86 86 ASP H H 86 8.380 8.761 -0.381 1 1 732 . 11 1 1 A 86 86 ASP HA H 86 4.450 4.910 -0.460 1 1 735 . 11 1 1 A 86 86 ASP C C 86 177.100 176.263 0.837 1 1 736 . 11 1 1 A 86 86 ASP CA C 86 56.240 53.102 3.138 1 1 737 . 11 1 1 A 86 86 ASP CB C 86 41.100 40.372 0.728 1 1 738 . 11 1 1 A 86 86 ASP N N 86 117.710 119.525 -1.815 1 1 739 . 11 1 1 A 87 87 GLY H H 87 8.690 7.596 1.094 1 1 740 . 11 1 1 A 87 87 GLY HA2 H 87 3.870 4.109 -0.239 1 1 741 . 11 1 1 A 87 87 GLY HA3 H 87 4.090 4.120 -0.030 1 1 742 . 11 1 1 A 87 87 GLY C C 87 173.800 174.331 -0.531 1 1 743 . 11 1 1 A 87 87 GLY CA C 87 45.770 45.634 0.136 1 1 744 . 11 1 1 A 87 87 GLY N N 87 108.540 107.793 0.747 1 1 745 . 11 1 1 A 88 88 VAL H H 88 7.910 7.631 0.279 1 1 746 . 11 1 1 A 88 88 VAL HA H 88 4.780 4.275 0.505 1 1 754 . 11 1 1 A 88 88 VAL C C 88 173.970 175.572 -1.602 1 1 755 . 11 1 1 A 88 88 VAL CA C 88 60.900 62.193 -1.293 1 1 756 . 11 1 1 A 88 88 VAL CB C 88 35.460 32.990 2.470 1 1 759 . 11 1 1 A 88 88 VAL N N 88 119.790 120.685 -0.895 1 1 760 . 11 1 1 A 89 89 PHE H H 89 9.210 9.786 -0.576 1 1 761 . 11 1 1 A 89 89 PHE HA H 89 4.930 5.442 -0.512 1 1 766 . 11 1 1 A 89 89 PHE C C 89 173.970 174.023 -0.053 1 1 767 . 11 1 1 A 89 89 PHE CA C 89 56.450 55.393 1.057 1 1 768 . 11 1 1 A 89 89 PHE CB C 89 41.120 40.985 0.135 1 1 769 . 11 1 1 A 89 89 PHE N N 89 126.780 124.564 2.216 1 1 770 . 11 1 1 A 90 90 VAL H H 90 7.880 9.177 -1.297 1 1 771 . 11 1 1 A 90 90 VAL HA H 90 4.860 4.987 -0.127 1 1 779 . 11 1 1 A 90 90 VAL C C 90 173.190 175.129 -1.939 1 1 780 . 11 1 1 A 90 90 VAL CA C 90 59.750 61.328 -1.578 1 1 781 . 11 1 1 A 90 90 VAL CB C 90 34.770 32.810 1.960 1 1 784 . 11 1 1 A 90 90 VAL N N 90 124.990 127.406 -2.416 1 1 785 . 11 1 1 A 91 91 ASN H H 91 8.670 9.003 -0.333 1 1 786 . 11 1 1 A 91 91 ASN HA H 91 4.730 5.376 -0.646 1 1 791 . 11 1 1 A 91 91 ASN C C 91 173.200 174.207 -1.007 1 1 792 . 11 1 1 A 91 91 ASN CA C 91 51.970 51.847 0.123 1 1 793 . 11 1 1 A 91 91 ASN CB C 91 41.340 41.613 -0.273 1 1 794 . 11 1 1 A 91 91 ASN N N 91 124.860 125.049 -0.189 1 1 796 . 11 1 1 A 92 92 ALA H H 92 8.840 9.098 -0.258 1 1 797 . 11 1 1 A 92 92 ALA HA H 92 5.290 5.521 -0.231 1 1 801 . 11 1 1 A 92 92 ALA C C 92 176.330 176.279 0.051 1 1 802 . 11 1 1 A 92 92 ALA CA C 92 50.170 50.615 -0.445 1 1 803 . 11 1 1 A 92 92 ALA CB C 92 23.610 21.360 2.250 1 1 804 . 11 1 1 A 92 92 ALA N N 92 128.510 127.903 0.607 1 1 805 . 11 1 1 A 93 93 LYS H H 93 8.670 9.595 -0.925 1 1 806 . 11 1 1 A 93 93 LYS HA H 93 4.460 4.912 -0.452 1 1 815 . 11 1 1 A 93 93 LYS C C 93 174.170 175.220 -1.050 1 1 816 . 11 1 1 A 93 93 LYS CA C 93 55.010 54.665 0.345 1 1 817 . 11 1 1 A 93 93 LYS CB C 93 36.430 35.539 0.891 1 1 821 . 11 1 1 A 93 93 LYS N N 93 121.300 122.109 -0.809 1 1 822 . 11 1 1 A 94 94 LYS H H 94 8.960 8.687 0.273 1 1 823 . 11 1 1 A 94 94 LYS HA H 94 4.460 4.158 0.302 1 1 832 . 11 1 1 A 94 94 LYS C C 94 176.330 176.878 -0.548 1 1 833 . 11 1 1 A 94 94 LYS CA C 94 56.720 56.692 0.028 1 1 834 . 11 1 1 A 94 94 LYS CB C 94 31.930 32.768 -0.838 1 1 837 . 11 1 1 A 94 94 LYS N N 94 127.060 127.500 -0.440 1 1 838 . 11 1 1 A 95 95 ILE H H 95 8.290 8.650 -0.360 1 1 839 . 11 1 1 A 95 95 ILE HA H 95 4.120 4.113 0.007 1 1 849 . 11 1 1 A 95 95 ILE C C 95 175.740 175.236 0.504 1 1 850 . 11 1 1 A 95 95 ILE CA C 95 62.760 62.613 0.147 1 1 851 . 11 1 1 A 95 95 ILE CB C 95 38.890 39.151 -0.261 1 1 855 . 11 1 1 A 95 95 ILE N N 95 126.530 128.041 -1.511 1 1 856 . 11 1 1 A 96 96 GLU H H 96 8.030 7.374 0.656 1 1 857 . 11 1 1 A 96 96 GLU HA H 96 4.450 4.608 -0.158 1 1 862 . 11 1 1 A 96 96 GLU C C 96 174.380 174.188 0.192 1 1 863 . 11 1 1 A 96 96 GLU CA C 96 54.320 55.450 -1.130 1 1 864 . 11 1 1 A 96 96 GLU CB C 96 32.770 33.117 -0.347 1 1 866 . 11 1 1 A 96 96 GLU N N 96 117.080 120.166 -3.086 1 1 867 . 11 1 1 A 97 97 ASP H H 97 8.730 8.759 -0.029 1 1 868 . 11 1 1 A 97 97 ASP HA H 97 4.360 4.550 -0.190 1 1 871 . 11 1 1 A 97 97 ASP C C 97 177.100 176.996 0.104 1 1 872 . 11 1 1 A 97 97 ASP CA C 97 57.160 55.481 1.679 1 1 873 . 11 1 1 A 97 97 ASP CB C 97 39.920 40.473 -0.553 1 1 874 . 11 1 1 A 97 97 ASP N N 97 120.570 120.809 -0.239 1 1 875 . 11 1 1 A 98 98 GLY H H 98 8.760 8.482 0.278 1 1 876 . 11 1 1 A 98 98 GLY HA2 H 98 2.120 1.373 0.747 1 1 877 . 11 1 1 A 98 98 GLY HA3 H 98 3.910 3.343 0.567 1 1 878 . 11 1 1 A 98 98 GLY C C 98 174.000 172.895 1.105 1 1 879 . 11 1 1 A 98 98 GLY CA C 98 45.720 45.221 0.499 1 1 880 . 11 1 1 A 98 98 GLY N N 98 112.090 111.540 0.550 1 1 881 . 11 1 1 A 99 99 LYS H H 99 7.890 7.171 0.719 1 1 882 . 11 1 1 A 99 99 LYS HA H 99 5.330 5.080 0.250 1 1 891 . 11 1 1 A 99 99 LYS C C 99 174.750 174.315 0.435 1 1 892 . 11 1 1 A 99 99 LYS CA C 99 55.990 54.797 1.193 1 1 893 . 11 1 1 A 99 99 LYS CB C 99 37.840 35.444 2.396 1 1 897 . 11 1 1 A 99 99 LYS N N 99 118.050 114.790 3.260 1 1 898 . 11 1 1 A 100 100 VAL H H 100 8.980 8.453 0.527 1 1 899 . 11 1 1 A 100 100 VAL HA H 100 4.510 4.725 -0.215 1 1 907 . 11 1 1 A 100 100 VAL C C 100 174.760 173.668 1.092 1 1 908 . 11 1 1 A 100 100 VAL CA C 100 60.130 58.994 1.136 1 1 909 . 11 1 1 A 100 100 VAL CB C 100 35.240 35.759 -0.519 1 1 912 . 11 1 1 A 100 100 VAL N N 100 123.850 119.684 4.166 1 1 913 . 11 1 1 A 101 101 ARG H H 101 8.810 8.251 0.559 1 1 914 . 11 1 1 A 101 101 ARG HA H 101 4.850 4.753 0.097 1 1 921 . 11 1 1 A 101 101 ARG C C 101 174.770 174.387 0.383 1 1 922 . 11 1 1 A 101 101 ARG CA C 101 54.580 54.760 -0.180 1 1 923 . 11 1 1 A 101 101 ARG CB C 101 32.400 31.577 0.823 1 1 926 . 11 1 1 A 101 101 ARG N N 101 129.210 122.994 6.216 1 1 927 . 11 1 1 A 102 102 VAL H H 102 9.100 7.912 1.188 1 1 928 . 11 1 1 A 102 102 VAL HA H 102 4.120 4.993 -0.873 1 1 936 . 11 1 1 A 102 102 VAL C C 102 171.640 173.521 -1.881 1 1 937 . 11 1 1 A 102 102 VAL CA C 102 61.350 59.176 2.174 1 1 938 . 11 1 1 A 102 102 VAL CB C 102 32.530 35.154 -2.624 1 1 941 . 11 1 1 A 102 102 VAL N N 102 130.470 122.805 7.665 1 1 942 . 11 1 1 A 103 103 LEU H H 103 8.110 9.471 -1.361 1 1 943 . 11 1 1 A 103 103 LEU HA H 103 5.120 4.903 0.217 1 1 953 . 11 1 1 A 103 103 LEU C C 103 176.410 174.837 1.573 1 1 954 . 11 1 1 A 103 103 LEU CA C 103 53.380 53.495 -0.115 1 1 955 . 11 1 1 A 103 103 LEU CB C 103 43.680 43.433 0.247 1 1 959 . 11 1 1 A 103 103 LEU N N 103 125.560 128.375 -2.815 1 1 960 . 11 1 1 A 104 104 VAL H H 104 9.580 8.840 0.740 1 1 961 . 11 1 1 A 104 104 VAL HA H 104 5.260 5.449 -0.189 1 1 969 . 11 1 1 A 104 104 VAL C C 104 176.030 174.412 1.618 1 1 970 . 11 1 1 A 104 104 VAL CA C 104 60.220 59.834 0.386 1 1 971 . 11 1 1 A 104 104 VAL CB C 104 34.310 34.486 -0.176 1 1 974 . 11 1 1 A 104 104 VAL N N 104 125.790 126.157 -0.367 1 1 975 . 11 1 1 A 105 105 SER H H 105 9.340 8.561 0.779 1 1 976 . 11 1 1 A 105 105 SER HA H 105 5.300 5.062 0.238 1 1 979 . 11 1 1 A 105 105 SER C C 105 173.600 173.064 0.536 1 1 980 . 11 1 1 A 105 105 SER CA C 105 57.450 57.312 0.138 1 1 981 . 11 1 1 A 105 105 SER CB C 105 65.600 66.878 -1.278 1 1 982 . 11 1 1 A 105 105 SER N N 105 119.220 123.827 -4.607 1 1 983 . 11 1 1 A 106 106 SER H H 106 8.350 9.071 -0.721 1 1 984 . 11 1 1 A 106 106 SER HA H 106 4.720 4.383 0.337 1 1 987 . 11 1 1 A 106 106 SER C C 106 176.930 174.495 2.435 1 1 988 . 11 1 1 A 106 106 SER CA C 106 58.170 58.886 -0.716 1 1 989 . 11 1 1 A 106 106 SER CB C 106 64.170 62.727 1.443 1 1 990 . 11 1 1 A 106 106 SER N N 106 114.800 119.996 -5.196 1 1 991 . 11 1 1 A 107 107 LEU H H 107 8.770 8.589 0.181 1 1 992 . 11 1 1 A 107 107 LEU HA H 107 4.710 4.137 0.573 1 1 1001 . 11 1 1 A 107 107 LEU C C 107 178.280 178.767 -0.487 1 1 1002 . 11 1 1 A 107 107 LEU CA C 107 55.280 56.998 -1.718 1 1 1003 . 11 1 1 A 107 107 LEU CB C 107 43.410 41.824 1.586 1 1 1007 . 11 1 1 A 107 107 LEU N N 107 127.210 128.367 -1.157 1 1 1008 . 11 1 1 A 108 108 THR H H 108 8.210 7.744 0.466 1 1 1009 . 11 1 1 A 108 108 THR HA H 108 4.400 4.252 0.148 1 1 1015 . 11 1 1 A 108 108 THR C C 108 176.130 175.614 0.516 1 1 1016 . 11 1 1 A 108 108 THR CA C 108 62.050 63.194 -1.144 1 1 1017 . 11 1 1 A 108 108 THR CB C 108 70.910 70.393 0.517 1 1 1019 . 11 1 1 A 108 108 THR N N 108 108.810 110.866 -2.056 1 1 1020 . 11 1 1 A 109 109 GLY H H 109 8.250 7.669 0.581 1 1 1021 . 11 1 1 A 109 109 GLY HA2 H 109 3.780 4.021 -0.241 1 1 1022 . 11 1 1 A 109 109 GLY HA3 H 109 4.290 4.022 0.268 1 1 1023 . 11 1 1 A 109 109 GLY C C 109 173.180 174.320 -1.140 1 1 1024 . 11 1 1 A 109 109 GLY CA C 109 45.340 45.077 0.263 1 1 1025 . 11 1 1 A 109 109 GLY N N 109 110.160 110.685 -0.525 1 1 1026 . 11 1 1 A 110 110 GLU H H 110 7.960 7.477 0.483 1 1 1027 . 11 1 1 A 110 110 GLU HA H 110 4.760 4.562 0.198 1 1 1032 . 11 1 1 A 110 110 GLU CA C 110 53.450 53.335 0.115 1 1 1033 . 11 1 1 A 110 110 GLU CB C 110 30.020 30.177 -0.157 1 1 1035 . 11 1 1 A 110 110 GLU N N 110 119.720 120.919 -1.199 1 1 1036 . 11 1 1 A 111 111 PRO HA H 111 3.250 3.999 -0.749 1 1 1043 . 11 1 1 A 111 111 PRO C C 111 176.710 176.896 -0.186 1 1 1044 . 11 1 1 A 111 111 PRO CA C 111 62.240 62.443 -0.203 1 1 1045 . 11 1 1 A 111 111 PRO CB C 111 31.990 31.432 0.558 1 1 1048 . 11 1 1 A 112 112 LEU H H 112 8.840 8.201 0.639 1 1 1049 . 11 1 1 A 112 112 LEU HA H 112 4.290 4.369 -0.079 1 1 1059 . 11 1 1 A 112 112 LEU CA C 112 52.220 53.331 -1.111 1 1 1060 . 11 1 1 A 112 112 LEU CB C 112 41.090 42.242 -1.152 1 1 1063 . 11 1 1 A 112 112 LEU N N 112 122.420 120.612 1.808 1 1 1064 . 11 1 1 A 113 113 PRO HA H 113 4.380 4.587 -0.207 1 1 1071 . 11 1 1 A 113 113 PRO C C 113 176.100 175.236 0.864 1 1 1072 . 11 1 1 A 113 113 PRO CA C 113 61.930 62.349 -0.419 1 1 1073 . 11 1 1 A 113 113 PRO CB C 113 32.470 33.157 -0.687 1 1 1076 . 11 1 1 A 114 114 ALA H H 114 8.070 8.297 -0.227 1 1 1077 . 11 1 1 A 114 114 ALA HA H 114 4.550 4.597 -0.047 1 1 1081 . 11 1 1 A 114 114 ALA C C 114 177.490 175.754 1.736 1 1 1082 . 11 1 1 A 114 114 ALA CA C 114 51.340 50.901 0.439 1 1 1083 . 11 1 1 A 114 114 ALA CB C 114 19.940 22.529 -2.589 1 1 1084 . 11 1 1 A 114 114 ALA N N 114 121.460 120.543 0.917 1 1 1085 . 11 1 1 A 115 115 LYS H H 115 9.000 8.257 0.743 1 1 1086 . 11 1 1 A 115 115 LYS HA H 115 3.930 3.881 0.049 1 1 1095 . 11 1 1 A 115 115 LYS C C 115 175.740 175.228 0.512 1 1 1096 . 11 1 1 A 115 115 LYS CA C 115 57.580 57.773 -0.193 1 1 1097 . 11 1 1 A 115 115 LYS CB C 115 29.510 30.204 -0.694 1 1 1101 . 11 1 1 A 115 115 LYS N N 115 112.560 115.131 -2.571 1 1 1102 . 11 1 1 A 116 116 GLU H H 116 7.620 7.669 -0.049 1 1 1103 . 11 1 1 A 116 116 GLU HA H 116 4.550 4.939 -0.389 1 1 1108 . 11 1 1 A 116 116 GLU C C 116 176.110 175.144 0.966 1 1 1109 . 11 1 1 A 116 116 GLU CA C 116 54.570 54.349 0.221 1 1 1110 . 11 1 1 A 116 116 GLU CB C 116 33.680 33.328 0.352 1 1 1112 . 11 1 1 A 116 116 GLU N N 116 115.710 118.022 -2.312 1 1 1113 . 11 1 1 A 117 117 VAL H H 117 8.770 8.863 -0.093 1 1 1114 . 11 1 1 A 117 117 VAL HA H 117 3.200 4.086 -0.886 1 1 1122 . 11 1 1 A 117 117 VAL C C 117 175.740 175.464 0.276 1 1 1123 . 11 1 1 A 117 117 VAL CA C 117 65.340 63.004 2.336 1 1 1124 . 11 1 1 A 117 117 VAL CB C 117 31.290 31.065 0.225 1 1 1127 . 11 1 1 A 117 117 VAL N N 117 124.450 120.479 3.971 1 1 1128 . 11 1 1 A 118 118 LEU H H 118 8.550 8.923 -0.373 1 1 1129 . 11 1 1 A 118 118 LEU HA H 118 4.540 4.368 0.172 1 1 1139 . 11 1 1 A 118 118 LEU C C 118 176.210 176.850 -0.640 1 1 1140 . 11 1 1 A 118 118 LEU CA C 118 55.510 55.951 -0.441 1 1 1141 . 11 1 1 A 118 118 LEU CB C 118 44.600 42.495 2.105 1 1 1145 . 11 1 1 A 118 118 LEU N N 118 128.440 129.107 -0.667 1 1 1146 . 11 1 1 A 119 119 ALA H H 119 7.970 7.575 0.395 1 1 1147 . 11 1 1 A 119 119 ALA HA H 119 4.740 4.829 -0.089 1 1 1151 . 11 1 1 A 119 119 ALA C C 119 174.570 175.233 -0.663 1 1 1152 . 11 1 1 A 119 119 ALA CA C 119 50.770 51.789 -1.019 1 1 1153 . 11 1 1 A 119 119 ALA CB C 119 22.450 22.683 -0.233 1 1 1154 . 11 1 1 A 119 119 ALA N N 119 118.100 117.099 1.001 1 1 1155 . 11 1 1 A 120 120 LYS H H 120 8.760 8.835 -0.075 1 1 1156 . 11 1 1 A 120 120 LYS HA H 120 5.240 5.537 -0.297 1 1 1165 . 11 1 1 A 120 120 LYS C C 120 175.340 174.985 0.355 1 1 1166 . 11 1 1 A 120 120 LYS CA C 120 54.220 54.854 -0.634 1 1 1167 . 11 1 1 A 120 120 LYS CB C 120 34.340 34.873 -0.533 1 1 1171 . 11 1 1 A 120 120 LYS N N 120 120.010 122.480 -2.470 1 1 1172 . 11 1 1 A 121 121 VAL H H 121 9.410 8.478 0.932 1 1 1173 . 11 1 1 A 121 121 VAL HA H 121 4.230 4.753 -0.523 1 1 1181 . 11 1 1 A 121 121 VAL C C 121 173.980 174.210 -0.230 1 1 1182 . 11 1 1 A 121 121 VAL CA C 121 62.370 61.435 0.935 1 1 1183 . 11 1 1 A 121 121 VAL CB C 121 32.410 33.515 -1.105 1 1 1186 . 11 1 1 A 121 121 VAL N N 121 124.960 125.699 -0.739 1 1 1187 . 11 1 1 A 122 122 VAL H H 122 9.280 8.919 0.361 1 1 1188 . 11 1 1 A 122 122 VAL HA H 122 4.360 5.115 -0.755 1 1 1196 . 11 1 1 A 122 122 VAL C C 122 174.190 174.612 -0.422 1 1 1197 . 11 1 1 A 122 122 VAL CA C 122 62.760 60.734 2.026 1 1 1198 . 11 1 1 A 122 122 VAL CB C 122 32.020 33.163 -1.143 1 1 1201 . 11 1 1 A 122 122 VAL N N 122 128.990 128.164 0.826 1 1 1202 . 11 1 1 A 123 123 LEU H H 123 8.610 9.001 -0.391 1 1 1203 . 11 1 1 A 123 123 LEU HA H 123 4.900 4.764 0.136 1 1 1213 . 11 1 1 A 123 123 LEU C C 123 174.950 176.187 -1.237 1 1 1214 . 11 1 1 A 123 123 LEU CA C 123 52.050 53.500 -1.450 1 1 1215 . 11 1 1 A 123 123 LEU CB C 123 45.210 42.718 2.492 1 1 1219 . 11 1 1 A 123 123 LEU N N 123 127.200 127.631 -0.431 1 1 1220 . 11 1 1 A 124 124 ARG H H 124 9.540 8.825 0.715 1 1 1221 . 11 1 1 A 124 124 ARG HA H 124 4.900 4.445 0.455 1 1 1229 . 11 1 1 A 124 124 ARG C C 124 176.320 175.741 0.579 1 1 1230 . 11 1 1 A 124 124 ARG CA C 124 55.320 56.770 -1.450 1 1 1231 . 11 1 1 A 124 124 ARG CB C 124 31.750 30.370 1.380 1 1 1234 . 11 1 1 A 124 124 ARG N N 124 124.290 126.160 -1.870 1 1 1236 . 11 1 1 A 125 125 ALA H H 125 8.880 8.696 0.184 1 1 1237 . 11 1 1 A 125 125 ALA HA H 125 4.380 4.030 0.350 1 1 1241 . 11 1 1 A 125 125 ALA C C 125 177.290 177.739 -0.449 1 1 1242 . 11 1 1 A 125 125 ALA CA C 125 52.530 51.431 1.099 1 1 1243 . 11 1 1 A 125 125 ALA CB C 125 19.870 17.545 2.325 1 1 1244 . 11 1 1 A 125 125 ALA N N 125 130.790 129.238 1.552 1 1 1245 . 11 1 1 A 126 126 GLU H H 126 9.260 8.765 0.495 1 1 1246 . 11 1 1 A 126 126 GLU HA H 126 4.460 4.334 0.126 1 1 1251 . 11 1 1 A 126 126 GLU C C 126 176.120 176.032 0.088 1 1 1252 . 11 1 1 A 126 126 GLU CA C 126 56.940 57.042 -0.102 1 1 1253 . 11 1 1 A 126 126 GLU CB C 126 32.450 30.092 2.358 1 1 1255 . 11 1 1 A 126 126 GLU N N 126 125.740 123.622 2.118 1 1 1256 . 11 1 1 A 127 127 ALA H H 127 7.460 7.493 -0.033 1 1 1257 . 11 1 1 A 127 127 ALA HA H 127 4.360 4.596 -0.236 1 1 1261 . 11 1 1 A 127 127 ALA C C 127 173.400 175.830 -2.430 1 1 1262 . 11 1 1 A 127 127 ALA CA C 127 51.360 51.686 -0.326 1 1 1263 . 11 1 1 A 127 127 ALA CB C 127 22.180 21.869 0.311 1 1 1264 . 11 1 1 A 127 127 ALA N N 127 120.910 119.607 1.303 1 1 1265 . 11 1 1 A 128 128 LYS H H 128 7.940 8.683 -0.743 1 1 1266 . 11 1 1 A 128 128 LYS HA H 128 3.580 4.094 -0.514 1 1 1275 . 11 1 1 A 128 128 LYS C C 128 176.080 175.851 0.229 1 1 1276 . 11 1 1 A 128 128 LYS CA C 128 56.860 57.174 -0.314 1 1 1277 . 11 1 1 A 128 128 LYS CB C 128 33.170 33.244 -0.074 1 1 1281 . 11 1 1 A 128 128 LYS N N 128 116.520 124.466 -7.946 1 1 1282 . 11 1 1 A 129 129 ALA H H 129 8.590 8.563 0.027 1 1 1283 . 11 1 1 A 129 129 ALA HA H 129 4.390 4.693 -0.303 1 1 1287 . 11 1 1 A 129 129 ALA C C 129 174.970 176.428 -1.458 1 1 1288 . 11 1 1 A 129 129 ALA CA C 129 52.970 51.017 1.953 1 1 1289 . 11 1 1 A 129 129 ALA CB C 129 21.500 19.339 2.161 1 1 1290 . 11 1 1 A 129 129 ALA N N 129 124.710 128.605 -3.895 1 1 1291 . 11 1 1 A 130 130 GLU H H 130 8.660 8.223 0.437 1 1 1292 . 11 1 1 A 130 130 GLU HA H 130 4.660 3.981 0.679 1 1 1297 . 11 1 1 A 130 130 GLU C C 130 177.390 177.617 -0.227 1 1 1298 . 11 1 1 A 130 130 GLU CA C 130 55.070 58.515 -3.445 1 1 1299 . 11 1 1 A 130 130 GLU CB C 130 30.860 29.224 1.636 1 1 1301 . 11 1 1 A 130 130 GLU N N 130 123.180 122.870 0.310 1 1 1302 . 11 1 1 A 131 131 GLY H H 131 9.170 9.150 0.020 1 1 1303 . 11 1 1 A 131 131 GLY HA2 H 131 3.560 4.008 -0.448 1 1 1304 . 11 1 1 A 131 131 GLY HA3 H 131 3.750 4.015 -0.265 1 1 1305 . 11 1 1 A 131 131 GLY C C 131 174.550 174.720 -0.170 1 1 1306 . 11 1 1 A 131 131 GLY CA C 131 47.660 45.475 2.185 1 1 1307 . 11 1 1 A 131 131 GLY N N 131 115.530 115.911 -0.381 1 1 1308 . 11 1 1 A 132 132 SER H H 132 8.430 8.212 0.218 1 1 1309 . 11 1 1 A 132 132 SER HA H 132 4.170 4.661 -0.491 1 1 1312 . 11 1 1 A 132 132 SER C C 132 175.350 174.133 1.217 1 1 1313 . 11 1 1 A 132 132 SER CA C 132 59.050 57.629 1.421 1 1 1314 . 11 1 1 A 132 132 SER CB C 132 64.880 62.022 2.858 1 1 1315 . 11 1 1 A 132 132 SER N N 132 115.930 118.598 -2.668 1 1 1316 . 11 1 1 A 133 133 ASN H H 133 8.850 9.064 -0.214 1 1 1317 . 11 1 1 A 133 133 ASN HA H 133 4.910 5.162 -0.252 1 1 1322 . 11 1 1 A 133 133 ASN C C 133 175.450 174.605 0.845 1 1 1323 . 11 1 1 A 133 133 ASN CA C 133 54.920 53.934 0.986 1 1 1324 . 11 1 1 A 133 133 ASN CB C 133 41.060 39.008 2.052 1 1 1325 . 11 1 1 A 133 133 ASN N N 133 125.590 122.618 2.972 1 1 1327 . 11 1 1 A 134 134 LEU H H 134 9.070 9.733 -0.663 1 1 1328 . 11 1 1 A 134 134 LEU HA H 134 5.230 5.320 -0.090 1 1 1338 . 11 1 1 A 134 134 LEU C C 134 175.240 175.211 0.029 1 1 1339 . 11 1 1 A 134 134 LEU CA C 134 53.470 53.387 0.083 1 1 1340 . 11 1 1 A 134 134 LEU CB C 134 45.090 43.414 1.676 1 1 1344 . 11 1 1 A 134 134 LEU N N 134 129.210 126.927 2.283 1 1 1345 . 11 1 1 A 135 135 SER H H 135 8.690 8.972 -0.282 1 1 1346 . 11 1 1 A 135 135 SER HA H 135 5.280 5.566 -0.286 1 1 1349 . 11 1 1 A 135 135 SER C C 135 173.590 173.691 -0.101 1 1 1350 . 11 1 1 A 135 135 SER CA C 135 56.220 56.539 -0.319 1 1 1351 . 11 1 1 A 135 135 SER CB C 135 66.510 64.951 1.559 1 1 1352 . 11 1 1 A 135 135 SER N N 135 113.020 119.395 -6.375 1 1 1353 . 11 1 1 A 136 136 VAL H H 136 8.940 8.764 0.176 1 1 1354 . 11 1 1 A 136 136 VAL HA H 136 5.500 5.061 0.439 1 1 1362 . 11 1 1 A 136 136 VAL C C 136 175.730 175.387 0.343 1 1 1363 . 11 1 1 A 136 136 VAL CA C 136 60.960 61.073 -0.113 1 1 1364 . 11 1 1 A 136 136 VAL CB C 136 33.630 32.973 0.657 1 1 1367 . 11 1 1 A 136 136 VAL N N 136 124.340 118.721 5.619 1 1 1368 . 11 1 1 A 137 137 THR H H 137 9.240 8.551 0.689 1 1 1369 . 11 1 1 A 137 137 THR HA H 137 4.920 4.763 0.157 1 1 1374 . 11 1 1 A 137 137 THR C C 137 173.500 174.104 -0.604 1 1 1375 . 11 1 1 A 137 137 THR CA C 137 59.120 60.348 -1.228 1 1 1376 . 11 1 1 A 137 137 THR CB C 137 72.500 70.659 1.841 1 1 1378 . 11 1 1 A 137 137 THR N N 137 117.010 118.131 -1.121 1 1 1379 . 11 1 1 A 138 138 ASN H H 138 9.190 8.844 0.346 1 1 1380 . 11 1 1 A 138 138 ASN HA H 138 4.420 4.262 0.158 1 1 1385 . 11 1 1 A 138 138 ASN C C 138 175.550 174.317 1.233 1 1 1386 . 11 1 1 A 138 138 ASN CA C 138 54.350 54.250 0.100 1 1 1387 . 11 1 1 A 138 138 ASN CB C 138 37.380 36.491 0.889 1 1 1388 . 11 1 1 A 138 138 ASN N N 138 115.270 118.761 -3.491 1 1 1390 . 11 1 1 A 139 139 SER H H 139 8.560 7.940 0.620 1 1 1391 . 11 1 1 A 139 139 SER HA H 139 5.800 4.329 1.471 1 1 1394 . 11 1 1 A 139 139 SER C C 139 175.750 174.246 1.504 1 1 1395 . 11 1 1 A 139 139 SER CA C 139 56.020 60.426 -4.406 1 1 1396 . 11 1 1 A 139 139 SER CB C 139 65.320 63.753 1.567 1 1 1397 . 11 1 1 A 139 139 SER N N 139 112.360 114.850 -2.490 1 1 1398 . 11 1 1 A 140 140 SER H H 140 9.900 8.487 1.413 1 1 1399 . 11 1 1 A 140 140 SER HA H 140 5.360 5.454 -0.094 1 1 1402 . 11 1 1 A 140 140 SER C C 140 172.620 172.753 -0.133 1 1 1403 . 11 1 1 A 140 140 SER CA C 140 57.400 57.114 0.286 1 1 1404 . 11 1 1 A 140 140 SER CB C 140 66.550 66.553 -0.003 1 1 1405 . 11 1 1 A 140 140 SER N N 140 119.130 122.962 -3.832 1 1 1406 . 11 1 1 A 141 141 VAL H H 141 9.030 8.825 0.205 1 1 1407 . 11 1 1 A 141 141 VAL HA H 141 5.520 4.987 0.533 1 1 1415 . 11 1 1 A 141 141 VAL C C 141 174.750 174.716 0.034 1 1 1416 . 11 1 1 A 141 141 VAL CA C 141 58.310 59.919 -1.609 1 1 1417 . 11 1 1 A 141 141 VAL CB C 141 35.030 35.645 -0.615 1 1 1420 . 11 1 1 A 141 141 VAL N N 141 111.410 117.004 -5.594 1 1 1421 . 11 1 1 A 142 142 GLY H H 142 8.790 9.262 -0.472 1 1 1422 . 11 1 1 A 142 142 GLY HA2 H 142 3.600 4.025 -0.425 1 1 1423 . 11 1 1 A 142 142 GLY HA3 H 142 5.310 4.057 1.253 1 1 1424 . 11 1 1 A 142 142 GLY C C 142 174.180 173.387 0.793 1 1 1425 . 11 1 1 A 142 142 GLY CA C 142 44.110 45.927 -1.817 1 1 1426 . 11 1 1 A 142 142 GLY N N 142 109.330 111.557 -2.227 1 1 1427 . 11 1 1 A 143 143 ASP H H 143 8.840 9.081 -0.241 1 1 1428 . 11 1 1 A 143 143 ASP HA H 143 5.790 4.989 0.801 1 1 1431 . 11 1 1 A 143 143 ASP C C 143 178.860 177.816 1.044 1 1 1432 . 11 1 1 A 143 143 ASP CA C 143 53.040 54.613 -1.573 1 1 1433 . 11 1 1 A 143 143 ASP CB C 143 43.660 42.476 1.184 1 1 1434 . 11 1 1 A 143 143 ASP N N 143 125.390 126.640 -1.250 1 1 1435 . 11 1 1 A 144 144 GLY H H 144 9.150 8.536 0.614 1 1 1436 . 11 1 1 A 144 144 GLY HA2 H 144 3.450 2.558 0.892 1 1 1437 . 11 1 1 A 144 144 GLY HA3 H 144 3.720 3.460 0.260 1 1 1438 . 11 1 1 A 144 144 GLY C C 144 174.770 175.973 -1.203 1 1 1439 . 11 1 1 A 144 144 GLY CA C 144 46.930 46.400 0.530 1 1 1440 . 11 1 1 A 144 144 GLY N N 144 106.470 109.510 -3.040 1 1 1441 . 11 1 1 A 145 145 GLU H H 145 8.470 7.671 0.799 1 1 1442 . 11 1 1 A 145 145 GLU HA H 145 4.460 4.215 0.245 1 1 1447 . 11 1 1 A 145 145 GLU C C 145 176.520 176.127 0.393 1 1 1448 . 11 1 1 A 145 145 GLU CA C 145 55.330 56.802 -1.472 1 1 1449 . 11 1 1 A 145 145 GLU CB C 145 30.620 30.136 0.484 1 1 1451 . 11 1 1 A 145 145 GLU N N 145 119.170 119.374 -0.204 1 1 1452 . 11 1 1 A 146 146 GLY H H 146 7.950 7.718 0.232 1 1 1453 . 11 1 1 A 146 146 GLY HA2 H 146 3.630 3.977 -0.347 1 1 1454 . 11 1 1 A 146 146 GLY HA3 H 146 4.130 3.993 0.137 1 1 1455 . 11 1 1 A 146 146 GLY C C 146 174.350 174.802 -0.452 1 1 1456 . 11 1 1 A 146 146 GLY CA C 146 45.330 45.310 0.020 1 1 1457 . 11 1 1 A 146 146 GLY N N 146 108.130 106.237 1.893 1 1 1458 . 11 1 1 A 147 147 LEU H H 147 8.440 7.872 0.568 1 1 1459 . 11 1 1 A 147 147 LEU HA H 147 4.340 4.417 -0.077 1 1 1469 . 11 1 1 A 147 147 LEU C C 147 175.950 175.637 0.313 1 1 1470 . 11 1 1 A 147 147 LEU CA C 147 54.860 54.517 0.343 1 1 1471 . 11 1 1 A 147 147 LEU CB C 147 41.590 42.257 -0.667 1 1 1475 . 11 1 1 A 147 147 LEU N N 147 124.000 122.064 1.936 1 1 1476 . 11 1 1 A 148 148 VAL H H 148 7.780 8.477 -0.697 1 1 1477 . 11 1 1 A 148 148 VAL HA H 148 4.830 5.320 -0.490 1 1 1485 . 11 1 1 A 148 148 VAL C C 148 175.740 173.679 2.061 1 1 1486 . 11 1 1 A 148 148 VAL CA C 148 61.140 59.370 1.770 1 1 1487 . 11 1 1 A 148 148 VAL CB C 148 33.640 34.428 -0.788 1 1 1490 . 11 1 1 A 148 148 VAL N N 148 120.440 119.961 0.479 1 1 1491 . 11 1 1 A 149 149 HIS H H 149 9.170 8.772 0.398 1 1 1492 . 11 1 1 A 149 149 HIS HA H 149 4.950 4.954 -0.004 1 1 1496 . 11 1 1 A 149 149 HIS C C 149 174.780 174.855 -0.075 1 1 1497 . 11 1 1 A 149 149 HIS CA C 149 53.900 54.505 -0.605 1 1 1498 . 11 1 1 A 149 149 HIS CB C 149 32.200 29.856 2.344 1 1 1499 . 11 1 1 A 149 149 HIS N N 149 124.700 127.175 -2.475 1 1 1500 . 11 1 1 A 150 150 GLU H H 150 9.060 8.513 0.547 1 1 1501 . 11 1 1 A 150 150 GLU HA H 150 4.420 4.275 0.145 1 1 1506 . 11 1 1 A 150 150 GLU C C 150 176.520 176.742 -0.222 1 1 1507 . 11 1 1 A 150 150 GLU CA C 150 57.630 57.039 0.591 1 1 1508 . 11 1 1 A 150 150 GLU CB C 150 30.370 29.856 0.514 1 1 1510 . 11 1 1 A 150 150 GLU N N 150 125.540 124.056 1.484 1 1 1511 . 11 1 1 A 151 151 ILE H H 151 8.150 8.559 -0.409 1 1 1512 . 11 1 1 A 151 151 ILE HA H 151 4.780 4.509 0.271 1 1 1522 . 11 1 1 A 151 151 ILE C C 151 174.570 176.306 -1.736 1 1 1523 . 11 1 1 A 151 151 ILE CA C 151 59.390 59.620 -0.230 1 1 1524 . 11 1 1 A 151 151 ILE CB C 151 42.040 39.939 2.101 1 1 1528 . 11 1 1 A 151 151 ILE N N 151 115.880 123.029 -7.149 1 1 1529 . 11 1 1 A 152 152 ALA H H 152 8.010 8.448 -0.438 1 1 1530 . 11 1 1 A 152 152 ALA HA H 152 4.310 4.391 -0.081 1 1 1534 . 11 1 1 A 152 152 ALA C C 152 177.500 176.650 0.850 1 1 1535 . 11 1 1 A 152 152 ALA CA C 152 53.680 51.730 1.950 1 1 1536 . 11 1 1 A 152 152 ALA CB C 152 20.050 19.641 0.409 1 1 1537 . 11 1 1 A 152 152 ALA N N 152 126.640 124.546 2.094 1 1 1538 . 11 1 1 A 153 153 GLY H H 153 8.340 8.359 -0.019 1 1 1539 . 11 1 1 A 153 153 GLY HA2 H 153 4.050 4.318 -0.268 1 1 1540 . 11 1 1 A 153 153 GLY HA3 H 153 4.140 4.326 -0.186 1 1 1541 . 11 1 1 A 153 153 GLY C C 153 173.140 171.515 1.625 1 1 1542 . 11 1 1 A 153 153 GLY CA C 153 44.130 45.780 -1.650 1 1 1543 . 11 1 1 A 153 153 GLY N N 153 107.490 105.485 2.005 1 1 1544 . 11 1 1 A 154 154 THR H H 154 7.380 8.421 -1.041 1 1 1545 . 11 1 1 A 154 154 THR HA H 154 4.700 5.086 -0.386 1 1 1550 . 11 1 1 A 154 154 THR C C 154 171.120 173.821 -2.701 1 1 1551 . 11 1 1 A 154 154 THR CA C 154 60.830 61.108 -0.278 1 1 1552 . 11 1 1 A 154 154 THR CB C 154 68.850 72.385 -3.535 1 1 1554 . 11 1 1 A 154 154 THR N N 154 109.340 114.445 -5.105 1 1 1555 . 11 1 1 A 155 155 GLU H H 155 8.020 8.707 -0.687 1 1 1556 . 11 1 1 A 155 155 GLU HA H 155 5.370 5.620 -0.250 1 1 1561 . 11 1 1 A 155 155 GLU C C 155 174.240 174.466 -0.226 1 1 1562 . 11 1 1 A 155 155 GLU CA C 155 54.830 54.575 0.255 1 1 1563 . 11 1 1 A 155 155 GLU CB C 155 33.620 33.208 0.412 1 1 1565 . 11 1 1 A 155 155 GLU N N 155 118.690 122.687 -3.997 1 1 1566 . 11 1 1 A 156 156 LYS H H 156 9.230 9.323 -0.093 1 1 1567 . 11 1 1 A 156 156 LYS HA H 156 4.650 5.002 -0.352 1 1 1576 . 11 1 1 A 156 156 LYS C C 156 174.000 174.541 -0.541 1 1 1577 . 11 1 1 A 156 156 LYS CA C 156 55.840 55.088 0.752 1 1 1578 . 11 1 1 A 156 156 LYS CB C 156 37.550 36.552 0.998 1 1 1582 . 11 1 1 A 156 156 LYS N N 156 121.940 120.536 1.404 1 1 1583 . 11 1 1 A 157 157 THR H H 157 8.160 8.672 -0.512 1 1 1584 . 11 1 1 A 157 157 THR HA H 157 5.440 5.134 0.306 1 1 1589 . 11 1 1 A 157 157 THR C C 157 174.360 173.538 0.822 1 1 1590 . 11 1 1 A 157 157 THR CA C 157 60.410 60.711 -0.301 1 1 1591 . 11 1 1 A 157 157 THR CB C 157 71.500 71.172 0.328 1 1 1593 . 11 1 1 A 157 157 THR N N 157 113.240 112.918 0.322 1 1 1594 . 11 1 1 A 158 158 VAL H H 158 9.120 9.078 0.042 1 1 1595 . 11 1 1 A 158 158 VAL HA H 158 4.580 5.373 -0.793 1 1 1603 . 11 1 1 A 158 158 VAL C C 158 172.800 174.837 -2.037 1 1 1604 . 11 1 1 A 158 158 VAL CA C 158 59.980 60.287 -0.307 1 1 1605 . 11 1 1 A 158 158 VAL CB C 158 36.290 34.221 2.069 1 1 1608 . 11 1 1 A 158 158 VAL N N 158 121.710 122.091 -0.381 1 1 1609 . 11 1 1 A 159 159 ASN H H 159 8.240 8.796 -0.556 1 1 1610 . 11 1 1 A 159 159 ASN HA H 159 5.420 5.028 0.392 1 1 1615 . 11 1 1 A 159 159 ASN C C 159 173.800 174.123 -0.323 1 1 1616 . 11 1 1 A 159 159 ASN CA C 159 51.740 52.476 -0.736 1 1 1617 . 11 1 1 A 159 159 ASN CB C 159 40.380 39.207 1.173 1 1 1618 . 11 1 1 A 159 159 ASN N N 159 122.730 124.481 -1.751 1 1 1620 . 11 1 1 A 160 160 ILE H H 160 9.160 8.588 0.572 1 1 1621 . 11 1 1 A 160 160 ILE HA H 160 5.130 4.836 0.294 1 1 1631 . 11 1 1 A 160 160 ILE C C 160 177.320 175.557 1.763 1 1 1632 . 11 1 1 A 160 160 ILE CA C 160 60.640 61.066 -0.426 1 1 1633 . 11 1 1 A 160 160 ILE CB C 160 38.520 37.603 0.917 1 1 1637 . 11 1 1 A 160 160 ILE N N 160 123.690 125.507 -1.817 1 1 1638 . 11 1 1 A 161 161 ILE H H 161 8.780 9.012 -0.232 1 1 1639 . 11 1 1 A 161 161 ILE HA H 161 4.590 4.528 0.062 1 1 1649 . 11 1 1 A 161 161 ILE C C 161 174.960 175.824 -0.864 1 1 1650 . 11 1 1 A 161 161 ILE CA C 161 59.320 60.337 -1.017 1 1 1651 . 11 1 1 A 161 161 ILE CB C 161 41.030 39.518 1.512 1 1 1655 . 11 1 1 A 161 161 ILE N N 161 122.490 129.464 -6.974 1 1 1656 . 11 1 1 A 162 162 GLU H H 162 8.620 8.552 0.068 1 1 1657 . 11 1 1 A 162 162 GLU HA H 162 4.290 4.343 -0.053 1 1 1662 . 11 1 1 A 162 162 GLU C C 162 176.660 176.459 0.201 1 1 1663 . 11 1 1 A 162 162 GLU CA C 162 56.470 57.391 -0.921 1 1 1664 . 11 1 1 A 162 162 GLU CB C 162 31.150 30.541 0.609 1 1 1666 . 11 1 1 A 162 162 GLU N N 162 120.520 126.717 -6.197 1 1 1667 . 11 1 1 A 163 163 GLY H H 163 8.480 8.331 0.149 1 1 1668 . 11 1 1 A 163 163 GLY HA2 H 163 3.910 4.164 -0.254 1 1 1669 . 11 1 1 A 163 163 GLY HA3 H 163 4.150 4.165 -0.015 1 1 1670 . 11 1 1 A 163 163 GLY C C 163 174.000 173.139 0.861 1 1 1671 . 11 1 1 A 163 163 GLY CA C 163 45.270 44.490 0.780 1 1 1672 . 11 1 1 A 163 163 GLY N N 163 110.210 109.124 1.086 1 1 1673 . 11 1 1 A 164 164 THR H H 164 8.170 8.608 -0.438 1 1 1674 . 11 1 1 A 164 164 THR HA H 164 4.410 4.383 0.027 1 1 1679 . 11 1 1 A 164 164 THR C C 164 174.100 174.256 -0.156 1 1 1680 . 11 1 1 A 164 164 THR CA C 164 61.620 62.264 -0.644 1 1 1681 . 11 1 1 A 164 164 THR CB C 164 70.060 69.641 0.419 1 1 1683 . 11 1 1 A 164 164 THR N N 164 113.480 116.671 -3.191 1 1 1 . 12 1 1 A 13 13 GLY H H 13 8.350 8.694 -0.344 1 1 2 . 12 1 1 A 13 13 GLY HA2 H 13 3.920 3.904 0.016 1 1 3 . 12 1 1 A 13 13 GLY HA3 H 13 3.920 3.905 0.015 1 1 4 . 12 1 1 A 13 13 GLY CA C 13 45.290 47.238 -1.948 1 1 5 . 12 1 1 A 13 13 GLY N N 13 110.450 108.987 1.463 1 1 6 . 12 1 1 A 14 14 LEU H H 14 8.050 7.678 0.372 1 1 7 . 12 1 1 A 14 14 LEU N N 14 121.500 121.885 -0.385 1 1 8 . 12 1 1 A 15 15 VAL H H 15 8.070 8.519 -0.449 1 1 9 . 12 1 1 A 15 15 VAL N N 15 122.390 124.187 -1.797 1 1 10 . 12 1 1 A 16 16 PRO HA H 16 4.360 4.482 -0.122 1 1 17 . 12 1 1 A 16 16 PRO CA C 16 62.770 63.156 -0.386 1 1 18 . 12 1 1 A 16 16 PRO CB C 16 32.020 32.547 -0.527 1 1 21 . 12 1 1 A 21 21 MET H H 21 8.180 8.898 -0.718 1 1 22 . 12 1 1 A 21 21 MET N N 21 121.310 125.640 -4.330 1 1 23 . 12 1 1 A 22 22 ALA H H 22 8.290 7.983 0.307 1 1 24 . 12 1 1 A 22 22 ALA N N 22 124.800 120.638 4.162 1 1 25 . 12 1 1 A 23 23 SER H H 23 8.210 7.714 0.496 1 1 26 . 12 1 1 A 23 23 SER N N 23 114.830 111.275 3.555 1 1 27 . 12 1 1 A 24 24 LYS H H 24 8.250 7.931 0.319 1 1 28 . 12 1 1 A 24 24 LYS N N 24 122.980 120.227 2.753 1 1 29 . 12 1 1 A 25 25 LEU H H 25 8.140 7.125 1.015 1 1 30 . 12 1 1 A 25 25 LEU HA H 25 4.290 4.279 0.011 1 1 40 . 12 1 1 A 25 25 LEU C C 25 177.410 178.009 -0.599 1 1 41 . 12 1 1 A 25 25 LEU CA C 25 55.430 54.722 0.708 1 1 42 . 12 1 1 A 25 25 LEU CB C 25 42.350 42.564 -0.214 1 1 46 . 12 1 1 A 25 25 LEU N N 25 122.580 122.421 0.159 1 1 47 . 12 1 1 A 26 26 LYS H H 26 8.200 8.622 -0.422 1 1 48 . 12 1 1 A 26 26 LYS HA H 26 4.260 4.184 0.076 1 1 57 . 12 1 1 A 26 26 LYS C C 26 176.520 176.535 -0.015 1 1 58 . 12 1 1 A 26 26 LYS CA C 26 56.700 58.096 -1.396 1 1 59 . 12 1 1 A 26 26 LYS CB C 26 33.060 32.997 0.063 1 1 63 . 12 1 1 A 26 26 LYS N N 26 121.800 120.573 1.227 1 1 64 . 12 1 1 A 27 27 GLU H H 27 8.380 7.803 0.577 1 1 65 . 12 1 1 A 27 27 GLU HA H 27 4.240 4.795 -0.555 1 1 70 . 12 1 1 A 27 27 GLU C C 27 176.130 174.355 1.775 1 1 71 . 12 1 1 A 27 27 GLU CA C 27 56.700 55.547 1.153 1 1 72 . 12 1 1 A 27 27 GLU CB C 27 30.370 33.096 -2.726 1 1 74 . 12 1 1 A 27 27 GLU N N 27 121.700 117.449 4.251 1 1 75 . 12 1 1 A 28 28 ALA H H 28 8.230 8.349 -0.119 1 1 76 . 12 1 1 A 28 28 ALA HA H 28 4.280 4.614 -0.334 1 1 80 . 12 1 1 A 28 28 ALA C C 28 177.090 177.247 -0.157 1 1 81 . 12 1 1 A 28 28 ALA CA C 28 52.530 51.144 1.386 1 1 82 . 12 1 1 A 28 28 ALA CB C 28 19.360 19.645 -0.285 1 1 83 . 12 1 1 A 28 28 ALA N N 28 124.640 124.857 -0.217 1 1 84 . 12 1 1 A 29 29 ALA H H 29 8.150 8.092 0.058 1 1 85 . 12 1 1 A 29 29 ALA HA H 29 4.320 3.940 0.380 1 1 89 . 12 1 1 A 29 29 ALA C C 29 177.120 176.501 0.619 1 1 90 . 12 1 1 A 29 29 ALA CA C 29 52.040 53.187 -1.147 1 1 91 . 12 1 1 A 29 29 ALA CB C 29 19.430 17.076 2.354 1 1 92 . 12 1 1 A 29 29 ALA N N 29 123.430 117.422 6.008 1 1 93 . 12 1 1 A 30 30 GLU H H 30 8.310 7.803 0.507 1 1 94 . 12 1 1 A 30 30 GLU HA H 30 4.220 4.438 -0.218 1 1 99 . 12 1 1 A 30 30 GLU C C 30 176.310 176.320 -0.010 1 1 100 . 12 1 1 A 30 30 GLU CA C 30 56.630 56.616 0.014 1 1 101 . 12 1 1 A 30 30 GLU CB C 30 30.320 29.553 0.767 1 1 103 . 12 1 1 A 30 30 GLU N N 30 120.630 114.980 5.650 1 1 104 . 12 1 1 A 31 31 VAL H H 31 8.630 8.795 -0.165 1 1 105 . 12 1 1 A 31 31 VAL HA H 31 4.430 4.876 -0.446 1 1 113 . 12 1 1 A 31 31 VAL C C 31 176.510 176.721 -0.211 1 1 114 . 12 1 1 A 31 31 VAL CA C 31 62.360 63.147 -0.787 1 1 115 . 12 1 1 A 31 31 VAL CB C 31 32.370 31.897 0.473 1 1 118 . 12 1 1 A 31 31 VAL N N 31 127.110 125.325 1.785 1 1 119 . 12 1 1 A 32 32 THR H H 32 7.640 8.748 -1.108 1 1 120 . 12 1 1 A 32 32 THR HA H 32 4.870 3.930 0.940 1 1 125 . 12 1 1 A 32 32 THR C C 32 172.220 174.785 -2.565 1 1 126 . 12 1 1 A 32 32 THR CA C 32 59.510 64.841 -5.331 1 1 127 . 12 1 1 A 32 32 THR CB C 32 71.630 69.925 1.705 1 1 129 . 12 1 1 A 32 32 THR N N 32 118.860 121.373 -2.513 1 1 130 . 12 1 1 A 33 33 GLY H H 33 8.350 7.937 0.413 1 1 131 . 12 1 1 A 33 33 GLY HA2 H 33 4.160 3.962 0.198 1 1 132 . 12 1 1 A 33 33 GLY HA3 H 33 4.250 3.972 0.278 1 1 133 . 12 1 1 A 33 33 GLY C C 33 172.820 173.098 -0.278 1 1 134 . 12 1 1 A 33 33 GLY CA C 33 46.680 46.152 0.528 1 1 135 . 12 1 1 A 33 33 GLY N N 33 106.720 109.219 -2.499 1 1 136 . 12 1 1 A 34 34 SER H H 34 8.810 8.134 0.676 1 1 137 . 12 1 1 A 34 34 SER HA H 34 5.390 4.940 0.450 1 1 140 . 12 1 1 A 34 34 SER C C 34 173.780 172.875 0.905 1 1 141 . 12 1 1 A 34 34 SER CA C 34 57.380 57.433 -0.053 1 1 142 . 12 1 1 A 34 34 SER CB C 34 65.730 65.660 0.070 1 1 143 . 12 1 1 A 34 34 SER N N 34 112.690 119.684 -6.994 1 1 144 . 12 1 1 A 35 35 VAL H H 35 8.470 8.745 -0.275 1 1 145 . 12 1 1 A 35 35 VAL HA H 35 4.120 4.904 -0.784 1 1 153 . 12 1 1 A 35 35 VAL C C 35 174.750 174.458 0.292 1 1 154 . 12 1 1 A 35 35 VAL CA C 35 62.310 60.806 1.504 1 1 155 . 12 1 1 A 35 35 VAL CB C 35 34.550 33.184 1.366 1 1 158 . 12 1 1 A 35 35 VAL N N 35 123.150 121.652 1.498 1 1 159 . 12 1 1 A 36 36 SER H H 36 8.240 8.760 -0.520 1 1 160 . 12 1 1 A 36 36 SER HA H 36 4.690 4.862 -0.172 1 1 163 . 12 1 1 A 36 36 SER C C 36 171.860 172.921 -1.061 1 1 164 . 12 1 1 A 36 36 SER CA C 36 56.020 56.542 -0.522 1 1 165 . 12 1 1 A 36 36 SER CB C 36 66.050 64.454 1.596 1 1 166 . 12 1 1 A 36 36 SER N N 36 118.760 119.748 -0.988 1 1 167 . 12 1 1 A 37 37 LEU H H 37 8.310 8.959 -0.649 1 1 168 . 12 1 1 A 37 37 LEU HA H 37 4.870 4.806 0.064 1 1 178 . 12 1 1 A 37 37 LEU C C 37 174.190 175.596 -1.406 1 1 179 . 12 1 1 A 37 37 LEU CA C 37 53.870 53.876 -0.006 1 1 180 . 12 1 1 A 37 37 LEU CB C 37 47.000 42.026 4.974 1 1 184 . 12 1 1 A 37 37 LEU N N 37 124.790 128.681 -3.891 1 1 185 . 12 1 1 A 38 38 GLU H H 38 9.270 8.858 0.412 1 1 186 . 12 1 1 A 38 38 GLU HA H 38 4.650 4.979 -0.329 1 1 191 . 12 1 1 A 38 38 GLU C C 38 173.970 175.224 -1.254 1 1 192 . 12 1 1 A 38 38 GLU CA C 38 54.410 55.906 -1.496 1 1 193 . 12 1 1 A 38 38 GLU CB C 38 32.460 32.099 0.361 1 1 195 . 12 1 1 A 38 38 GLU N N 38 126.550 127.037 -0.487 1 1 196 . 12 1 1 A 39 39 ALA H H 39 8.120 8.523 -0.403 1 1 197 . 12 1 1 A 39 39 ALA HA H 39 4.600 4.720 -0.120 1 1 201 . 12 1 1 A 39 39 ALA C C 39 175.930 177.031 -1.101 1 1 202 . 12 1 1 A 39 39 ALA CA C 39 51.570 50.630 0.940 1 1 203 . 12 1 1 A 39 39 ALA CB C 39 21.780 22.971 -1.191 1 1 204 . 12 1 1 A 39 39 ALA N N 39 124.410 128.844 -4.434 1 1 205 . 12 1 1 A 40 40 LEU H H 40 7.860 9.036 -1.176 1 1 206 . 12 1 1 A 40 40 LEU HA H 40 4.230 3.973 0.257 1 1 216 . 12 1 1 A 40 40 LEU C C 40 175.940 176.616 -0.676 1 1 217 . 12 1 1 A 40 40 LEU CA C 40 55.360 57.167 -1.807 1 1 218 . 12 1 1 A 40 40 LEU CB C 40 42.990 42.056 0.934 1 1 222 . 12 1 1 A 40 40 LEU N N 40 120.640 121.502 -0.862 1 1 223 . 12 1 1 A 41 41 GLU H H 41 8.210 7.878 0.332 1 1 224 . 12 1 1 A 41 41 GLU HA H 41 4.240 4.029 0.211 1 1 229 . 12 1 1 A 41 41 GLU C C 41 176.920 174.812 2.108 1 1 230 . 12 1 1 A 41 41 GLU CA C 41 58.090 57.809 0.281 1 1 231 . 12 1 1 A 41 41 GLU CB C 41 30.530 27.218 3.312 1 1 233 . 12 1 1 A 41 41 GLU N N 41 114.680 116.555 -1.875 1 1 234 . 12 1 1 A 42 42 GLU H H 42 7.490 7.752 -0.262 1 1 235 . 12 1 1 A 42 42 GLU HA H 42 5.680 4.778 0.902 1 1 240 . 12 1 1 A 42 42 GLU C C 42 173.790 174.145 -0.355 1 1 241 . 12 1 1 A 42 42 GLU CA C 42 54.360 56.087 -1.727 1 1 242 . 12 1 1 A 42 42 GLU CB C 42 33.850 33.270 0.580 1 1 244 . 12 1 1 A 42 42 GLU N N 42 116.670 118.244 -1.574 1 1 245 . 12 1 1 A 43 43 VAL H H 43 8.550 8.962 -0.412 1 1 246 . 12 1 1 A 43 43 VAL HA H 43 4.550 4.661 -0.111 1 1 254 . 12 1 1 A 43 43 VAL C C 43 172.220 173.659 -1.439 1 1 255 . 12 1 1 A 43 43 VAL CA C 43 59.470 60.426 -0.956 1 1 256 . 12 1 1 A 43 43 VAL CB C 43 35.470 34.669 0.801 1 1 259 . 12 1 1 A 43 43 VAL N N 43 120.030 125.065 -5.035 1 1 260 . 12 1 1 A 44 44 GLN H H 44 8.470 8.607 -0.137 1 1 261 . 12 1 1 A 44 44 GLN HA H 44 4.890 4.506 0.384 1 1 268 . 12 1 1 A 44 44 GLN C C 44 176.130 176.038 0.092 1 1 269 . 12 1 1 A 44 44 GLN CA C 44 54.360 55.549 -1.189 1 1 270 . 12 1 1 A 44 44 GLN CB C 44 30.610 29.355 1.255 1 1 272 . 12 1 1 A 44 44 GLN N N 44 124.690 130.119 -5.429 1 1 274 . 12 1 1 A 45 45 VAL H H 45 8.130 8.560 -0.430 1 1 275 . 12 1 1 A 45 45 VAL HA H 45 3.030 3.865 -0.835 1 1 283 . 12 1 1 A 45 45 VAL C C 45 176.710 177.239 -0.529 1 1 284 . 12 1 1 A 45 45 VAL CA C 45 65.810 64.724 1.086 1 1 285 . 12 1 1 A 45 45 VAL CB C 45 31.960 31.492 0.468 1 1 288 . 12 1 1 A 45 45 VAL N N 45 120.450 127.128 -6.678 1 1 289 . 12 1 1 A 46 46 GLY H H 46 8.950 10.015 -1.065 1 1 290 . 12 1 1 A 46 46 GLY HA2 H 46 3.590 4.009 -0.419 1 1 291 . 12 1 1 A 46 46 GLY HA3 H 46 4.410 4.011 0.399 1 1 292 . 12 1 1 A 46 46 GLY C C 46 174.390 174.056 0.334 1 1 293 . 12 1 1 A 46 46 GLY CA C 46 44.730 44.976 -0.246 1 1 294 . 12 1 1 A 46 46 GLY N N 46 116.490 115.139 1.351 1 1 295 . 12 1 1 A 47 47 GLU H H 47 8.260 8.064 0.196 1 1 296 . 12 1 1 A 47 47 GLU HA H 47 4.460 4.607 -0.147 1 1 301 . 12 1 1 A 47 47 GLU C C 47 174.780 175.364 -0.584 1 1 302 . 12 1 1 A 47 47 GLU CA C 47 54.830 55.551 -0.721 1 1 303 . 12 1 1 A 47 47 GLU CB C 47 31.140 31.606 -0.466 1 1 305 . 12 1 1 A 47 47 GLU N N 47 120.520 121.665 -1.145 1 1 306 . 12 1 1 A 48 48 ASN H H 48 8.440 8.794 -0.354 1 1 307 . 12 1 1 A 48 48 ASN HA H 48 5.380 5.522 -0.142 1 1 312 . 12 1 1 A 48 48 ASN C C 48 174.770 173.876 0.894 1 1 313 . 12 1 1 A 48 48 ASN CA C 48 51.570 51.814 -0.244 1 1 314 . 12 1 1 A 48 48 ASN CB C 48 39.010 41.619 -2.609 1 1 315 . 12 1 1 A 48 48 ASN N N 48 117.180 120.573 -3.393 1 1 317 . 12 1 1 A 49 49 LEU H H 49 9.810 8.144 1.666 1 1 318 . 12 1 1 A 49 49 LEU HA H 49 4.510 4.922 -0.412 1 1 328 . 12 1 1 A 49 49 LEU C C 49 174.560 175.193 -0.633 1 1 329 . 12 1 1 A 49 49 LEU CA C 49 53.460 54.308 -0.848 1 1 330 . 12 1 1 A 49 49 LEU CB C 49 45.520 44.264 1.256 1 1 333 . 12 1 1 A 49 49 LEU N N 49 125.620 126.008 -0.388 1 1 334 . 12 1 1 A 50 50 GLU H H 50 8.750 8.691 0.059 1 1 335 . 12 1 1 A 50 50 GLU HA H 50 4.360 4.895 -0.535 1 1 340 . 12 1 1 A 50 50 GLU C C 50 175.340 174.862 0.478 1 1 341 . 12 1 1 A 50 50 GLU CA C 50 55.550 55.474 0.076 1 1 342 . 12 1 1 A 50 50 GLU CB C 50 29.890 32.111 -2.221 1 1 344 . 12 1 1 A 50 50 GLU N N 50 125.420 125.321 0.099 1 1 345 . 12 1 1 A 51 51 VAL H H 51 9.230 8.829 0.401 1 1 346 . 12 1 1 A 51 51 VAL HA H 51 4.190 4.850 -0.660 1 1 354 . 12 1 1 A 51 51 VAL C C 51 175.310 174.482 0.828 1 1 355 . 12 1 1 A 51 51 VAL CA C 51 62.520 61.001 1.519 1 1 356 . 12 1 1 A 51 51 VAL CB C 51 31.470 32.928 -1.458 1 1 359 . 12 1 1 A 51 51 VAL N N 51 129.810 122.911 6.899 1 1 360 . 12 1 1 A 52 52 GLY H H 52 9.410 8.402 1.008 1 1 361 . 12 1 1 A 52 52 GLY HA2 H 52 3.460 3.894 -0.434 1 1 362 . 12 1 1 A 52 52 GLY HA3 H 52 4.680 3.924 0.756 1 1 363 . 12 1 1 A 52 52 GLY C C 52 173.000 173.242 -0.242 1 1 364 . 12 1 1 A 52 52 GLY CA C 52 46.470 47.454 -0.984 1 1 365 . 12 1 1 A 52 52 GLY N N 52 116.600 112.981 3.619 1 1 366 . 12 1 1 A 53 53 VAL H H 53 9.130 8.747 0.383 1 1 367 . 12 1 1 A 53 53 VAL HA H 53 4.840 4.853 -0.013 1 1 375 . 12 1 1 A 53 53 VAL C C 53 175.470 175.229 0.241 1 1 376 . 12 1 1 A 53 53 VAL CA C 53 61.350 61.590 -0.240 1 1 377 . 12 1 1 A 53 53 VAL CB C 53 34.300 31.681 2.619 1 1 380 . 12 1 1 A 53 53 VAL N N 53 129.050 122.829 6.221 1 1 381 . 12 1 1 A 54 54 GLY H H 54 8.420 8.390 0.030 1 1 382 . 12 1 1 A 54 54 GLY HA2 H 54 3.850 3.827 0.023 1 1 383 . 12 1 1 A 54 54 GLY HA3 H 54 3.850 3.912 -0.062 1 1 384 . 12 1 1 A 54 54 GLY C C 54 173.310 172.973 0.337 1 1 385 . 12 1 1 A 54 54 GLY CA C 54 45.180 44.380 0.800 1 1 386 . 12 1 1 A 54 54 GLY N N 54 116.890 115.284 1.606 1 1 387 . 12 1 1 A 55 55 ILE H H 55 10.190 8.171 2.019 1 1 388 . 12 1 1 A 55 55 ILE HA H 55 4.010 4.975 -0.965 1 1 398 . 12 1 1 A 55 55 ILE C C 55 174.380 175.330 -0.950 1 1 399 . 12 1 1 A 55 55 ILE CA C 55 61.350 59.820 1.530 1 1 400 . 12 1 1 A 55 55 ILE CB C 55 40.840 40.662 0.178 1 1 404 . 12 1 1 A 55 55 ILE N N 55 129.330 121.901 7.429 1 1 405 . 12 1 1 A 56 56 ASP H H 56 8.810 9.706 -0.896 1 1 406 . 12 1 1 A 56 56 ASP HA H 56 4.440 4.695 -0.255 1 1 409 . 12 1 1 A 56 56 ASP C C 56 175.530 175.201 0.329 1 1 410 . 12 1 1 A 56 56 ASP CA C 56 56.460 55.355 1.105 1 1 411 . 12 1 1 A 56 56 ASP CB C 56 42.720 42.774 -0.054 1 1 412 . 12 1 1 A 56 56 ASP N N 56 128.310 127.508 0.802 1 1 413 . 12 1 1 A 57 57 GLU H H 57 7.270 7.493 -0.223 1 1 414 . 12 1 1 A 57 57 GLU HA H 57 4.290 4.748 -0.458 1 1 419 . 12 1 1 A 57 57 GLU C C 57 173.370 174.536 -1.166 1 1 420 . 12 1 1 A 57 57 GLU CA C 57 54.840 55.253 -0.413 1 1 421 . 12 1 1 A 57 57 GLU CB C 57 33.190 33.578 -0.388 1 1 423 . 12 1 1 A 57 57 GLU N N 57 112.810 115.932 -3.122 1 1 424 . 12 1 1 A 58 58 LEU H H 58 8.370 8.511 -0.141 1 1 425 . 12 1 1 A 58 58 LEU HA H 58 4.830 4.637 0.193 1 1 434 . 12 1 1 A 58 58 LEU C C 58 174.180 174.406 -0.226 1 1 435 . 12 1 1 A 58 58 LEU CA C 58 55.320 54.877 0.443 1 1 436 . 12 1 1 A 58 58 LEU CB C 58 44.300 42.977 1.323 1 1 439 . 12 1 1 A 58 58 LEU N N 58 123.130 124.875 -1.745 1 1 440 . 12 1 1 A 59 59 VAL H H 59 9.120 8.785 0.335 1 1 441 . 12 1 1 A 59 59 VAL HA H 59 4.240 4.534 -0.294 1 1 449 . 12 1 1 A 59 59 VAL C C 59 174.960 175.547 -0.587 1 1 450 . 12 1 1 A 59 59 VAL CA C 59 61.760 59.582 2.178 1 1 451 . 12 1 1 A 59 59 VAL CB C 59 33.760 33.661 0.099 1 1 454 . 12 1 1 A 59 59 VAL N N 59 127.930 126.623 1.307 1 1 455 . 12 1 1 A 60 60 ASN H H 60 8.770 8.760 0.010 1 1 456 . 12 1 1 A 60 60 ASN HA H 60 4.250 4.324 -0.074 1 1 461 . 12 1 1 A 60 60 ASN C C 60 172.810 173.867 -1.057 1 1 462 . 12 1 1 A 60 60 ASN CA C 60 54.830 54.523 0.307 1 1 463 . 12 1 1 A 60 60 ASN CB C 60 36.030 37.091 -1.061 1 1 464 . 12 1 1 A 60 60 ASN N N 60 115.500 122.649 -7.149 1 1 466 . 12 1 1 A 61 61 ALA H H 61 7.330 7.292 0.038 1 1 467 . 12 1 1 A 61 61 ALA HA H 61 4.520 4.540 -0.020 1 1 471 . 12 1 1 A 61 61 ALA C C 61 174.580 175.388 -0.808 1 1 472 . 12 1 1 A 61 61 ALA CA C 61 51.560 50.306 1.254 1 1 473 . 12 1 1 A 61 61 ALA CB C 61 22.870 22.509 0.361 1 1 474 . 12 1 1 A 61 61 ALA N N 61 115.640 118.696 -3.056 1 1 475 . 12 1 1 A 62 62 GLU H H 62 7.900 9.240 -1.340 1 1 476 . 12 1 1 A 62 62 GLU HA H 62 4.310 4.495 -0.185 1 1 481 . 12 1 1 A 62 62 GLU C C 62 173.790 174.936 -1.146 1 1 482 . 12 1 1 A 62 62 GLU CA C 62 55.080 54.966 0.114 1 1 483 . 12 1 1 A 62 62 GLU CB C 62 32.610 29.907 2.703 1 1 485 . 12 1 1 A 62 62 GLU N N 62 117.400 123.331 -5.931 1 1 486 . 12 1 1 A 63 63 ALA H H 63 8.910 8.428 0.482 1 1 487 . 12 1 1 A 63 63 ALA HA H 63 4.690 4.480 0.210 1 1 491 . 12 1 1 A 63 63 ALA C C 63 175.720 176.404 -0.684 1 1 492 . 12 1 1 A 63 63 ALA CA C 63 50.600 53.072 -2.472 1 1 493 . 12 1 1 A 63 63 ALA CB C 63 20.660 18.869 1.791 1 1 494 . 12 1 1 A 63 63 ALA N N 63 122.480 128.822 -6.342 1 1 495 . 12 1 1 A 64 64 PHE H H 64 9.220 9.107 0.113 1 1 496 . 12 1 1 A 64 64 PHE HA H 64 4.320 4.713 -0.393 1 1 501 . 12 1 1 A 64 64 PHE C C 64 174.380 176.088 -1.708 1 1 502 . 12 1 1 A 64 64 PHE CA C 64 59.770 58.746 1.024 1 1 503 . 12 1 1 A 64 64 PHE CB C 64 40.830 41.366 -0.536 1 1 504 . 12 1 1 A 64 64 PHE N N 64 120.870 123.308 -2.438 1 1 505 . 12 1 1 A 65 65 ALA H H 65 8.150 7.932 0.218 1 1 506 . 12 1 1 A 65 65 ALA HA H 65 5.280 4.823 0.457 1 1 510 . 12 1 1 A 65 65 ALA C C 65 175.950 175.637 0.313 1 1 511 . 12 1 1 A 65 65 ALA CA C 65 51.120 51.230 -0.110 1 1 512 . 12 1 1 A 65 65 ALA CB C 65 22.850 21.432 1.418 1 1 513 . 12 1 1 A 65 65 ALA N N 65 122.350 119.858 2.492 1 1 514 . 12 1 1 A 66 66 TYR H H 66 9.260 9.272 -0.012 1 1 515 . 12 1 1 A 66 66 TYR HA H 66 5.710 4.909 0.801 1 1 520 . 12 1 1 A 66 66 TYR C C 66 175.690 174.563 1.127 1 1 521 . 12 1 1 A 66 66 TYR CA C 66 54.390 58.157 -3.767 1 1 522 . 12 1 1 A 66 66 TYR CB C 66 41.560 39.622 1.938 1 1 523 . 12 1 1 A 66 66 TYR N N 66 124.350 126.602 -2.252 1 1 524 . 12 1 1 A 67 67 ASP H H 67 9.070 8.073 0.997 1 1 525 . 12 1 1 A 67 67 ASP HA H 67 5.630 5.382 0.248 1 1 528 . 12 1 1 A 67 67 ASP C C 67 174.300 174.595 -0.295 1 1 529 . 12 1 1 A 67 67 ASP CA C 67 51.590 53.037 -1.447 1 1 530 . 12 1 1 A 67 67 ASP CB C 67 44.380 43.599 0.781 1 1 531 . 12 1 1 A 67 67 ASP N N 67 130.490 127.335 3.155 1 1 532 . 12 1 1 A 68 68 PHE H H 68 8.670 8.377 0.293 1 1 533 . 12 1 1 A 68 68 PHE HA H 68 4.890 5.197 -0.307 1 1 538 . 12 1 1 A 68 68 PHE C C 68 172.220 172.635 -0.415 1 1 539 . 12 1 1 A 68 68 PHE CA C 68 57.360 55.646 1.714 1 1 540 . 12 1 1 A 68 68 PHE CB C 68 40.360 41.968 -1.608 1 1 541 . 12 1 1 A 68 68 PHE N N 68 118.200 119.636 -1.436 1 1 542 . 12 1 1 A 69 69 THR H H 69 8.390 9.135 -0.745 1 1 543 . 12 1 1 A 69 69 THR HA H 69 5.170 4.847 0.323 1 1 548 . 12 1 1 A 69 69 THR C C 69 172.620 173.734 -1.114 1 1 549 . 12 1 1 A 69 69 THR CA C 69 61.370 61.277 0.093 1 1 550 . 12 1 1 A 69 69 THR CB C 69 64.880 70.298 -5.418 1 1 552 . 12 1 1 A 69 69 THR N N 69 115.810 113.207 2.603 1 1 553 . 12 1 1 A 70 70 LEU H H 70 9.560 8.667 0.893 1 1 554 . 12 1 1 A 70 70 LEU HA H 70 5.270 4.732 0.538 1 1 564 . 12 1 1 A 70 70 LEU C C 70 173.800 175.405 -1.605 1 1 565 . 12 1 1 A 70 70 LEU CA C 70 53.460 55.700 -2.240 1 1 566 . 12 1 1 A 70 70 LEU CB C 70 45.040 43.083 1.957 1 1 570 . 12 1 1 A 70 70 LEU N N 70 129.220 129.387 -0.167 1 1 571 . 12 1 1 A 71 71 ASN H H 71 9.590 8.618 0.972 1 1 572 . 12 1 1 A 71 71 ASN HA H 71 5.880 5.671 0.209 1 1 577 . 12 1 1 A 71 71 ASN C C 71 177.970 173.966 4.004 1 1 578 . 12 1 1 A 71 71 ASN CA C 71 52.060 52.309 -0.249 1 1 579 . 12 1 1 A 71 71 ASN CB C 71 41.020 40.575 0.445 1 1 580 . 12 1 1 A 71 71 ASN N N 71 125.970 123.639 2.331 1 1 582 . 12 1 1 A 72 72 TYR H H 72 8.740 9.483 -0.743 1 1 583 . 12 1 1 A 72 72 TYR HA H 72 5.110 5.239 -0.129 1 1 588 . 12 1 1 A 72 72 TYR C C 72 177.720 172.982 4.738 1 1 589 . 12 1 1 A 72 72 TYR CA C 72 55.310 55.387 -0.077 1 1 590 . 12 1 1 A 72 72 TYR CB C 72 41.510 41.473 0.037 1 1 591 . 12 1 1 A 72 72 TYR N N 72 119.640 120.765 -1.125 1 1 592 . 12 1 1 A 73 73 ASP H H 73 9.780 9.063 0.717 1 1 593 . 12 1 1 A 73 73 ASP HA H 73 4.680 5.178 -0.498 1 1 596 . 12 1 1 A 73 73 ASP C C 73 177.290 176.294 0.996 1 1 597 . 12 1 1 A 73 73 ASP CA C 73 53.650 52.937 0.713 1 1 598 . 12 1 1 A 73 73 ASP CB C 73 40.900 43.334 -2.434 1 1 599 . 12 1 1 A 73 73 ASP N N 73 119.290 119.152 0.138 1 1 600 . 12 1 1 A 74 74 GLU H H 74 9.430 9.030 0.400 1 1 601 . 12 1 1 A 74 74 GLU HA H 74 4.740 4.568 0.172 1 1 606 . 12 1 1 A 74 74 GLU C C 74 176.320 178.414 -2.094 1 1 607 . 12 1 1 A 74 74 GLU CA C 74 57.410 58.854 -1.444 1 1 608 . 12 1 1 A 74 74 GLU CB C 74 29.490 29.726 -0.236 1 1 610 . 12 1 1 A 74 74 GLU N N 74 130.930 124.522 6.408 1 1 611 . 12 1 1 A 75 75 ASN H H 75 8.680 8.285 0.395 1 1 612 . 12 1 1 A 75 75 ASN HA H 75 4.600 4.483 0.117 1 1 617 . 12 1 1 A 75 75 ASN C C 75 175.340 177.226 -1.886 1 1 618 . 12 1 1 A 75 75 ASN CA C 75 54.620 56.252 -1.632 1 1 619 . 12 1 1 A 75 75 ASN CB C 75 38.770 38.119 0.651 1 1 620 . 12 1 1 A 75 75 ASN N N 75 115.040 118.270 -3.230 1 1 622 . 12 1 1 A 76 76 ALA H H 76 7.740 7.622 0.118 1 1 623 . 12 1 1 A 76 76 ALA HA H 76 4.310 4.374 -0.064 1 1 627 . 12 1 1 A 76 76 ALA C C 76 175.550 176.983 -1.433 1 1 628 . 12 1 1 A 76 76 ALA CA C 76 53.260 53.764 -0.504 1 1 629 . 12 1 1 A 76 76 ALA CB C 76 21.450 20.096 1.354 1 1 630 . 12 1 1 A 76 76 ALA N N 76 122.200 119.091 3.109 1 1 631 . 12 1 1 A 77 77 PHE H H 77 8.070 8.014 0.056 1 1 632 . 12 1 1 A 77 77 PHE HA H 77 5.650 4.910 0.740 1 1 637 . 12 1 1 A 77 77 PHE C C 77 174.570 175.386 -0.816 1 1 638 . 12 1 1 A 77 77 PHE CA C 77 56.360 57.639 -1.279 1 1 639 . 12 1 1 A 77 77 PHE CB C 77 46.080 41.138 4.942 1 1 640 . 12 1 1 A 77 77 PHE N N 77 114.160 113.945 0.215 1 1 641 . 12 1 1 A 78 78 GLU H H 78 8.800 8.660 0.140 1 1 642 . 12 1 1 A 78 78 GLU HA H 78 4.900 5.022 -0.122 1 1 647 . 12 1 1 A 78 78 GLU C C 78 175.950 174.946 1.004 1 1 648 . 12 1 1 A 78 78 GLU CA C 78 53.670 55.884 -2.214 1 1 649 . 12 1 1 A 78 78 GLU CB C 78 33.600 33.231 0.369 1 1 651 . 12 1 1 A 78 78 GLU N N 78 117.590 120.872 -3.282 1 1 652 . 12 1 1 A 79 79 TYR H H 79 8.770 9.012 -0.242 1 1 653 . 12 1 1 A 79 79 TYR HA H 79 4.250 4.244 0.006 1 1 658 . 12 1 1 A 79 79 TYR C C 79 174.580 174.943 -0.363 1 1 659 . 12 1 1 A 79 79 TYR CA C 79 59.250 59.533 -0.283 1 1 660 . 12 1 1 A 79 79 TYR CB C 79 38.310 39.124 -0.814 1 1 661 . 12 1 1 A 79 79 TYR N N 79 126.560 129.600 -3.040 1 1 662 . 12 1 1 A 80 80 VAL H H 80 8.220 8.245 -0.025 1 1 663 . 12 1 1 A 80 80 VAL HA H 80 3.690 3.901 -0.211 1 1 671 . 12 1 1 A 80 80 VAL C C 80 174.780 175.484 -0.704 1 1 672 . 12 1 1 A 80 80 VAL CA C 80 64.400 62.943 1.457 1 1 673 . 12 1 1 A 80 80 VAL CB C 80 33.510 33.163 0.347 1 1 676 . 12 1 1 A 80 80 VAL N N 80 129.460 124.802 4.658 1 1 677 . 12 1 1 A 81 81 GLU H H 81 6.920 7.035 -0.115 1 1 678 . 12 1 1 A 81 81 GLU HA H 81 4.260 4.776 -0.516 1 1 683 . 12 1 1 A 81 81 GLU C C 81 171.840 174.734 -2.894 1 1 684 . 12 1 1 A 81 81 GLU CA C 81 55.310 55.247 0.063 1 1 685 . 12 1 1 A 81 81 GLU CB C 81 30.520 32.804 -2.284 1 1 687 . 12 1 1 A 81 81 GLU N N 81 112.430 114.560 -2.130 1 1 688 . 12 1 1 A 82 82 ALA H H 82 8.310 8.607 -0.297 1 1 689 . 12 1 1 A 82 82 ALA HA H 82 5.650 5.126 0.524 1 1 693 . 12 1 1 A 82 82 ALA C C 82 176.110 177.016 -0.906 1 1 694 . 12 1 1 A 82 82 ALA CA C 82 50.620 51.725 -1.105 1 1 695 . 12 1 1 A 82 82 ALA CB C 82 21.770 19.917 1.853 1 1 696 . 12 1 1 A 82 82 ALA N N 82 121.240 124.691 -3.451 1 1 697 . 12 1 1 A 83 83 ILE H H 83 9.150 9.461 -0.311 1 1 698 . 12 1 1 A 83 83 ILE HA H 83 4.600 4.780 -0.180 1 1 708 . 12 1 1 A 83 83 ILE C C 83 174.810 174.859 -0.049 1 1 709 . 12 1 1 A 83 83 ILE CA C 83 60.060 59.061 0.999 1 1 710 . 12 1 1 A 83 83 ILE CB C 83 42.440 41.577 0.863 1 1 714 . 12 1 1 A 83 83 ILE N N 83 119.720 120.318 -0.598 1 1 715 . 12 1 1 A 84 84 SER H H 84 8.350 8.735 -0.385 1 1 716 . 12 1 1 A 84 84 SER HA H 84 4.660 4.759 -0.099 1 1 719 . 12 1 1 A 84 84 SER C C 84 177.550 172.654 4.896 1 1 720 . 12 1 1 A 84 84 SER CA C 84 57.330 55.894 1.436 1 1 721 . 12 1 1 A 84 84 SER CB C 84 66.490 65.505 0.985 1 1 722 . 12 1 1 A 84 84 SER N N 84 116.740 120.056 -3.316 1 1 723 . 12 1 1 A 85 85 ASP H H 85 8.740 8.666 0.074 1 1 724 . 12 1 1 A 85 85 ASP HA H 85 4.820 4.758 0.062 1 1 727 . 12 1 1 A 85 85 ASP C C 85 176.090 176.153 -0.063 1 1 728 . 12 1 1 A 85 85 ASP CA C 85 53.480 52.433 1.047 1 1 729 . 12 1 1 A 85 85 ASP CB C 85 42.480 43.205 -0.725 1 1 730 . 12 1 1 A 85 85 ASP N N 85 120.960 122.307 -1.347 1 1 731 . 12 1 1 A 86 86 ASP H H 86 8.380 8.825 -0.445 1 1 732 . 12 1 1 A 86 86 ASP HA H 86 4.450 4.880 -0.430 1 1 735 . 12 1 1 A 86 86 ASP C C 86 177.100 176.905 0.195 1 1 736 . 12 1 1 A 86 86 ASP CA C 86 56.240 54.114 2.126 1 1 737 . 12 1 1 A 86 86 ASP CB C 86 41.100 41.298 -0.198 1 1 738 . 12 1 1 A 86 86 ASP N N 86 117.710 120.993 -3.283 1 1 739 . 12 1 1 A 87 87 GLY H H 87 8.690 7.566 1.124 1 1 740 . 12 1 1 A 87 87 GLY HA2 H 87 3.870 4.082 -0.212 1 1 741 . 12 1 1 A 87 87 GLY HA3 H 87 4.090 4.091 -0.001 1 1 742 . 12 1 1 A 87 87 GLY C C 87 173.800 174.115 -0.315 1 1 743 . 12 1 1 A 87 87 GLY CA C 87 45.770 45.815 -0.045 1 1 744 . 12 1 1 A 87 87 GLY N N 87 108.540 107.500 1.040 1 1 745 . 12 1 1 A 88 88 VAL H H 88 7.910 7.687 0.223 1 1 746 . 12 1 1 A 88 88 VAL HA H 88 4.780 4.415 0.365 1 1 754 . 12 1 1 A 88 88 VAL C C 88 173.970 174.293 -0.323 1 1 755 . 12 1 1 A 88 88 VAL CA C 88 60.900 60.956 -0.056 1 1 756 . 12 1 1 A 88 88 VAL CB C 88 35.460 33.567 1.893 1 1 759 . 12 1 1 A 88 88 VAL N N 88 119.790 118.604 1.186 1 1 760 . 12 1 1 A 89 89 PHE H H 89 9.210 9.769 -0.559 1 1 761 . 12 1 1 A 89 89 PHE HA H 89 4.930 5.346 -0.416 1 1 766 . 12 1 1 A 89 89 PHE C C 89 173.970 173.511 0.459 1 1 767 . 12 1 1 A 89 89 PHE CA C 89 56.450 55.917 0.533 1 1 768 . 12 1 1 A 89 89 PHE CB C 89 41.120 42.609 -1.489 1 1 769 . 12 1 1 A 89 89 PHE N N 89 126.780 123.891 2.889 1 1 770 . 12 1 1 A 90 90 VAL H H 90 7.880 8.346 -0.466 1 1 771 . 12 1 1 A 90 90 VAL HA H 90 4.860 4.923 -0.063 1 1 779 . 12 1 1 A 90 90 VAL C C 90 173.190 174.073 -0.883 1 1 780 . 12 1 1 A 90 90 VAL CA C 90 59.750 61.353 -1.603 1 1 781 . 12 1 1 A 90 90 VAL CB C 90 34.770 34.318 0.452 1 1 784 . 12 1 1 A 90 90 VAL N N 90 124.990 126.135 -1.145 1 1 785 . 12 1 1 A 91 91 ASN H H 91 8.670 9.658 -0.988 1 1 786 . 12 1 1 A 91 91 ASN HA H 91 4.730 5.481 -0.751 1 1 791 . 12 1 1 A 91 91 ASN C C 91 173.200 174.767 -1.567 1 1 792 . 12 1 1 A 91 91 ASN CA C 91 51.970 51.536 0.434 1 1 793 . 12 1 1 A 91 91 ASN CB C 91 41.340 41.551 -0.211 1 1 794 . 12 1 1 A 91 91 ASN N N 91 124.860 127.927 -3.067 1 1 796 . 12 1 1 A 92 92 ALA H H 92 8.840 9.055 -0.215 1 1 797 . 12 1 1 A 92 92 ALA HA H 92 5.290 5.045 0.245 1 1 801 . 12 1 1 A 92 92 ALA C C 92 176.330 176.649 -0.319 1 1 802 . 12 1 1 A 92 92 ALA CA C 92 50.170 51.238 -1.068 1 1 803 . 12 1 1 A 92 92 ALA CB C 92 23.610 21.052 2.558 1 1 804 . 12 1 1 A 92 92 ALA N N 92 128.510 129.300 -0.790 1 1 805 . 12 1 1 A 93 93 LYS H H 93 8.670 9.003 -0.333 1 1 806 . 12 1 1 A 93 93 LYS HA H 93 4.460 4.803 -0.343 1 1 815 . 12 1 1 A 93 93 LYS C C 93 174.170 175.071 -0.901 1 1 816 . 12 1 1 A 93 93 LYS CA C 93 55.010 55.097 -0.087 1 1 817 . 12 1 1 A 93 93 LYS CB C 93 36.430 34.898 1.532 1 1 821 . 12 1 1 A 93 93 LYS N N 93 121.300 118.247 3.053 1 1 822 . 12 1 1 A 94 94 LYS H H 94 8.960 8.782 0.178 1 1 823 . 12 1 1 A 94 94 LYS HA H 94 4.460 4.174 0.286 1 1 832 . 12 1 1 A 94 94 LYS C C 94 176.330 176.952 -0.622 1 1 833 . 12 1 1 A 94 94 LYS CA C 94 56.720 56.731 -0.011 1 1 834 . 12 1 1 A 94 94 LYS CB C 94 31.930 32.745 -0.815 1 1 837 . 12 1 1 A 94 94 LYS N N 94 127.060 126.928 0.132 1 1 838 . 12 1 1 A 95 95 ILE H H 95 8.290 8.417 -0.127 1 1 839 . 12 1 1 A 95 95 ILE HA H 95 4.120 4.177 -0.057 1 1 849 . 12 1 1 A 95 95 ILE C C 95 175.740 175.373 0.367 1 1 850 . 12 1 1 A 95 95 ILE CA C 95 62.760 62.612 0.148 1 1 851 . 12 1 1 A 95 95 ILE CB C 95 38.890 39.296 -0.406 1 1 855 . 12 1 1 A 95 95 ILE N N 95 126.530 128.144 -1.614 1 1 856 . 12 1 1 A 96 96 GLU H H 96 8.030 7.309 0.721 1 1 857 . 12 1 1 A 96 96 GLU HA H 96 4.450 4.739 -0.289 1 1 862 . 12 1 1 A 96 96 GLU C C 96 174.380 175.139 -0.759 1 1 863 . 12 1 1 A 96 96 GLU CA C 96 54.320 54.993 -0.673 1 1 864 . 12 1 1 A 96 96 GLU CB C 96 32.770 33.878 -1.108 1 1 866 . 12 1 1 A 96 96 GLU N N 96 117.080 119.281 -2.201 1 1 867 . 12 1 1 A 97 97 ASP H H 97 8.730 8.682 0.048 1 1 868 . 12 1 1 A 97 97 ASP HA H 97 4.360 4.619 -0.259 1 1 871 . 12 1 1 A 97 97 ASP C C 97 177.100 176.370 0.730 1 1 872 . 12 1 1 A 97 97 ASP CA C 97 57.160 54.780 2.380 1 1 873 . 12 1 1 A 97 97 ASP CB C 97 39.920 40.788 -0.868 1 1 874 . 12 1 1 A 97 97 ASP N N 97 120.570 121.321 -0.751 1 1 875 . 12 1 1 A 98 98 GLY H H 98 8.760 8.089 0.671 1 1 876 . 12 1 1 A 98 98 GLY HA2 H 98 2.120 1.517 0.603 1 1 877 . 12 1 1 A 98 98 GLY HA3 H 98 3.910 3.338 0.572 1 1 878 . 12 1 1 A 98 98 GLY C C 98 174.000 172.860 1.140 1 1 879 . 12 1 1 A 98 98 GLY CA C 98 45.720 45.123 0.597 1 1 880 . 12 1 1 A 98 98 GLY N N 98 112.090 110.777 1.313 1 1 881 . 12 1 1 A 99 99 LYS H H 99 7.890 7.256 0.634 1 1 882 . 12 1 1 A 99 99 LYS HA H 99 5.330 5.229 0.101 1 1 891 . 12 1 1 A 99 99 LYS C C 99 174.750 174.359 0.391 1 1 892 . 12 1 1 A 99 99 LYS CA C 99 55.990 54.885 1.105 1 1 893 . 12 1 1 A 99 99 LYS CB C 99 37.840 35.507 2.333 1 1 897 . 12 1 1 A 99 99 LYS N N 99 118.050 114.732 3.318 1 1 898 . 12 1 1 A 100 100 VAL H H 100 8.980 8.801 0.179 1 1 899 . 12 1 1 A 100 100 VAL HA H 100 4.510 4.728 -0.218 1 1 907 . 12 1 1 A 100 100 VAL C C 100 174.760 174.020 0.740 1 1 908 . 12 1 1 A 100 100 VAL CA C 100 60.130 59.045 1.085 1 1 909 . 12 1 1 A 100 100 VAL CB C 100 35.240 35.695 -0.455 1 1 912 . 12 1 1 A 100 100 VAL N N 100 123.850 119.609 4.241 1 1 913 . 12 1 1 A 101 101 ARG H H 101 8.810 8.136 0.674 1 1 914 . 12 1 1 A 101 101 ARG HA H 101 4.850 4.472 0.378 1 1 921 . 12 1 1 A 101 101 ARG C C 101 174.770 174.656 0.114 1 1 922 . 12 1 1 A 101 101 ARG CA C 101 54.580 55.668 -1.088 1 1 923 . 12 1 1 A 101 101 ARG CB C 101 32.400 31.339 1.061 1 1 926 . 12 1 1 A 101 101 ARG N N 101 129.210 123.882 5.328 1 1 927 . 12 1 1 A 102 102 VAL H H 102 9.100 8.242 0.858 1 1 928 . 12 1 1 A 102 102 VAL HA H 102 4.120 4.377 -0.257 1 1 936 . 12 1 1 A 102 102 VAL C C 102 171.640 173.952 -2.312 1 1 937 . 12 1 1 A 102 102 VAL CA C 102 61.350 60.568 0.782 1 1 938 . 12 1 1 A 102 102 VAL CB C 102 32.530 32.814 -0.284 1 1 941 . 12 1 1 A 102 102 VAL N N 102 130.470 122.566 7.904 1 1 942 . 12 1 1 A 103 103 LEU H H 103 8.110 9.160 -1.050 1 1 943 . 12 1 1 A 103 103 LEU HA H 103 5.120 4.624 0.496 1 1 953 . 12 1 1 A 103 103 LEU C C 103 176.410 175.985 0.425 1 1 954 . 12 1 1 A 103 103 LEU CA C 103 53.380 54.344 -0.964 1 1 955 . 12 1 1 A 103 103 LEU CB C 103 43.680 41.342 2.338 1 1 959 . 12 1 1 A 103 103 LEU N N 103 125.560 129.799 -4.239 1 1 960 . 12 1 1 A 104 104 VAL H H 104 9.580 9.032 0.548 1 1 961 . 12 1 1 A 104 104 VAL HA H 104 5.260 5.122 0.138 1 1 969 . 12 1 1 A 104 104 VAL C C 104 176.030 174.819 1.211 1 1 970 . 12 1 1 A 104 104 VAL CA C 104 60.220 60.990 -0.770 1 1 971 . 12 1 1 A 104 104 VAL CB C 104 34.310 34.184 0.126 1 1 974 . 12 1 1 A 104 104 VAL N N 104 125.790 126.506 -0.716 1 1 975 . 12 1 1 A 105 105 SER H H 105 9.340 9.247 0.093 1 1 976 . 12 1 1 A 105 105 SER HA H 105 5.300 5.126 0.174 1 1 979 . 12 1 1 A 105 105 SER C C 105 173.600 173.016 0.584 1 1 980 . 12 1 1 A 105 105 SER CA C 105 57.450 57.411 0.039 1 1 981 . 12 1 1 A 105 105 SER CB C 105 65.600 66.820 -1.220 1 1 982 . 12 1 1 A 105 105 SER N N 105 119.220 119.888 -0.668 1 1 983 . 12 1 1 A 106 106 SER H H 106 8.350 9.163 -0.813 1 1 984 . 12 1 1 A 106 106 SER HA H 106 4.720 4.514 0.206 1 1 987 . 12 1 1 A 106 106 SER C C 106 176.930 174.705 2.225 1 1 988 . 12 1 1 A 106 106 SER CA C 106 58.170 58.916 -0.746 1 1 989 . 12 1 1 A 106 106 SER CB C 106 64.170 63.026 1.144 1 1 990 . 12 1 1 A 106 106 SER N N 106 114.800 120.238 -5.438 1 1 991 . 12 1 1 A 107 107 LEU H H 107 8.770 8.974 -0.204 1 1 992 . 12 1 1 A 107 107 LEU HA H 107 4.710 4.180 0.530 1 1 1001 . 12 1 1 A 107 107 LEU C C 107 178.280 178.387 -0.107 1 1 1002 . 12 1 1 A 107 107 LEU CA C 107 55.280 57.272 -1.992 1 1 1003 . 12 1 1 A 107 107 LEU CB C 107 43.410 41.902 1.508 1 1 1007 . 12 1 1 A 107 107 LEU N N 107 127.210 128.420 -1.210 1 1 1008 . 12 1 1 A 108 108 THR H H 108 8.210 7.819 0.391 1 1 1009 . 12 1 1 A 108 108 THR HA H 108 4.400 4.291 0.109 1 1 1015 . 12 1 1 A 108 108 THR C C 108 176.130 175.720 0.410 1 1 1016 . 12 1 1 A 108 108 THR CA C 108 62.050 63.349 -1.299 1 1 1017 . 12 1 1 A 108 108 THR CB C 108 70.910 70.311 0.599 1 1 1019 . 12 1 1 A 108 108 THR N N 108 108.810 110.742 -1.932 1 1 1020 . 12 1 1 A 109 109 GLY H H 109 8.250 7.769 0.481 1 1 1021 . 12 1 1 A 109 109 GLY HA2 H 109 3.780 4.047 -0.267 1 1 1022 . 12 1 1 A 109 109 GLY HA3 H 109 4.290 4.059 0.231 1 1 1023 . 12 1 1 A 109 109 GLY C C 109 173.180 174.348 -1.168 1 1 1024 . 12 1 1 A 109 109 GLY CA C 109 45.340 45.132 0.208 1 1 1025 . 12 1 1 A 109 109 GLY N N 109 110.160 110.938 -0.778 1 1 1026 . 12 1 1 A 110 110 GLU H H 110 7.960 7.619 0.341 1 1 1027 . 12 1 1 A 110 110 GLU HA H 110 4.760 4.700 0.060 1 1 1032 . 12 1 1 A 110 110 GLU CA C 110 53.450 54.107 -0.657 1 1 1033 . 12 1 1 A 110 110 GLU CB C 110 30.020 30.783 -0.763 1 1 1035 . 12 1 1 A 110 110 GLU N N 110 119.720 119.629 0.091 1 1 1036 . 12 1 1 A 111 111 PRO HA H 111 3.250 4.044 -0.794 1 1 1043 . 12 1 1 A 111 111 PRO C C 111 176.710 176.187 0.523 1 1 1044 . 12 1 1 A 111 111 PRO CA C 111 62.240 62.103 0.137 1 1 1045 . 12 1 1 A 111 111 PRO CB C 111 31.990 32.084 -0.094 1 1 1048 . 12 1 1 A 112 112 LEU H H 112 8.840 8.714 0.126 1 1 1049 . 12 1 1 A 112 112 LEU HA H 112 4.290 4.251 0.039 1 1 1059 . 12 1 1 A 112 112 LEU CA C 112 52.220 53.542 -1.322 1 1 1060 . 12 1 1 A 112 112 LEU CB C 112 41.090 41.694 -0.604 1 1 1063 . 12 1 1 A 112 112 LEU N N 112 122.420 121.802 0.618 1 1 1064 . 12 1 1 A 113 113 PRO HA H 113 4.380 4.187 0.193 1 1 1071 . 12 1 1 A 113 113 PRO C C 113 176.100 177.048 -0.948 1 1 1072 . 12 1 1 A 113 113 PRO CA C 113 61.930 65.240 -3.310 1 1 1073 . 12 1 1 A 113 113 PRO CB C 113 32.470 31.711 0.759 1 1 1076 . 12 1 1 A 114 114 ALA H H 114 8.070 7.789 0.281 1 1 1077 . 12 1 1 A 114 114 ALA HA H 114 4.550 3.953 0.597 1 1 1081 . 12 1 1 A 114 114 ALA C C 114 177.490 177.257 0.233 1 1 1082 . 12 1 1 A 114 114 ALA CA C 114 51.340 53.628 -2.288 1 1 1083 . 12 1 1 A 114 114 ALA CB C 114 19.940 18.175 1.765 1 1 1084 . 12 1 1 A 114 114 ALA N N 114 121.460 120.284 1.176 1 1 1085 . 12 1 1 A 115 115 LYS H H 115 9.000 8.619 0.381 1 1 1086 . 12 1 1 A 115 115 LYS HA H 115 3.930 3.956 -0.026 1 1 1095 . 12 1 1 A 115 115 LYS C C 115 175.740 175.100 0.640 1 1 1096 . 12 1 1 A 115 115 LYS CA C 115 57.580 57.809 -0.229 1 1 1097 . 12 1 1 A 115 115 LYS CB C 115 29.510 30.570 -1.060 1 1 1101 . 12 1 1 A 115 115 LYS N N 115 112.560 116.013 -3.453 1 1 1102 . 12 1 1 A 116 116 GLU H H 116 7.620 7.730 -0.110 1 1 1103 . 12 1 1 A 116 116 GLU HA H 116 4.550 4.816 -0.266 1 1 1108 . 12 1 1 A 116 116 GLU C C 116 176.110 175.186 0.924 1 1 1109 . 12 1 1 A 116 116 GLU CA C 116 54.570 54.783 -0.213 1 1 1110 . 12 1 1 A 116 116 GLU CB C 116 33.680 32.056 1.624 1 1 1112 . 12 1 1 A 116 116 GLU N N 116 115.710 117.940 -2.230 1 1 1113 . 12 1 1 A 117 117 VAL H H 117 8.770 8.764 0.006 1 1 1114 . 12 1 1 A 117 117 VAL HA H 117 3.200 4.035 -0.835 1 1 1122 . 12 1 1 A 117 117 VAL C C 117 175.740 175.786 -0.046 1 1 1123 . 12 1 1 A 117 117 VAL CA C 117 65.340 63.199 2.141 1 1 1124 . 12 1 1 A 117 117 VAL CB C 117 31.290 30.953 0.337 1 1 1127 . 12 1 1 A 117 117 VAL N N 117 124.450 120.441 4.009 1 1 1128 . 12 1 1 A 118 118 LEU H H 118 8.550 8.991 -0.441 1 1 1129 . 12 1 1 A 118 118 LEU HA H 118 4.540 4.398 0.142 1 1 1139 . 12 1 1 A 118 118 LEU C C 118 176.210 177.079 -0.869 1 1 1140 . 12 1 1 A 118 118 LEU CA C 118 55.510 55.745 -0.235 1 1 1141 . 12 1 1 A 118 118 LEU CB C 118 44.600 42.638 1.962 1 1 1145 . 12 1 1 A 118 118 LEU N N 118 128.440 128.789 -0.349 1 1 1146 . 12 1 1 A 119 119 ALA H H 119 7.970 7.587 0.383 1 1 1147 . 12 1 1 A 119 119 ALA HA H 119 4.740 4.816 -0.076 1 1 1151 . 12 1 1 A 119 119 ALA C C 119 174.570 175.126 -0.556 1 1 1152 . 12 1 1 A 119 119 ALA CA C 119 50.770 51.635 -0.865 1 1 1153 . 12 1 1 A 119 119 ALA CB C 119 22.450 22.558 -0.108 1 1 1154 . 12 1 1 A 119 119 ALA N N 119 118.100 117.491 0.609 1 1 1155 . 12 1 1 A 120 120 LYS H H 120 8.760 8.662 0.098 1 1 1156 . 12 1 1 A 120 120 LYS HA H 120 5.240 5.419 -0.179 1 1 1165 . 12 1 1 A 120 120 LYS C C 120 175.340 175.567 -0.227 1 1 1166 . 12 1 1 A 120 120 LYS CA C 120 54.220 54.967 -0.747 1 1 1167 . 12 1 1 A 120 120 LYS CB C 120 34.340 34.528 -0.188 1 1 1171 . 12 1 1 A 120 120 LYS N N 120 120.010 121.811 -1.801 1 1 1172 . 12 1 1 A 121 121 VAL H H 121 9.410 8.972 0.438 1 1 1173 . 12 1 1 A 121 121 VAL HA H 121 4.230 4.427 -0.197 1 1 1181 . 12 1 1 A 121 121 VAL C C 121 173.980 175.565 -1.585 1 1 1182 . 12 1 1 A 121 121 VAL CA C 121 62.370 62.530 -0.160 1 1 1183 . 12 1 1 A 121 121 VAL CB C 121 32.410 32.163 0.247 1 1 1186 . 12 1 1 A 121 121 VAL N N 121 124.960 125.847 -0.887 1 1 1187 . 12 1 1 A 122 122 VAL H H 122 9.280 8.568 0.712 1 1 1188 . 12 1 1 A 122 122 VAL HA H 122 4.360 4.531 -0.171 1 1 1196 . 12 1 1 A 122 122 VAL C C 122 174.190 175.403 -1.213 1 1 1197 . 12 1 1 A 122 122 VAL CA C 122 62.760 62.892 -0.132 1 1 1198 . 12 1 1 A 122 122 VAL CB C 122 32.020 31.055 0.965 1 1 1201 . 12 1 1 A 122 122 VAL N N 122 128.990 127.974 1.016 1 1 1202 . 12 1 1 A 123 123 LEU H H 123 8.610 9.045 -0.435 1 1 1203 . 12 1 1 A 123 123 LEU HA H 123 4.900 4.894 0.006 1 1 1213 . 12 1 1 A 123 123 LEU C C 123 174.950 175.637 -0.687 1 1 1214 . 12 1 1 A 123 123 LEU CA C 123 52.050 53.688 -1.638 1 1 1215 . 12 1 1 A 123 123 LEU CB C 123 45.210 42.184 3.026 1 1 1219 . 12 1 1 A 123 123 LEU N N 123 127.200 128.645 -1.445 1 1 1220 . 12 1 1 A 124 124 ARG H H 124 9.540 8.895 0.645 1 1 1221 . 12 1 1 A 124 124 ARG HA H 124 4.900 4.572 0.328 1 1 1229 . 12 1 1 A 124 124 ARG C C 124 176.320 175.898 0.422 1 1 1230 . 12 1 1 A 124 124 ARG CA C 124 55.320 56.772 -1.452 1 1 1231 . 12 1 1 A 124 124 ARG CB C 124 31.750 30.517 1.233 1 1 1234 . 12 1 1 A 124 124 ARG N N 124 124.290 126.072 -1.782 1 1 1236 . 12 1 1 A 125 125 ALA H H 125 8.880 8.496 0.384 1 1 1237 . 12 1 1 A 125 125 ALA HA H 125 4.380 4.210 0.170 1 1 1241 . 12 1 1 A 125 125 ALA C C 125 177.290 177.847 -0.557 1 1 1242 . 12 1 1 A 125 125 ALA CA C 125 52.530 51.586 0.944 1 1 1243 . 12 1 1 A 125 125 ALA CB C 125 19.870 17.804 2.066 1 1 1244 . 12 1 1 A 125 125 ALA N N 125 130.790 129.021 1.769 1 1 1245 . 12 1 1 A 126 126 GLU H H 126 9.260 8.651 0.609 1 1 1246 . 12 1 1 A 126 126 GLU HA H 126 4.460 4.335 0.125 1 1 1251 . 12 1 1 A 126 126 GLU C C 126 176.120 176.178 -0.058 1 1 1252 . 12 1 1 A 126 126 GLU CA C 126 56.940 57.102 -0.162 1 1 1253 . 12 1 1 A 126 126 GLU CB C 126 32.450 30.135 2.315 1 1 1255 . 12 1 1 A 126 126 GLU N N 126 125.740 124.110 1.630 1 1 1256 . 12 1 1 A 127 127 ALA H H 127 7.460 7.517 -0.057 1 1 1257 . 12 1 1 A 127 127 ALA HA H 127 4.360 4.631 -0.271 1 1 1261 . 12 1 1 A 127 127 ALA C C 127 173.400 175.730 -2.330 1 1 1262 . 12 1 1 A 127 127 ALA CA C 127 51.360 51.606 -0.246 1 1 1263 . 12 1 1 A 127 127 ALA CB C 127 22.180 21.932 0.248 1 1 1264 . 12 1 1 A 127 127 ALA N N 127 120.910 119.662 1.248 1 1 1265 . 12 1 1 A 128 128 LYS H H 128 7.940 8.753 -0.813 1 1 1266 . 12 1 1 A 128 128 LYS HA H 128 3.580 4.083 -0.503 1 1 1275 . 12 1 1 A 128 128 LYS C C 128 176.080 175.459 0.621 1 1 1276 . 12 1 1 A 128 128 LYS CA C 128 56.860 57.136 -0.276 1 1 1277 . 12 1 1 A 128 128 LYS CB C 128 33.170 32.884 0.286 1 1 1281 . 12 1 1 A 128 128 LYS N N 128 116.520 125.054 -8.534 1 1 1282 . 12 1 1 A 129 129 ALA H H 129 8.590 8.467 0.123 1 1 1283 . 12 1 1 A 129 129 ALA HA H 129 4.390 4.639 -0.249 1 1 1287 . 12 1 1 A 129 129 ALA C C 129 174.970 176.262 -1.292 1 1 1288 . 12 1 1 A 129 129 ALA CA C 129 52.970 50.529 2.441 1 1 1289 . 12 1 1 A 129 129 ALA CB C 129 21.500 19.297 2.203 1 1 1290 . 12 1 1 A 129 129 ALA N N 129 124.710 129.461 -4.751 1 1 1291 . 12 1 1 A 130 130 GLU H H 130 8.660 8.597 0.063 1 1 1292 . 12 1 1 A 130 130 GLU HA H 130 4.660 3.929 0.731 1 1 1297 . 12 1 1 A 130 130 GLU C C 130 177.390 177.502 -0.112 1 1 1298 . 12 1 1 A 130 130 GLU CA C 130 55.070 58.492 -3.422 1 1 1299 . 12 1 1 A 130 130 GLU CB C 130 30.860 29.267 1.593 1 1 1301 . 12 1 1 A 130 130 GLU N N 130 123.180 124.366 -1.186 1 1 1302 . 12 1 1 A 131 131 GLY H H 131 9.170 9.126 0.044 1 1 1303 . 12 1 1 A 131 131 GLY HA2 H 131 3.560 3.974 -0.414 1 1 1304 . 12 1 1 A 131 131 GLY HA3 H 131 3.750 3.983 -0.233 1 1 1305 . 12 1 1 A 131 131 GLY C C 131 174.550 174.636 -0.086 1 1 1306 . 12 1 1 A 131 131 GLY CA C 131 47.660 45.246 2.414 1 1 1307 . 12 1 1 A 131 131 GLY N N 131 115.530 115.578 -0.048 1 1 1308 . 12 1 1 A 132 132 SER H H 132 8.430 8.222 0.208 1 1 1309 . 12 1 1 A 132 132 SER HA H 132 4.170 4.478 -0.308 1 1 1312 . 12 1 1 A 132 132 SER C C 132 175.350 174.235 1.115 1 1 1313 . 12 1 1 A 132 132 SER CA C 132 59.050 58.955 0.095 1 1 1314 . 12 1 1 A 132 132 SER CB C 132 64.880 62.657 2.223 1 1 1315 . 12 1 1 A 132 132 SER N N 132 115.930 117.260 -1.330 1 1 1316 . 12 1 1 A 133 133 ASN H H 133 8.850 8.449 0.401 1 1 1317 . 12 1 1 A 133 133 ASN HA H 133 4.910 4.847 0.063 1 1 1322 . 12 1 1 A 133 133 ASN C C 133 175.450 175.127 0.323 1 1 1323 . 12 1 1 A 133 133 ASN CA C 133 54.920 54.284 0.636 1 1 1324 . 12 1 1 A 133 133 ASN CB C 133 41.060 39.005 2.055 1 1 1325 . 12 1 1 A 133 133 ASN N N 133 125.590 124.833 0.757 1 1 1327 . 12 1 1 A 134 134 LEU H H 134 9.070 9.189 -0.119 1 1 1328 . 12 1 1 A 134 134 LEU HA H 134 5.230 5.414 -0.184 1 1 1338 . 12 1 1 A 134 134 LEU C C 134 175.240 175.195 0.045 1 1 1339 . 12 1 1 A 134 134 LEU CA C 134 53.470 53.951 -0.481 1 1 1340 . 12 1 1 A 134 134 LEU CB C 134 45.090 46.242 -1.152 1 1 1344 . 12 1 1 A 134 134 LEU N N 134 129.210 121.525 7.685 1 1 1345 . 12 1 1 A 135 135 SER H H 135 8.690 8.369 0.321 1 1 1346 . 12 1 1 A 135 135 SER HA H 135 5.280 5.232 0.048 1 1 1349 . 12 1 1 A 135 135 SER C C 135 173.590 172.892 0.698 1 1 1350 . 12 1 1 A 135 135 SER CA C 135 56.220 56.739 -0.519 1 1 1351 . 12 1 1 A 135 135 SER CB C 135 66.510 65.147 1.363 1 1 1352 . 12 1 1 A 135 135 SER N N 135 113.020 118.889 -5.869 1 1 1353 . 12 1 1 A 136 136 VAL H H 136 8.940 8.721 0.219 1 1 1354 . 12 1 1 A 136 136 VAL HA H 136 5.500 4.482 1.018 1 1 1362 . 12 1 1 A 136 136 VAL C C 136 175.730 175.590 0.140 1 1 1363 . 12 1 1 A 136 136 VAL CA C 136 60.960 61.635 -0.675 1 1 1364 . 12 1 1 A 136 136 VAL CB C 136 33.630 31.444 2.186 1 1 1367 . 12 1 1 A 136 136 VAL N N 136 124.340 127.644 -3.304 1 1 1368 . 12 1 1 A 137 137 THR H H 137 9.240 8.493 0.747 1 1 1369 . 12 1 1 A 137 137 THR HA H 137 4.920 4.747 0.173 1 1 1374 . 12 1 1 A 137 137 THR C C 137 173.500 174.087 -0.587 1 1 1375 . 12 1 1 A 137 137 THR CA C 137 59.120 60.224 -1.104 1 1 1376 . 12 1 1 A 137 137 THR CB C 137 72.500 70.665 1.835 1 1 1378 . 12 1 1 A 137 137 THR N N 137 117.010 118.567 -1.557 1 1 1379 . 12 1 1 A 138 138 ASN H H 138 9.190 8.812 0.378 1 1 1380 . 12 1 1 A 138 138 ASN HA H 138 4.420 4.281 0.139 1 1 1385 . 12 1 1 A 138 138 ASN C C 138 175.550 174.406 1.144 1 1 1386 . 12 1 1 A 138 138 ASN CA C 138 54.350 54.219 0.131 1 1 1387 . 12 1 1 A 138 138 ASN CB C 138 37.380 36.758 0.622 1 1 1388 . 12 1 1 A 138 138 ASN N N 138 115.270 118.188 -2.918 1 1 1390 . 12 1 1 A 139 139 SER H H 139 8.560 7.859 0.701 1 1 1391 . 12 1 1 A 139 139 SER HA H 139 5.800 4.250 1.550 1 1 1394 . 12 1 1 A 139 139 SER C C 139 175.750 173.783 1.967 1 1 1395 . 12 1 1 A 139 139 SER CA C 139 56.020 59.804 -3.784 1 1 1396 . 12 1 1 A 139 139 SER CB C 139 65.320 63.150 2.170 1 1 1397 . 12 1 1 A 139 139 SER N N 139 112.360 115.764 -3.404 1 1 1398 . 12 1 1 A 140 140 SER H H 140 9.900 8.409 1.491 1 1 1399 . 12 1 1 A 140 140 SER HA H 140 5.360 5.228 0.132 1 1 1402 . 12 1 1 A 140 140 SER C C 140 172.620 172.943 -0.323 1 1 1403 . 12 1 1 A 140 140 SER CA C 140 57.400 57.037 0.363 1 1 1404 . 12 1 1 A 140 140 SER CB C 140 66.550 65.860 0.690 1 1 1405 . 12 1 1 A 140 140 SER N N 140 119.130 122.193 -3.063 1 1 1406 . 12 1 1 A 141 141 VAL H H 141 9.030 8.736 0.294 1 1 1407 . 12 1 1 A 141 141 VAL HA H 141 5.520 4.975 0.545 1 1 1415 . 12 1 1 A 141 141 VAL C C 141 174.750 174.874 -0.124 1 1 1416 . 12 1 1 A 141 141 VAL CA C 141 58.310 59.913 -1.603 1 1 1417 . 12 1 1 A 141 141 VAL CB C 141 35.030 35.597 -0.567 1 1 1420 . 12 1 1 A 141 141 VAL N N 141 111.410 117.963 -6.553 1 1 1421 . 12 1 1 A 142 142 GLY H H 142 8.790 8.846 -0.056 1 1 1422 . 12 1 1 A 142 142 GLY HA2 H 142 3.600 3.972 -0.372 1 1 1423 . 12 1 1 A 142 142 GLY HA3 H 142 5.310 3.984 1.326 1 1 1424 . 12 1 1 A 142 142 GLY C C 142 174.180 173.286 0.894 1 1 1425 . 12 1 1 A 142 142 GLY CA C 142 44.110 47.113 -3.003 1 1 1426 . 12 1 1 A 142 142 GLY N N 142 109.330 111.705 -2.375 1 1 1427 . 12 1 1 A 143 143 ASP H H 143 8.840 8.916 -0.076 1 1 1428 . 12 1 1 A 143 143 ASP HA H 143 5.790 5.188 0.602 1 1 1431 . 12 1 1 A 143 143 ASP C C 143 178.860 178.069 0.791 1 1 1432 . 12 1 1 A 143 143 ASP CA C 143 53.040 55.032 -1.992 1 1 1433 . 12 1 1 A 143 143 ASP CB C 143 43.660 42.876 0.784 1 1 1434 . 12 1 1 A 143 143 ASP N N 143 125.390 125.224 0.166 1 1 1435 . 12 1 1 A 144 144 GLY H H 144 9.150 9.108 0.042 1 1 1436 . 12 1 1 A 144 144 GLY HA2 H 144 3.450 3.819 -0.369 1 1 1437 . 12 1 1 A 144 144 GLY HA3 H 144 3.720 3.931 -0.211 1 1 1438 . 12 1 1 A 144 144 GLY C C 144 174.770 175.529 -0.759 1 1 1439 . 12 1 1 A 144 144 GLY CA C 144 46.930 47.401 -0.471 1 1 1440 . 12 1 1 A 144 144 GLY N N 144 106.470 111.526 -5.056 1 1 1441 . 12 1 1 A 145 145 GLU H H 145 8.470 7.950 0.520 1 1 1442 . 12 1 1 A 145 145 GLU HA H 145 4.460 4.314 0.146 1 1 1447 . 12 1 1 A 145 145 GLU C C 145 176.520 176.459 0.061 1 1 1448 . 12 1 1 A 145 145 GLU CA C 145 55.330 56.992 -1.662 1 1 1449 . 12 1 1 A 145 145 GLU CB C 145 30.620 29.868 0.752 1 1 1451 . 12 1 1 A 145 145 GLU N N 145 119.170 119.379 -0.209 1 1 1452 . 12 1 1 A 146 146 GLY H H 146 7.950 7.999 -0.049 1 1 1453 . 12 1 1 A 146 146 GLY HA2 H 146 3.630 4.055 -0.425 1 1 1454 . 12 1 1 A 146 146 GLY HA3 H 146 4.130 4.061 0.069 1 1 1455 . 12 1 1 A 146 146 GLY C C 146 174.350 173.821 0.529 1 1 1456 . 12 1 1 A 146 146 GLY CA C 146 45.330 44.949 0.381 1 1 1457 . 12 1 1 A 146 146 GLY N N 146 108.130 106.457 1.673 1 1 1458 . 12 1 1 A 147 147 LEU H H 147 8.440 8.009 0.431 1 1 1459 . 12 1 1 A 147 147 LEU HA H 147 4.340 4.457 -0.117 1 1 1469 . 12 1 1 A 147 147 LEU C C 147 175.950 175.442 0.508 1 1 1470 . 12 1 1 A 147 147 LEU CA C 147 54.860 53.843 1.017 1 1 1471 . 12 1 1 A 147 147 LEU CB C 147 41.590 43.660 -2.070 1 1 1475 . 12 1 1 A 147 147 LEU N N 147 124.000 123.099 0.901 1 1 1476 . 12 1 1 A 148 148 VAL H H 148 7.780 8.736 -0.956 1 1 1477 . 12 1 1 A 148 148 VAL HA H 148 4.830 4.529 0.301 1 1 1485 . 12 1 1 A 148 148 VAL C C 148 175.740 174.658 1.082 1 1 1486 . 12 1 1 A 148 148 VAL CA C 148 61.140 62.517 -1.377 1 1 1487 . 12 1 1 A 148 148 VAL CB C 148 33.640 32.441 1.199 1 1 1490 . 12 1 1 A 148 148 VAL N N 148 120.440 126.606 -6.166 1 1 1491 . 12 1 1 A 149 149 HIS H H 149 9.170 8.965 0.205 1 1 1492 . 12 1 1 A 149 149 HIS HA H 149 4.950 4.876 0.074 1 1 1496 . 12 1 1 A 149 149 HIS C C 149 174.780 174.739 0.041 1 1 1497 . 12 1 1 A 149 149 HIS CA C 149 53.900 55.097 -1.197 1 1 1498 . 12 1 1 A 149 149 HIS CB C 149 32.200 28.712 3.488 1 1 1499 . 12 1 1 A 149 149 HIS N N 149 124.700 128.484 -3.784 1 1 1500 . 12 1 1 A 150 150 GLU H H 150 9.060 8.656 0.404 1 1 1501 . 12 1 1 A 150 150 GLU HA H 150 4.420 4.258 0.162 1 1 1506 . 12 1 1 A 150 150 GLU C C 150 176.520 176.665 -0.145 1 1 1507 . 12 1 1 A 150 150 GLU CA C 150 57.630 56.775 0.855 1 1 1508 . 12 1 1 A 150 150 GLU CB C 150 30.370 29.772 0.598 1 1 1510 . 12 1 1 A 150 150 GLU N N 150 125.540 123.798 1.742 1 1 1511 . 12 1 1 A 151 151 ILE H H 151 8.150 8.139 0.011 1 1 1512 . 12 1 1 A 151 151 ILE HA H 151 4.780 4.482 0.298 1 1 1522 . 12 1 1 A 151 151 ILE C C 151 174.570 176.276 -1.706 1 1 1523 . 12 1 1 A 151 151 ILE CA C 151 59.390 59.693 -0.303 1 1 1524 . 12 1 1 A 151 151 ILE CB C 151 42.040 39.881 2.159 1 1 1528 . 12 1 1 A 151 151 ILE N N 151 115.880 122.013 -6.133 1 1 1529 . 12 1 1 A 152 152 ALA H H 152 8.010 8.690 -0.680 1 1 1530 . 12 1 1 A 152 152 ALA HA H 152 4.310 4.375 -0.065 1 1 1534 . 12 1 1 A 152 152 ALA C C 152 177.500 176.648 0.852 1 1 1535 . 12 1 1 A 152 152 ALA CA C 152 53.680 51.553 2.127 1 1 1536 . 12 1 1 A 152 152 ALA CB C 152 20.050 19.558 0.492 1 1 1537 . 12 1 1 A 152 152 ALA N N 152 126.640 124.741 1.899 1 1 1538 . 12 1 1 A 153 153 GLY H H 153 8.340 8.363 -0.023 1 1 1539 . 12 1 1 A 153 153 GLY HA2 H 153 4.050 4.252 -0.202 1 1 1540 . 12 1 1 A 153 153 GLY HA3 H 153 4.140 4.260 -0.120 1 1 1541 . 12 1 1 A 153 153 GLY C C 153 173.140 171.462 1.678 1 1 1542 . 12 1 1 A 153 153 GLY CA C 153 44.130 46.112 -1.982 1 1 1543 . 12 1 1 A 153 153 GLY N N 153 107.490 105.423 2.067 1 1 1544 . 12 1 1 A 154 154 THR H H 154 7.380 8.337 -0.957 1 1 1545 . 12 1 1 A 154 154 THR HA H 154 4.700 5.070 -0.370 1 1 1550 . 12 1 1 A 154 154 THR C C 154 171.120 172.880 -1.760 1 1 1551 . 12 1 1 A 154 154 THR CA C 154 60.830 61.084 -0.254 1 1 1552 . 12 1 1 A 154 154 THR CB C 154 68.850 72.455 -3.605 1 1 1554 . 12 1 1 A 154 154 THR N N 154 109.340 114.116 -4.776 1 1 1555 . 12 1 1 A 155 155 GLU H H 155 8.020 8.938 -0.918 1 1 1556 . 12 1 1 A 155 155 GLU HA H 155 5.370 5.331 0.039 1 1 1561 . 12 1 1 A 155 155 GLU C C 155 174.240 174.889 -0.649 1 1 1562 . 12 1 1 A 155 155 GLU CA C 155 54.830 54.829 0.001 1 1 1563 . 12 1 1 A 155 155 GLU CB C 155 33.620 32.423 1.197 1 1 1565 . 12 1 1 A 155 155 GLU N N 155 118.690 126.228 -7.538 1 1 1566 . 12 1 1 A 156 156 LYS H H 156 9.230 9.409 -0.179 1 1 1567 . 12 1 1 A 156 156 LYS HA H 156 4.650 4.951 -0.301 1 1 1576 . 12 1 1 A 156 156 LYS C C 156 174.000 174.661 -0.661 1 1 1577 . 12 1 1 A 156 156 LYS CA C 156 55.840 55.686 0.154 1 1 1578 . 12 1 1 A 156 156 LYS CB C 156 37.550 36.630 0.920 1 1 1582 . 12 1 1 A 156 156 LYS N N 156 121.940 124.805 -2.865 1 1 1583 . 12 1 1 A 157 157 THR H H 157 8.160 8.736 -0.576 1 1 1584 . 12 1 1 A 157 157 THR HA H 157 5.440 5.147 0.293 1 1 1589 . 12 1 1 A 157 157 THR C C 157 174.360 173.758 0.602 1 1 1590 . 12 1 1 A 157 157 THR CA C 157 60.410 60.432 -0.022 1 1 1591 . 12 1 1 A 157 157 THR CB C 157 71.500 71.327 0.173 1 1 1593 . 12 1 1 A 157 157 THR N N 157 113.240 113.191 0.049 1 1 1594 . 12 1 1 A 158 158 VAL H H 158 9.120 8.675 0.445 1 1 1595 . 12 1 1 A 158 158 VAL HA H 158 4.580 5.262 -0.682 1 1 1603 . 12 1 1 A 158 158 VAL C C 158 172.800 174.544 -1.744 1 1 1604 . 12 1 1 A 158 158 VAL CA C 158 59.980 59.988 -0.008 1 1 1605 . 12 1 1 A 158 158 VAL CB C 158 36.290 34.726 1.564 1 1 1608 . 12 1 1 A 158 158 VAL N N 158 121.710 120.166 1.544 1 1 1609 . 12 1 1 A 159 159 ASN H H 159 8.240 8.557 -0.317 1 1 1610 . 12 1 1 A 159 159 ASN HA H 159 5.420 5.031 0.389 1 1 1615 . 12 1 1 A 159 159 ASN C C 159 173.800 174.642 -0.842 1 1 1616 . 12 1 1 A 159 159 ASN CA C 159 51.740 52.524 -0.784 1 1 1617 . 12 1 1 A 159 159 ASN CB C 159 40.380 39.143 1.237 1 1 1618 . 12 1 1 A 159 159 ASN N N 159 122.730 124.102 -1.372 1 1 1620 . 12 1 1 A 160 160 ILE H H 160 9.160 8.521 0.639 1 1 1621 . 12 1 1 A 160 160 ILE HA H 160 5.130 4.668 0.462 1 1 1631 . 12 1 1 A 160 160 ILE C C 160 177.320 175.391 1.929 1 1 1632 . 12 1 1 A 160 160 ILE CA C 160 60.640 61.600 -0.960 1 1 1633 . 12 1 1 A 160 160 ILE CB C 160 38.520 37.821 0.699 1 1 1637 . 12 1 1 A 160 160 ILE N N 160 123.690 125.065 -1.375 1 1 1638 . 12 1 1 A 161 161 ILE H H 161 8.780 8.755 0.025 1 1 1639 . 12 1 1 A 161 161 ILE HA H 161 4.590 4.444 0.146 1 1 1649 . 12 1 1 A 161 161 ILE C C 161 174.960 175.234 -0.274 1 1 1650 . 12 1 1 A 161 161 ILE CA C 161 59.320 60.071 -0.751 1 1 1651 . 12 1 1 A 161 161 ILE CB C 161 41.030 41.542 -0.512 1 1 1655 . 12 1 1 A 161 161 ILE N N 161 122.490 126.681 -4.191 1 1 1656 . 12 1 1 A 162 162 GLU H H 162 8.620 8.602 0.018 1 1 1657 . 12 1 1 A 162 162 GLU HA H 162 4.290 4.294 -0.004 1 1 1662 . 12 1 1 A 162 162 GLU C C 162 176.660 176.449 0.211 1 1 1663 . 12 1 1 A 162 162 GLU CA C 162 56.470 57.700 -1.230 1 1 1664 . 12 1 1 A 162 162 GLU CB C 162 31.150 30.543 0.607 1 1 1666 . 12 1 1 A 162 162 GLU N N 162 120.520 127.073 -6.553 1 1 1667 . 12 1 1 A 163 163 GLY H H 163 8.480 8.320 0.160 1 1 1668 . 12 1 1 A 163 163 GLY HA2 H 163 3.910 4.133 -0.223 1 1 1669 . 12 1 1 A 163 163 GLY HA3 H 163 4.150 4.134 0.016 1 1 1670 . 12 1 1 A 163 163 GLY C C 163 174.000 173.375 0.625 1 1 1671 . 12 1 1 A 163 163 GLY CA C 163 45.270 44.484 0.786 1 1 1672 . 12 1 1 A 163 163 GLY N N 163 110.210 109.834 0.376 1 1 1673 . 12 1 1 A 164 164 THR H H 164 8.170 8.455 -0.285 1 1 1674 . 12 1 1 A 164 164 THR HA H 164 4.410 4.413 -0.003 1 1 1679 . 12 1 1 A 164 164 THR C C 164 174.100 175.111 -1.011 1 1 1680 . 12 1 1 A 164 164 THR CA C 164 61.620 62.015 -0.395 1 1 1681 . 12 1 1 A 164 164 THR CB C 164 70.060 69.557 0.503 1 1 1683 . 12 1 1 A 164 164 THR N N 164 113.480 117.023 -3.543 1 1 1 . 13 1 1 A 13 13 GLY H H 13 8.350 8.377 -0.027 1 1 2 . 13 1 1 A 13 13 GLY HA2 H 13 3.920 4.193 -0.273 1 1 3 . 13 1 1 A 13 13 GLY HA3 H 13 3.920 4.196 -0.276 1 1 4 . 13 1 1 A 13 13 GLY CA C 13 45.290 45.623 -0.333 1 1 5 . 13 1 1 A 13 13 GLY N N 13 110.450 109.636 0.814 1 1 6 . 13 1 1 A 14 14 LEU H H 14 8.050 8.730 -0.680 1 1 7 . 13 1 1 A 14 14 LEU N N 14 121.500 125.157 -3.657 1 1 8 . 13 1 1 A 15 15 VAL H H 15 8.070 7.920 0.150 1 1 9 . 13 1 1 A 15 15 VAL N N 15 122.390 117.217 5.173 1 1 10 . 13 1 1 A 16 16 PRO HA H 16 4.360 4.437 -0.077 1 1 17 . 13 1 1 A 16 16 PRO CA C 16 62.770 63.474 -0.704 1 1 18 . 13 1 1 A 16 16 PRO CB C 16 32.020 32.066 -0.046 1 1 21 . 13 1 1 A 21 21 MET H H 21 8.180 7.904 0.276 1 1 22 . 13 1 1 A 21 21 MET N N 21 121.310 115.588 5.722 1 1 23 . 13 1 1 A 22 22 ALA H H 22 8.290 7.541 0.749 1 1 24 . 13 1 1 A 22 22 ALA N N 22 124.800 122.124 2.676 1 1 25 . 13 1 1 A 23 23 SER H H 23 8.210 9.076 -0.866 1 1 26 . 13 1 1 A 23 23 SER N N 23 114.830 119.769 -4.939 1 1 27 . 13 1 1 A 24 24 LYS H H 24 8.250 8.621 -0.371 1 1 28 . 13 1 1 A 24 24 LYS N N 24 122.980 123.204 -0.224 1 1 29 . 13 1 1 A 25 25 LEU H H 25 8.140 8.392 -0.252 1 1 30 . 13 1 1 A 25 25 LEU HA H 25 4.290 4.550 -0.260 1 1 40 . 13 1 1 A 25 25 LEU C C 25 177.410 176.067 1.343 1 1 41 . 13 1 1 A 25 25 LEU CA C 25 55.430 54.227 1.203 1 1 42 . 13 1 1 A 25 25 LEU CB C 25 42.350 41.475 0.875 1 1 46 . 13 1 1 A 25 25 LEU N N 25 122.580 121.952 0.628 1 1 47 . 13 1 1 A 26 26 LYS H H 26 8.200 8.452 -0.252 1 1 48 . 13 1 1 A 26 26 LYS HA H 26 4.260 4.528 -0.268 1 1 57 . 13 1 1 A 26 26 LYS C C 26 176.520 175.162 1.358 1 1 58 . 13 1 1 A 26 26 LYS CA C 26 56.700 57.825 -1.125 1 1 59 . 13 1 1 A 26 26 LYS CB C 26 33.060 35.638 -2.578 1 1 63 . 13 1 1 A 26 26 LYS N N 26 121.800 123.086 -1.286 1 1 64 . 13 1 1 A 27 27 GLU H H 27 8.380 7.762 0.618 1 1 65 . 13 1 1 A 27 27 GLU HA H 27 4.240 4.886 -0.646 1 1 70 . 13 1 1 A 27 27 GLU C C 27 176.130 174.494 1.636 1 1 71 . 13 1 1 A 27 27 GLU CA C 27 56.700 54.870 1.830 1 1 72 . 13 1 1 A 27 27 GLU CB C 27 30.370 34.114 -3.744 1 1 74 . 13 1 1 A 27 27 GLU N N 27 121.700 115.815 5.885 1 1 75 . 13 1 1 A 28 28 ALA H H 28 8.230 8.533 -0.303 1 1 76 . 13 1 1 A 28 28 ALA HA H 28 4.280 5.062 -0.782 1 1 80 . 13 1 1 A 28 28 ALA C C 28 177.090 175.848 1.242 1 1 81 . 13 1 1 A 28 28 ALA CA C 28 52.530 51.438 1.092 1 1 82 . 13 1 1 A 28 28 ALA CB C 28 19.360 23.424 -4.064 1 1 83 . 13 1 1 A 28 28 ALA N N 28 124.640 121.837 2.803 1 1 84 . 13 1 1 A 29 29 ALA H H 29 8.150 8.407 -0.257 1 1 85 . 13 1 1 A 29 29 ALA HA H 29 4.320 4.715 -0.395 1 1 89 . 13 1 1 A 29 29 ALA C C 29 177.120 175.809 1.311 1 1 90 . 13 1 1 A 29 29 ALA CA C 29 52.040 51.983 0.057 1 1 91 . 13 1 1 A 29 29 ALA CB C 29 19.430 18.907 0.523 1 1 92 . 13 1 1 A 29 29 ALA N N 29 123.430 121.711 1.719 1 1 93 . 13 1 1 A 30 30 GLU H H 30 8.310 8.786 -0.476 1 1 94 . 13 1 1 A 30 30 GLU HA H 30 4.220 4.703 -0.483 1 1 99 . 13 1 1 A 30 30 GLU C C 30 176.310 175.722 0.588 1 1 100 . 13 1 1 A 30 30 GLU CA C 30 56.630 56.032 0.598 1 1 101 . 13 1 1 A 30 30 GLU CB C 30 30.320 30.282 0.038 1 1 103 . 13 1 1 A 30 30 GLU N N 30 120.630 122.402 -1.772 1 1 104 . 13 1 1 A 31 31 VAL H H 31 8.630 8.797 -0.167 1 1 105 . 13 1 1 A 31 31 VAL HA H 31 4.430 4.605 -0.175 1 1 113 . 13 1 1 A 31 31 VAL C C 31 176.510 176.942 -0.432 1 1 114 . 13 1 1 A 31 31 VAL CA C 31 62.360 63.152 -0.792 1 1 115 . 13 1 1 A 31 31 VAL CB C 31 32.370 31.687 0.683 1 1 118 . 13 1 1 A 31 31 VAL N N 31 127.110 126.334 0.776 1 1 119 . 13 1 1 A 32 32 THR H H 32 7.640 8.701 -1.061 1 1 120 . 13 1 1 A 32 32 THR HA H 32 4.870 3.898 0.972 1 1 125 . 13 1 1 A 32 32 THR C C 32 172.220 174.720 -2.500 1 1 126 . 13 1 1 A 32 32 THR CA C 32 59.510 65.116 -5.606 1 1 127 . 13 1 1 A 32 32 THR CB C 32 71.630 69.555 2.075 1 1 129 . 13 1 1 A 32 32 THR N N 32 118.860 121.180 -2.320 1 1 130 . 13 1 1 A 33 33 GLY H H 33 8.350 8.011 0.339 1 1 131 . 13 1 1 A 33 33 GLY HA2 H 33 4.160 3.955 0.205 1 1 132 . 13 1 1 A 33 33 GLY HA3 H 33 4.250 3.960 0.290 1 1 133 . 13 1 1 A 33 33 GLY C C 33 172.820 173.162 -0.342 1 1 134 . 13 1 1 A 33 33 GLY CA C 33 46.680 46.042 0.638 1 1 135 . 13 1 1 A 33 33 GLY N N 33 106.720 108.898 -2.178 1 1 136 . 13 1 1 A 34 34 SER H H 34 8.810 7.984 0.826 1 1 137 . 13 1 1 A 34 34 SER HA H 34 5.390 4.892 0.498 1 1 140 . 13 1 1 A 34 34 SER C C 34 173.780 172.851 0.929 1 1 141 . 13 1 1 A 34 34 SER CA C 34 57.380 57.438 -0.058 1 1 142 . 13 1 1 A 34 34 SER CB C 34 65.730 65.576 0.154 1 1 143 . 13 1 1 A 34 34 SER N N 34 112.690 118.907 -6.217 1 1 144 . 13 1 1 A 35 35 VAL H H 35 8.470 8.750 -0.280 1 1 145 . 13 1 1 A 35 35 VAL HA H 35 4.120 4.860 -0.740 1 1 153 . 13 1 1 A 35 35 VAL C C 35 174.750 174.216 0.534 1 1 154 . 13 1 1 A 35 35 VAL CA C 35 62.310 60.475 1.835 1 1 155 . 13 1 1 A 35 35 VAL CB C 35 34.550 33.235 1.315 1 1 158 . 13 1 1 A 35 35 VAL N N 35 123.150 122.030 1.120 1 1 159 . 13 1 1 A 36 36 SER H H 36 8.240 8.521 -0.281 1 1 160 . 13 1 1 A 36 36 SER HA H 36 4.690 4.764 -0.074 1 1 163 . 13 1 1 A 36 36 SER C C 36 171.860 173.167 -1.307 1 1 164 . 13 1 1 A 36 36 SER CA C 36 56.020 56.535 -0.515 1 1 165 . 13 1 1 A 36 36 SER CB C 36 66.050 63.902 2.148 1 1 166 . 13 1 1 A 36 36 SER N N 36 118.760 121.065 -2.305 1 1 167 . 13 1 1 A 37 37 LEU H H 37 8.310 8.907 -0.597 1 1 168 . 13 1 1 A 37 37 LEU HA H 37 4.870 4.898 -0.028 1 1 178 . 13 1 1 A 37 37 LEU C C 37 174.190 175.414 -1.224 1 1 179 . 13 1 1 A 37 37 LEU CA C 37 53.870 53.949 -0.079 1 1 180 . 13 1 1 A 37 37 LEU CB C 37 47.000 43.854 3.146 1 1 184 . 13 1 1 A 37 37 LEU N N 37 124.790 130.679 -5.889 1 1 185 . 13 1 1 A 38 38 GLU H H 38 9.270 8.792 0.478 1 1 186 . 13 1 1 A 38 38 GLU HA H 38 4.650 5.129 -0.479 1 1 191 . 13 1 1 A 38 38 GLU C C 38 173.970 175.342 -1.372 1 1 192 . 13 1 1 A 38 38 GLU CA C 38 54.410 55.700 -1.290 1 1 193 . 13 1 1 A 38 38 GLU CB C 38 32.460 32.317 0.143 1 1 195 . 13 1 1 A 38 38 GLU N N 38 126.550 127.285 -0.735 1 1 196 . 13 1 1 A 39 39 ALA H H 39 8.120 8.540 -0.420 1 1 197 . 13 1 1 A 39 39 ALA HA H 39 4.600 4.697 -0.097 1 1 201 . 13 1 1 A 39 39 ALA C C 39 175.930 176.907 -0.977 1 1 202 . 13 1 1 A 39 39 ALA CA C 39 51.570 51.020 0.550 1 1 203 . 13 1 1 A 39 39 ALA CB C 39 21.780 22.950 -1.170 1 1 204 . 13 1 1 A 39 39 ALA N N 39 124.410 128.816 -4.406 1 1 205 . 13 1 1 A 40 40 LEU H H 40 7.860 8.941 -1.081 1 1 206 . 13 1 1 A 40 40 LEU HA H 40 4.230 4.043 0.187 1 1 216 . 13 1 1 A 40 40 LEU C C 40 175.940 176.396 -0.456 1 1 217 . 13 1 1 A 40 40 LEU CA C 40 55.360 56.024 -0.664 1 1 218 . 13 1 1 A 40 40 LEU CB C 40 42.990 42.677 0.313 1 1 222 . 13 1 1 A 40 40 LEU N N 40 120.640 120.725 -0.085 1 1 223 . 13 1 1 A 41 41 GLU H H 41 8.210 7.876 0.334 1 1 224 . 13 1 1 A 41 41 GLU HA H 41 4.240 4.072 0.168 1 1 229 . 13 1 1 A 41 41 GLU C C 41 176.920 174.890 2.030 1 1 230 . 13 1 1 A 41 41 GLU CA C 41 58.090 57.772 0.318 1 1 231 . 13 1 1 A 41 41 GLU CB C 41 30.530 27.168 3.362 1 1 233 . 13 1 1 A 41 41 GLU N N 41 114.680 116.762 -2.082 1 1 234 . 13 1 1 A 42 42 GLU H H 42 7.490 7.798 -0.308 1 1 235 . 13 1 1 A 42 42 GLU HA H 42 5.680 4.799 0.881 1 1 240 . 13 1 1 A 42 42 GLU C C 42 173.790 174.188 -0.398 1 1 241 . 13 1 1 A 42 42 GLU CA C 42 54.360 56.088 -1.728 1 1 242 . 13 1 1 A 42 42 GLU CB C 42 33.850 33.379 0.471 1 1 244 . 13 1 1 A 42 42 GLU N N 42 116.670 118.572 -1.902 1 1 245 . 13 1 1 A 43 43 VAL H H 43 8.550 8.877 -0.327 1 1 246 . 13 1 1 A 43 43 VAL HA H 43 4.550 4.644 -0.094 1 1 254 . 13 1 1 A 43 43 VAL C C 43 172.220 173.745 -1.525 1 1 255 . 13 1 1 A 43 43 VAL CA C 43 59.470 60.525 -1.055 1 1 256 . 13 1 1 A 43 43 VAL CB C 43 35.470 34.764 0.706 1 1 259 . 13 1 1 A 43 43 VAL N N 43 120.030 124.992 -4.962 1 1 260 . 13 1 1 A 44 44 GLN H H 44 8.470 8.616 -0.146 1 1 261 . 13 1 1 A 44 44 GLN HA H 44 4.890 4.723 0.167 1 1 268 . 13 1 1 A 44 44 GLN C C 44 176.130 175.888 0.242 1 1 269 . 13 1 1 A 44 44 GLN CA C 44 54.360 55.839 -1.479 1 1 270 . 13 1 1 A 44 44 GLN CB C 44 30.610 28.969 1.641 1 1 272 . 13 1 1 A 44 44 GLN N N 44 124.690 130.162 -5.472 1 1 274 . 13 1 1 A 45 45 VAL H H 45 8.130 8.181 -0.051 1 1 275 . 13 1 1 A 45 45 VAL HA H 45 3.030 3.932 -0.902 1 1 283 . 13 1 1 A 45 45 VAL C C 45 176.710 177.207 -0.497 1 1 284 . 13 1 1 A 45 45 VAL CA C 45 65.810 64.746 1.064 1 1 285 . 13 1 1 A 45 45 VAL CB C 45 31.960 31.447 0.513 1 1 288 . 13 1 1 A 45 45 VAL N N 45 120.450 127.246 -6.796 1 1 289 . 13 1 1 A 46 46 GLY H H 46 8.950 9.959 -1.009 1 1 290 . 13 1 1 A 46 46 GLY HA2 H 46 3.590 4.014 -0.424 1 1 291 . 13 1 1 A 46 46 GLY HA3 H 46 4.410 4.015 0.395 1 1 292 . 13 1 1 A 46 46 GLY C C 46 174.390 173.996 0.394 1 1 293 . 13 1 1 A 46 46 GLY CA C 46 44.730 44.937 -0.207 1 1 294 . 13 1 1 A 46 46 GLY N N 46 116.490 115.187 1.303 1 1 295 . 13 1 1 A 47 47 GLU H H 47 8.260 7.812 0.448 1 1 296 . 13 1 1 A 47 47 GLU HA H 47 4.460 4.701 -0.241 1 1 301 . 13 1 1 A 47 47 GLU C C 47 174.780 175.158 -0.378 1 1 302 . 13 1 1 A 47 47 GLU CA C 47 54.830 55.230 -0.400 1 1 303 . 13 1 1 A 47 47 GLU CB C 47 31.140 31.722 -0.582 1 1 305 . 13 1 1 A 47 47 GLU N N 47 120.520 121.494 -0.974 1 1 306 . 13 1 1 A 48 48 ASN H H 48 8.440 8.783 -0.343 1 1 307 . 13 1 1 A 48 48 ASN HA H 48 5.380 5.575 -0.195 1 1 312 . 13 1 1 A 48 48 ASN C C 48 174.770 173.883 0.887 1 1 313 . 13 1 1 A 48 48 ASN CA C 48 51.570 51.867 -0.297 1 1 314 . 13 1 1 A 48 48 ASN CB C 48 39.010 41.607 -2.597 1 1 315 . 13 1 1 A 48 48 ASN N N 48 117.180 120.145 -2.965 1 1 317 . 13 1 1 A 49 49 LEU H H 49 9.810 8.893 0.917 1 1 318 . 13 1 1 A 49 49 LEU HA H 49 4.510 5.173 -0.663 1 1 328 . 13 1 1 A 49 49 LEU C C 49 174.560 175.027 -0.467 1 1 329 . 13 1 1 A 49 49 LEU CA C 49 53.460 53.523 -0.063 1 1 330 . 13 1 1 A 49 49 LEU CB C 49 45.520 45.269 0.251 1 1 333 . 13 1 1 A 49 49 LEU N N 49 125.620 126.157 -0.537 1 1 334 . 13 1 1 A 50 50 GLU H H 50 8.750 9.107 -0.357 1 1 335 . 13 1 1 A 50 50 GLU HA H 50 4.360 4.949 -0.589 1 1 340 . 13 1 1 A 50 50 GLU C C 50 175.340 174.962 0.378 1 1 341 . 13 1 1 A 50 50 GLU CA C 50 55.550 54.851 0.699 1 1 342 . 13 1 1 A 50 50 GLU CB C 50 29.890 33.112 -3.222 1 1 344 . 13 1 1 A 50 50 GLU N N 50 125.420 124.288 1.132 1 1 345 . 13 1 1 A 51 51 VAL H H 51 9.230 8.864 0.366 1 1 346 . 13 1 1 A 51 51 VAL HA H 51 4.190 4.816 -0.626 1 1 354 . 13 1 1 A 51 51 VAL C C 51 175.310 174.589 0.721 1 1 355 . 13 1 1 A 51 51 VAL CA C 51 62.520 60.656 1.864 1 1 356 . 13 1 1 A 51 51 VAL CB C 51 31.470 33.522 -2.052 1 1 359 . 13 1 1 A 51 51 VAL N N 51 129.810 117.950 11.860 1 1 360 . 13 1 1 A 52 52 GLY H H 52 9.410 8.365 1.045 1 1 361 . 13 1 1 A 52 52 GLY HA2 H 52 3.460 3.896 -0.436 1 1 362 . 13 1 1 A 52 52 GLY HA3 H 52 4.680 3.932 0.748 1 1 363 . 13 1 1 A 52 52 GLY C C 52 173.000 173.325 -0.325 1 1 364 . 13 1 1 A 52 52 GLY CA C 52 46.470 47.480 -1.010 1 1 365 . 13 1 1 A 52 52 GLY N N 52 116.600 112.964 3.636 1 1 366 . 13 1 1 A 53 53 VAL H H 53 9.130 9.085 0.045 1 1 367 . 13 1 1 A 53 53 VAL HA H 53 4.840 4.810 0.030 1 1 375 . 13 1 1 A 53 53 VAL C C 53 175.470 175.243 0.227 1 1 376 . 13 1 1 A 53 53 VAL CA C 53 61.350 61.557 -0.207 1 1 377 . 13 1 1 A 53 53 VAL CB C 53 34.300 31.721 2.579 1 1 380 . 13 1 1 A 53 53 VAL N N 53 129.050 122.203 6.847 1 1 381 . 13 1 1 A 54 54 GLY H H 54 8.420 8.522 -0.102 1 1 382 . 13 1 1 A 54 54 GLY HA2 H 54 3.850 3.890 -0.040 1 1 383 . 13 1 1 A 54 54 GLY HA3 H 54 3.850 3.960 -0.110 1 1 384 . 13 1 1 A 54 54 GLY C C 54 173.310 172.837 0.473 1 1 385 . 13 1 1 A 54 54 GLY CA C 54 45.180 44.294 0.886 1 1 386 . 13 1 1 A 54 54 GLY N N 54 116.890 115.273 1.617 1 1 387 . 13 1 1 A 55 55 ILE H H 55 10.190 8.144 2.046 1 1 388 . 13 1 1 A 55 55 ILE HA H 55 4.010 4.620 -0.610 1 1 398 . 13 1 1 A 55 55 ILE C C 55 174.380 175.241 -0.861 1 1 399 . 13 1 1 A 55 55 ILE CA C 55 61.350 59.779 1.571 1 1 400 . 13 1 1 A 55 55 ILE CB C 55 40.840 39.797 1.043 1 1 404 . 13 1 1 A 55 55 ILE N N 55 129.330 121.924 7.406 1 1 405 . 13 1 1 A 56 56 ASP H H 56 8.810 9.585 -0.775 1 1 406 . 13 1 1 A 56 56 ASP HA H 56 4.440 4.676 -0.236 1 1 409 . 13 1 1 A 56 56 ASP C C 56 175.530 175.341 0.189 1 1 410 . 13 1 1 A 56 56 ASP CA C 56 56.460 55.368 1.092 1 1 411 . 13 1 1 A 56 56 ASP CB C 56 42.720 42.710 0.010 1 1 412 . 13 1 1 A 56 56 ASP N N 56 128.310 127.834 0.476 1 1 413 . 13 1 1 A 57 57 GLU H H 57 7.270 7.650 -0.380 1 1 414 . 13 1 1 A 57 57 GLU HA H 57 4.290 4.798 -0.508 1 1 419 . 13 1 1 A 57 57 GLU C C 57 173.370 174.462 -1.092 1 1 420 . 13 1 1 A 57 57 GLU CA C 57 54.840 55.546 -0.706 1 1 421 . 13 1 1 A 57 57 GLU CB C 57 33.190 33.575 -0.385 1 1 423 . 13 1 1 A 57 57 GLU N N 57 112.810 115.883 -3.073 1 1 424 . 13 1 1 A 58 58 LEU H H 58 8.370 8.525 -0.155 1 1 425 . 13 1 1 A 58 58 LEU HA H 58 4.830 4.681 0.149 1 1 434 . 13 1 1 A 58 58 LEU C C 58 174.180 174.548 -0.368 1 1 435 . 13 1 1 A 58 58 LEU CA C 58 55.320 54.862 0.458 1 1 436 . 13 1 1 A 58 58 LEU CB C 58 44.300 42.936 1.364 1 1 439 . 13 1 1 A 58 58 LEU N N 58 123.130 125.193 -2.063 1 1 440 . 13 1 1 A 59 59 VAL H H 59 9.120 8.718 0.402 1 1 441 . 13 1 1 A 59 59 VAL HA H 59 4.240 4.925 -0.685 1 1 449 . 13 1 1 A 59 59 VAL C C 59 174.960 175.390 -0.430 1 1 450 . 13 1 1 A 59 59 VAL CA C 59 61.760 60.345 1.415 1 1 451 . 13 1 1 A 59 59 VAL CB C 59 33.760 33.189 0.571 1 1 454 . 13 1 1 A 59 59 VAL N N 59 127.930 122.439 5.491 1 1 455 . 13 1 1 A 60 60 ASN H H 60 8.770 8.504 0.266 1 1 456 . 13 1 1 A 60 60 ASN HA H 60 4.250 4.716 -0.466 1 1 461 . 13 1 1 A 60 60 ASN C C 60 172.810 173.782 -0.972 1 1 462 . 13 1 1 A 60 60 ASN CA C 60 54.830 54.609 0.221 1 1 463 . 13 1 1 A 60 60 ASN CB C 60 36.030 36.427 -0.397 1 1 464 . 13 1 1 A 60 60 ASN N N 60 115.500 119.909 -4.409 1 1 466 . 13 1 1 A 61 61 ALA H H 61 7.330 7.356 -0.026 1 1 467 . 13 1 1 A 61 61 ALA HA H 61 4.520 4.860 -0.340 1 1 471 . 13 1 1 A 61 61 ALA C C 61 174.580 175.171 -0.591 1 1 472 . 13 1 1 A 61 61 ALA CA C 61 51.560 51.276 0.284 1 1 473 . 13 1 1 A 61 61 ALA CB C 61 22.870 22.915 -0.045 1 1 474 . 13 1 1 A 61 61 ALA N N 61 115.640 118.255 -2.615 1 1 475 . 13 1 1 A 62 62 GLU H H 62 7.900 9.138 -1.238 1 1 476 . 13 1 1 A 62 62 GLU HA H 62 4.310 4.861 -0.551 1 1 481 . 13 1 1 A 62 62 GLU C C 62 173.790 175.293 -1.503 1 1 482 . 13 1 1 A 62 62 GLU CA C 62 55.080 54.783 0.297 1 1 483 . 13 1 1 A 62 62 GLU CB C 62 32.610 30.467 2.143 1 1 485 . 13 1 1 A 62 62 GLU N N 62 117.400 121.060 -3.660 1 1 486 . 13 1 1 A 63 63 ALA H H 63 8.910 8.808 0.102 1 1 487 . 13 1 1 A 63 63 ALA HA H 63 4.690 4.583 0.107 1 1 491 . 13 1 1 A 63 63 ALA C C 63 175.720 176.692 -0.972 1 1 492 . 13 1 1 A 63 63 ALA CA C 63 50.600 53.189 -2.589 1 1 493 . 13 1 1 A 63 63 ALA CB C 63 20.660 19.179 1.481 1 1 494 . 13 1 1 A 63 63 ALA N N 63 122.480 129.966 -7.486 1 1 495 . 13 1 1 A 64 64 PHE H H 64 9.220 9.761 -0.541 1 1 496 . 13 1 1 A 64 64 PHE HA H 64 4.320 4.721 -0.401 1 1 501 . 13 1 1 A 64 64 PHE C C 64 174.380 176.334 -1.954 1 1 502 . 13 1 1 A 64 64 PHE CA C 64 59.770 58.755 1.015 1 1 503 . 13 1 1 A 64 64 PHE CB C 64 40.830 40.830 0.000 1 1 504 . 13 1 1 A 64 64 PHE N N 64 120.870 123.599 -2.729 1 1 505 . 13 1 1 A 65 65 ALA H H 65 8.150 7.959 0.191 1 1 506 . 13 1 1 A 65 65 ALA HA H 65 5.280 5.021 0.259 1 1 510 . 13 1 1 A 65 65 ALA C C 65 175.950 174.826 1.124 1 1 511 . 13 1 1 A 65 65 ALA CA C 65 51.120 51.179 -0.059 1 1 512 . 13 1 1 A 65 65 ALA CB C 65 22.850 21.445 1.405 1 1 513 . 13 1 1 A 65 65 ALA N N 65 122.350 120.216 2.134 1 1 514 . 13 1 1 A 66 66 TYR H H 66 9.260 9.261 -0.001 1 1 515 . 13 1 1 A 66 66 TYR HA H 66 5.710 5.418 0.292 1 1 520 . 13 1 1 A 66 66 TYR C C 66 175.690 173.934 1.756 1 1 521 . 13 1 1 A 66 66 TYR CA C 66 54.390 56.297 -1.907 1 1 522 . 13 1 1 A 66 66 TYR CB C 66 41.560 40.028 1.532 1 1 523 . 13 1 1 A 66 66 TYR N N 66 124.350 126.798 -2.448 1 1 524 . 13 1 1 A 67 67 ASP H H 67 9.070 8.867 0.203 1 1 525 . 13 1 1 A 67 67 ASP HA H 67 5.630 5.333 0.297 1 1 528 . 13 1 1 A 67 67 ASP C C 67 174.300 174.909 -0.609 1 1 529 . 13 1 1 A 67 67 ASP CA C 67 51.590 52.277 -0.687 1 1 530 . 13 1 1 A 67 67 ASP CB C 67 44.380 43.473 0.907 1 1 531 . 13 1 1 A 67 67 ASP N N 67 130.490 125.808 4.682 1 1 532 . 13 1 1 A 68 68 PHE H H 68 8.670 8.283 0.387 1 1 533 . 13 1 1 A 68 68 PHE HA H 68 4.890 5.325 -0.435 1 1 538 . 13 1 1 A 68 68 PHE C C 68 172.220 172.751 -0.531 1 1 539 . 13 1 1 A 68 68 PHE CA C 68 57.360 55.286 2.074 1 1 540 . 13 1 1 A 68 68 PHE CB C 68 40.360 41.686 -1.326 1 1 541 . 13 1 1 A 68 68 PHE N N 68 118.200 117.320 0.880 1 1 542 . 13 1 1 A 69 69 THR H H 69 8.390 9.066 -0.676 1 1 543 . 13 1 1 A 69 69 THR HA H 69 5.170 5.089 0.081 1 1 548 . 13 1 1 A 69 69 THR C C 69 172.620 173.384 -0.764 1 1 549 . 13 1 1 A 69 69 THR CA C 69 61.370 61.112 0.258 1 1 550 . 13 1 1 A 69 69 THR CB C 69 64.880 69.912 -5.032 1 1 552 . 13 1 1 A 69 69 THR N N 69 115.810 113.009 2.801 1 1 553 . 13 1 1 A 70 70 LEU H H 70 9.560 8.697 0.863 1 1 554 . 13 1 1 A 70 70 LEU HA H 70 5.270 4.655 0.615 1 1 564 . 13 1 1 A 70 70 LEU C C 70 173.800 175.625 -1.825 1 1 565 . 13 1 1 A 70 70 LEU CA C 70 53.460 55.682 -2.222 1 1 566 . 13 1 1 A 70 70 LEU CB C 70 45.040 42.979 2.061 1 1 570 . 13 1 1 A 70 70 LEU N N 70 129.220 128.400 0.820 1 1 571 . 13 1 1 A 71 71 ASN H H 71 9.590 8.368 1.222 1 1 572 . 13 1 1 A 71 71 ASN HA H 71 5.880 5.785 0.095 1 1 577 . 13 1 1 A 71 71 ASN C C 71 177.970 174.403 3.567 1 1 578 . 13 1 1 A 71 71 ASN CA C 71 52.060 51.876 0.184 1 1 579 . 13 1 1 A 71 71 ASN CB C 71 41.020 42.261 -1.241 1 1 580 . 13 1 1 A 71 71 ASN N N 71 125.970 122.973 2.997 1 1 582 . 13 1 1 A 72 72 TYR H H 72 8.740 9.227 -0.487 1 1 583 . 13 1 1 A 72 72 TYR HA H 72 5.110 5.333 -0.223 1 1 588 . 13 1 1 A 72 72 TYR C C 72 177.720 172.045 5.675 1 1 589 . 13 1 1 A 72 72 TYR CA C 72 55.310 55.586 -0.276 1 1 590 . 13 1 1 A 72 72 TYR CB C 72 41.510 41.085 0.425 1 1 591 . 13 1 1 A 72 72 TYR N N 72 119.640 119.322 0.318 1 1 592 . 13 1 1 A 73 73 ASP H H 73 9.780 8.991 0.789 1 1 593 . 13 1 1 A 73 73 ASP HA H 73 4.680 5.251 -0.571 1 1 596 . 13 1 1 A 73 73 ASP C C 73 177.290 176.290 1.000 1 1 597 . 13 1 1 A 73 73 ASP CA C 73 53.650 53.039 0.611 1 1 598 . 13 1 1 A 73 73 ASP CB C 73 40.900 43.906 -3.006 1 1 599 . 13 1 1 A 73 73 ASP N N 73 119.290 119.023 0.267 1 1 600 . 13 1 1 A 74 74 GLU H H 74 9.430 9.007 0.423 1 1 601 . 13 1 1 A 74 74 GLU HA H 74 4.740 4.580 0.160 1 1 606 . 13 1 1 A 74 74 GLU C C 74 176.320 176.889 -0.569 1 1 607 . 13 1 1 A 74 74 GLU CA C 74 57.410 57.175 0.235 1 1 608 . 13 1 1 A 74 74 GLU CB C 74 29.490 29.890 -0.400 1 1 610 . 13 1 1 A 74 74 GLU N N 74 130.930 123.282 7.648 1 1 611 . 13 1 1 A 75 75 ASN H H 75 8.680 8.202 0.478 1 1 612 . 13 1 1 A 75 75 ASN HA H 75 4.600 4.712 -0.112 1 1 617 . 13 1 1 A 75 75 ASN C C 75 175.340 175.112 0.228 1 1 618 . 13 1 1 A 75 75 ASN CA C 75 54.620 52.819 1.801 1 1 619 . 13 1 1 A 75 75 ASN CB C 75 38.770 37.894 0.876 1 1 620 . 13 1 1 A 75 75 ASN N N 75 115.040 115.187 -0.147 1 1 622 . 13 1 1 A 76 76 ALA H H 76 7.740 8.022 -0.282 1 1 623 . 13 1 1 A 76 76 ALA HA H 76 4.310 4.402 -0.092 1 1 627 . 13 1 1 A 76 76 ALA C C 76 175.550 176.800 -1.250 1 1 628 . 13 1 1 A 76 76 ALA CA C 76 53.260 53.427 -0.167 1 1 629 . 13 1 1 A 76 76 ALA CB C 76 21.450 21.005 0.445 1 1 630 . 13 1 1 A 76 76 ALA N N 76 122.200 119.165 3.035 1 1 631 . 13 1 1 A 77 77 PHE H H 77 8.070 7.905 0.165 1 1 632 . 13 1 1 A 77 77 PHE HA H 77 5.650 5.132 0.518 1 1 637 . 13 1 1 A 77 77 PHE C C 77 174.570 175.004 -0.434 1 1 638 . 13 1 1 A 77 77 PHE CA C 77 56.360 57.114 -0.754 1 1 639 . 13 1 1 A 77 77 PHE CB C 77 46.080 41.857 4.223 1 1 640 . 13 1 1 A 77 77 PHE N N 77 114.160 114.175 -0.015 1 1 641 . 13 1 1 A 78 78 GLU H H 78 8.800 8.930 -0.130 1 1 642 . 13 1 1 A 78 78 GLU HA H 78 4.900 4.841 0.059 1 1 647 . 13 1 1 A 78 78 GLU C C 78 175.950 174.832 1.118 1 1 648 . 13 1 1 A 78 78 GLU CA C 78 53.670 56.290 -2.620 1 1 649 . 13 1 1 A 78 78 GLU CB C 78 33.600 32.397 1.203 1 1 651 . 13 1 1 A 78 78 GLU N N 78 117.590 120.339 -2.749 1 1 652 . 13 1 1 A 79 79 TYR H H 79 8.770 9.269 -0.499 1 1 653 . 13 1 1 A 79 79 TYR HA H 79 4.250 4.184 0.066 1 1 658 . 13 1 1 A 79 79 TYR C C 79 174.580 174.942 -0.362 1 1 659 . 13 1 1 A 79 79 TYR CA C 79 59.250 59.612 -0.362 1 1 660 . 13 1 1 A 79 79 TYR CB C 79 38.310 39.152 -0.842 1 1 661 . 13 1 1 A 79 79 TYR N N 79 126.560 129.381 -2.821 1 1 662 . 13 1 1 A 80 80 VAL H H 80 8.220 8.078 0.142 1 1 663 . 13 1 1 A 80 80 VAL HA H 80 3.690 3.860 -0.170 1 1 671 . 13 1 1 A 80 80 VAL C C 80 174.780 174.858 -0.078 1 1 672 . 13 1 1 A 80 80 VAL CA C 80 64.400 62.897 1.503 1 1 673 . 13 1 1 A 80 80 VAL CB C 80 33.510 32.772 0.738 1 1 676 . 13 1 1 A 80 80 VAL N N 80 129.460 125.666 3.794 1 1 677 . 13 1 1 A 81 81 GLU H H 81 6.920 7.511 -0.591 1 1 678 . 13 1 1 A 81 81 GLU HA H 81 4.260 4.660 -0.400 1 1 683 . 13 1 1 A 81 81 GLU C C 81 171.840 175.681 -3.841 1 1 684 . 13 1 1 A 81 81 GLU CA C 81 55.310 55.104 0.206 1 1 685 . 13 1 1 A 81 81 GLU CB C 81 30.520 33.418 -2.898 1 1 687 . 13 1 1 A 81 81 GLU N N 81 112.430 117.111 -4.681 1 1 688 . 13 1 1 A 82 82 ALA H H 82 8.310 8.565 -0.255 1 1 689 . 13 1 1 A 82 82 ALA HA H 82 5.650 5.121 0.529 1 1 693 . 13 1 1 A 82 82 ALA C C 82 176.110 177.042 -0.932 1 1 694 . 13 1 1 A 82 82 ALA CA C 82 50.620 51.748 -1.128 1 1 695 . 13 1 1 A 82 82 ALA CB C 82 21.770 19.977 1.793 1 1 696 . 13 1 1 A 82 82 ALA N N 82 121.240 125.917 -4.677 1 1 697 . 13 1 1 A 83 83 ILE H H 83 9.150 8.963 0.187 1 1 698 . 13 1 1 A 83 83 ILE HA H 83 4.600 4.843 -0.243 1 1 708 . 13 1 1 A 83 83 ILE C C 83 174.810 174.906 -0.096 1 1 709 . 13 1 1 A 83 83 ILE CA C 83 60.060 59.162 0.898 1 1 710 . 13 1 1 A 83 83 ILE CB C 83 42.440 41.721 0.719 1 1 714 . 13 1 1 A 83 83 ILE N N 83 119.720 120.389 -0.669 1 1 715 . 13 1 1 A 84 84 SER H H 84 8.350 8.744 -0.394 1 1 716 . 13 1 1 A 84 84 SER HA H 84 4.660 5.050 -0.390 1 1 719 . 13 1 1 A 84 84 SER C C 84 177.550 173.241 4.309 1 1 720 . 13 1 1 A 84 84 SER CA C 84 57.330 56.089 1.241 1 1 721 . 13 1 1 A 84 84 SER CB C 84 66.490 66.079 0.411 1 1 722 . 13 1 1 A 84 84 SER N N 84 116.740 117.090 -0.350 1 1 723 . 13 1 1 A 85 85 ASP H H 85 8.740 8.767 -0.027 1 1 724 . 13 1 1 A 85 85 ASP HA H 85 4.820 4.735 0.085 1 1 727 . 13 1 1 A 85 85 ASP C C 85 176.090 175.948 0.142 1 1 728 . 13 1 1 A 85 85 ASP CA C 85 53.480 52.545 0.935 1 1 729 . 13 1 1 A 85 85 ASP CB C 85 42.480 42.864 -0.384 1 1 730 . 13 1 1 A 85 85 ASP N N 85 120.960 122.780 -1.820 1 1 731 . 13 1 1 A 86 86 ASP H H 86 8.380 8.620 -0.240 1 1 732 . 13 1 1 A 86 86 ASP HA H 86 4.450 4.877 -0.427 1 1 735 . 13 1 1 A 86 86 ASP C C 86 177.100 177.148 -0.048 1 1 736 . 13 1 1 A 86 86 ASP CA C 86 56.240 53.304 2.936 1 1 737 . 13 1 1 A 86 86 ASP CB C 86 41.100 41.309 -0.209 1 1 738 . 13 1 1 A 86 86 ASP N N 86 117.710 121.701 -3.991 1 1 739 . 13 1 1 A 87 87 GLY H H 87 8.690 7.590 1.100 1 1 740 . 13 1 1 A 87 87 GLY HA2 H 87 3.870 4.074 -0.204 1 1 741 . 13 1 1 A 87 87 GLY HA3 H 87 4.090 4.083 0.007 1 1 742 . 13 1 1 A 87 87 GLY C C 87 173.800 174.361 -0.561 1 1 743 . 13 1 1 A 87 87 GLY CA C 87 45.770 45.678 0.092 1 1 744 . 13 1 1 A 87 87 GLY N N 87 108.540 107.231 1.309 1 1 745 . 13 1 1 A 88 88 VAL H H 88 7.910 7.644 0.266 1 1 746 . 13 1 1 A 88 88 VAL HA H 88 4.780 4.272 0.508 1 1 754 . 13 1 1 A 88 88 VAL C C 88 173.970 175.406 -1.436 1 1 755 . 13 1 1 A 88 88 VAL CA C 88 60.900 62.179 -1.279 1 1 756 . 13 1 1 A 88 88 VAL CB C 88 35.460 33.164 2.296 1 1 759 . 13 1 1 A 88 88 VAL N N 88 119.790 120.662 -0.872 1 1 760 . 13 1 1 A 89 89 PHE H H 89 9.210 9.772 -0.562 1 1 761 . 13 1 1 A 89 89 PHE HA H 89 4.930 5.526 -0.596 1 1 766 . 13 1 1 A 89 89 PHE C C 89 173.970 174.051 -0.081 1 1 767 . 13 1 1 A 89 89 PHE CA C 89 56.450 55.442 1.008 1 1 768 . 13 1 1 A 89 89 PHE CB C 89 41.120 42.023 -0.903 1 1 769 . 13 1 1 A 89 89 PHE N N 89 126.780 125.078 1.702 1 1 770 . 13 1 1 A 90 90 VAL H H 90 7.880 8.450 -0.570 1 1 771 . 13 1 1 A 90 90 VAL HA H 90 4.860 5.094 -0.234 1 1 779 . 13 1 1 A 90 90 VAL C C 90 173.190 175.266 -2.076 1 1 780 . 13 1 1 A 90 90 VAL CA C 90 59.750 61.100 -1.350 1 1 781 . 13 1 1 A 90 90 VAL CB C 90 34.770 33.994 0.776 1 1 784 . 13 1 1 A 90 90 VAL N N 90 124.990 126.743 -1.753 1 1 785 . 13 1 1 A 91 91 ASN H H 91 8.670 8.812 -0.142 1 1 786 . 13 1 1 A 91 91 ASN HA H 91 4.730 5.305 -0.575 1 1 791 . 13 1 1 A 91 91 ASN C C 91 173.200 174.115 -0.915 1 1 792 . 13 1 1 A 91 91 ASN CA C 91 51.970 52.004 -0.034 1 1 793 . 13 1 1 A 91 91 ASN CB C 91 41.340 41.778 -0.438 1 1 794 . 13 1 1 A 91 91 ASN N N 91 124.860 124.606 0.254 1 1 796 . 13 1 1 A 92 92 ALA H H 92 8.840 9.106 -0.266 1 1 797 . 13 1 1 A 92 92 ALA HA H 92 5.290 5.396 -0.106 1 1 801 . 13 1 1 A 92 92 ALA C C 92 176.330 176.303 0.027 1 1 802 . 13 1 1 A 92 92 ALA CA C 92 50.170 50.858 -0.688 1 1 803 . 13 1 1 A 92 92 ALA CB C 92 23.610 21.149 2.461 1 1 804 . 13 1 1 A 92 92 ALA N N 92 128.510 127.880 0.630 1 1 805 . 13 1 1 A 93 93 LYS H H 93 8.670 9.461 -0.791 1 1 806 . 13 1 1 A 93 93 LYS HA H 93 4.460 4.786 -0.326 1 1 815 . 13 1 1 A 93 93 LYS C C 93 174.170 175.145 -0.975 1 1 816 . 13 1 1 A 93 93 LYS CA C 93 55.010 55.027 -0.017 1 1 817 . 13 1 1 A 93 93 LYS CB C 93 36.430 35.790 0.640 1 1 821 . 13 1 1 A 93 93 LYS N N 93 121.300 122.311 -1.011 1 1 822 . 13 1 1 A 94 94 LYS H H 94 8.960 8.804 0.156 1 1 823 . 13 1 1 A 94 94 LYS HA H 94 4.460 4.140 0.320 1 1 832 . 13 1 1 A 94 94 LYS C C 94 176.330 176.624 -0.294 1 1 833 . 13 1 1 A 94 94 LYS CA C 94 56.720 57.228 -0.508 1 1 834 . 13 1 1 A 94 94 LYS CB C 94 31.930 32.599 -0.669 1 1 837 . 13 1 1 A 94 94 LYS N N 94 127.060 127.685 -0.625 1 1 838 . 13 1 1 A 95 95 ILE H H 95 8.290 8.503 -0.213 1 1 839 . 13 1 1 A 95 95 ILE HA H 95 4.120 4.313 -0.193 1 1 849 . 13 1 1 A 95 95 ILE C C 95 175.740 174.756 0.984 1 1 850 . 13 1 1 A 95 95 ILE CA C 95 62.760 61.944 0.816 1 1 851 . 13 1 1 A 95 95 ILE CB C 95 38.890 40.358 -1.468 1 1 855 . 13 1 1 A 95 95 ILE N N 95 126.530 128.532 -2.002 1 1 856 . 13 1 1 A 96 96 GLU H H 96 8.030 7.316 0.714 1 1 857 . 13 1 1 A 96 96 GLU HA H 96 4.450 4.712 -0.262 1 1 862 . 13 1 1 A 96 96 GLU C C 96 174.380 176.555 -2.175 1 1 863 . 13 1 1 A 96 96 GLU CA C 96 54.320 54.497 -0.177 1 1 864 . 13 1 1 A 96 96 GLU CB C 96 32.770 33.779 -1.009 1 1 866 . 13 1 1 A 96 96 GLU N N 96 117.080 118.668 -1.588 1 1 867 . 13 1 1 A 97 97 ASP H H 97 8.730 8.900 -0.170 1 1 868 . 13 1 1 A 97 97 ASP HA H 97 4.360 4.695 -0.335 1 1 871 . 13 1 1 A 97 97 ASP C C 97 177.100 177.568 -0.468 1 1 872 . 13 1 1 A 97 97 ASP CA C 97 57.160 57.348 -0.188 1 1 873 . 13 1 1 A 97 97 ASP CB C 97 39.920 40.261 -0.341 1 1 874 . 13 1 1 A 97 97 ASP N N 97 120.570 121.429 -0.859 1 1 875 . 13 1 1 A 98 98 GLY H H 98 8.760 7.832 0.928 1 1 876 . 13 1 1 A 98 98 GLY HA2 H 98 2.120 2.048 0.072 1 1 877 . 13 1 1 A 98 98 GLY HA3 H 98 3.910 3.328 0.582 1 1 878 . 13 1 1 A 98 98 GLY C C 98 174.000 172.880 1.120 1 1 879 . 13 1 1 A 98 98 GLY CA C 98 45.720 45.810 -0.090 1 1 880 . 13 1 1 A 98 98 GLY N N 98 112.090 106.442 5.648 1 1 881 . 13 1 1 A 99 99 LYS H H 99 7.890 7.704 0.186 1 1 882 . 13 1 1 A 99 99 LYS HA H 99 5.330 5.250 0.080 1 1 891 . 13 1 1 A 99 99 LYS C C 99 174.750 174.511 0.239 1 1 892 . 13 1 1 A 99 99 LYS CA C 99 55.990 55.070 0.920 1 1 893 . 13 1 1 A 99 99 LYS CB C 99 37.840 36.054 1.786 1 1 897 . 13 1 1 A 99 99 LYS N N 99 118.050 117.328 0.722 1 1 898 . 13 1 1 A 100 100 VAL H H 100 8.980 8.601 0.379 1 1 899 . 13 1 1 A 100 100 VAL HA H 100 4.510 4.768 -0.258 1 1 907 . 13 1 1 A 100 100 VAL C C 100 174.760 173.707 1.053 1 1 908 . 13 1 1 A 100 100 VAL CA C 100 60.130 59.034 1.096 1 1 909 . 13 1 1 A 100 100 VAL CB C 100 35.240 35.796 -0.556 1 1 912 . 13 1 1 A 100 100 VAL N N 100 123.850 119.561 4.289 1 1 913 . 13 1 1 A 101 101 ARG H H 101 8.810 8.262 0.548 1 1 914 . 13 1 1 A 101 101 ARG HA H 101 4.850 5.025 -0.175 1 1 921 . 13 1 1 A 101 101 ARG C C 101 174.770 174.387 0.383 1 1 922 . 13 1 1 A 101 101 ARG CA C 101 54.580 54.630 -0.050 1 1 923 . 13 1 1 A 101 101 ARG CB C 101 32.400 31.910 0.490 1 1 926 . 13 1 1 A 101 101 ARG N N 101 129.210 123.064 6.146 1 1 927 . 13 1 1 A 102 102 VAL H H 102 9.100 8.470 0.630 1 1 928 . 13 1 1 A 102 102 VAL HA H 102 4.120 5.002 -0.882 1 1 936 . 13 1 1 A 102 102 VAL C C 102 171.640 173.275 -1.635 1 1 937 . 13 1 1 A 102 102 VAL CA C 102 61.350 59.233 2.117 1 1 938 . 13 1 1 A 102 102 VAL CB C 102 32.530 34.988 -2.458 1 1 941 . 13 1 1 A 102 102 VAL N N 102 130.470 123.225 7.245 1 1 942 . 13 1 1 A 103 103 LEU H H 103 8.110 9.506 -1.396 1 1 943 . 13 1 1 A 103 103 LEU HA H 103 5.120 4.897 0.223 1 1 953 . 13 1 1 A 103 103 LEU C C 103 176.410 175.508 0.902 1 1 954 . 13 1 1 A 103 103 LEU CA C 103 53.380 53.412 -0.032 1 1 955 . 13 1 1 A 103 103 LEU CB C 103 43.680 43.207 0.473 1 1 959 . 13 1 1 A 103 103 LEU N N 103 125.560 128.039 -2.479 1 1 960 . 13 1 1 A 104 104 VAL H H 104 9.580 8.996 0.584 1 1 961 . 13 1 1 A 104 104 VAL HA H 104 5.260 5.350 -0.090 1 1 969 . 13 1 1 A 104 104 VAL C C 104 176.030 174.800 1.230 1 1 970 . 13 1 1 A 104 104 VAL CA C 104 60.220 61.131 -0.911 1 1 971 . 13 1 1 A 104 104 VAL CB C 104 34.310 33.711 0.599 1 1 974 . 13 1 1 A 104 104 VAL N N 104 125.790 126.829 -1.039 1 1 975 . 13 1 1 A 105 105 SER H H 105 9.340 8.753 0.587 1 1 976 . 13 1 1 A 105 105 SER HA H 105 5.300 5.091 0.209 1 1 979 . 13 1 1 A 105 105 SER C C 105 173.600 173.116 0.484 1 1 980 . 13 1 1 A 105 105 SER CA C 105 57.450 57.334 0.116 1 1 981 . 13 1 1 A 105 105 SER CB C 105 65.600 66.859 -1.259 1 1 982 . 13 1 1 A 105 105 SER N N 105 119.220 119.886 -0.666 1 1 983 . 13 1 1 A 106 106 SER H H 106 8.350 9.063 -0.713 1 1 984 . 13 1 1 A 106 106 SER HA H 106 4.720 4.381 0.339 1 1 987 . 13 1 1 A 106 106 SER C C 106 176.930 174.706 2.224 1 1 988 . 13 1 1 A 106 106 SER CA C 106 58.170 58.813 -0.643 1 1 989 . 13 1 1 A 106 106 SER CB C 106 64.170 62.716 1.454 1 1 990 . 13 1 1 A 106 106 SER N N 106 114.800 120.044 -5.244 1 1 991 . 13 1 1 A 107 107 LEU H H 107 8.770 8.923 -0.153 1 1 992 . 13 1 1 A 107 107 LEU HA H 107 4.710 4.131 0.579 1 1 1001 . 13 1 1 A 107 107 LEU C C 107 178.280 178.670 -0.390 1 1 1002 . 13 1 1 A 107 107 LEU CA C 107 55.280 56.988 -1.708 1 1 1003 . 13 1 1 A 107 107 LEU CB C 107 43.410 41.935 1.475 1 1 1007 . 13 1 1 A 107 107 LEU N N 107 127.210 128.316 -1.106 1 1 1008 . 13 1 1 A 108 108 THR H H 108 8.210 7.742 0.468 1 1 1009 . 13 1 1 A 108 108 THR HA H 108 4.400 4.244 0.156 1 1 1015 . 13 1 1 A 108 108 THR C C 108 176.130 175.674 0.456 1 1 1016 . 13 1 1 A 108 108 THR CA C 108 62.050 63.178 -1.128 1 1 1017 . 13 1 1 A 108 108 THR CB C 108 70.910 70.333 0.577 1 1 1019 . 13 1 1 A 108 108 THR N N 108 108.810 110.452 -1.642 1 1 1020 . 13 1 1 A 109 109 GLY H H 109 8.250 7.697 0.553 1 1 1021 . 13 1 1 A 109 109 GLY HA2 H 109 3.780 3.981 -0.201 1 1 1022 . 13 1 1 A 109 109 GLY HA3 H 109 4.290 3.986 0.304 1 1 1023 . 13 1 1 A 109 109 GLY C C 109 173.180 174.057 -0.877 1 1 1024 . 13 1 1 A 109 109 GLY CA C 109 45.340 45.063 0.277 1 1 1025 . 13 1 1 A 109 109 GLY N N 109 110.160 110.708 -0.548 1 1 1026 . 13 1 1 A 110 110 GLU H H 110 7.960 7.486 0.474 1 1 1027 . 13 1 1 A 110 110 GLU HA H 110 4.760 4.608 0.152 1 1 1032 . 13 1 1 A 110 110 GLU CA C 110 53.450 53.291 0.159 1 1 1033 . 13 1 1 A 110 110 GLU CB C 110 30.020 30.047 -0.027 1 1 1035 . 13 1 1 A 110 110 GLU N N 110 119.720 120.684 -0.964 1 1 1036 . 13 1 1 A 111 111 PRO HA H 111 3.250 3.977 -0.727 1 1 1043 . 13 1 1 A 111 111 PRO C C 111 176.710 176.044 0.666 1 1 1044 . 13 1 1 A 111 111 PRO CA C 111 62.240 62.116 0.124 1 1 1045 . 13 1 1 A 111 111 PRO CB C 111 31.990 32.269 -0.279 1 1 1048 . 13 1 1 A 112 112 LEU H H 112 8.840 8.280 0.560 1 1 1049 . 13 1 1 A 112 112 LEU HA H 112 4.290 4.225 0.065 1 1 1059 . 13 1 1 A 112 112 LEU CA C 112 52.220 53.695 -1.475 1 1 1060 . 13 1 1 A 112 112 LEU CB C 112 41.090 41.454 -0.364 1 1 1063 . 13 1 1 A 112 112 LEU N N 112 122.420 122.348 0.072 1 1 1064 . 13 1 1 A 113 113 PRO HA H 113 4.380 4.246 0.134 1 1 1071 . 13 1 1 A 113 113 PRO C C 113 176.100 177.405 -1.305 1 1 1072 . 13 1 1 A 113 113 PRO CA C 113 61.930 64.537 -2.607 1 1 1073 . 13 1 1 A 113 113 PRO CB C 113 32.470 31.789 0.681 1 1 1076 . 13 1 1 A 114 114 ALA H H 114 8.070 7.850 0.220 1 1 1077 . 13 1 1 A 114 114 ALA HA H 114 4.550 3.986 0.564 1 1 1081 . 13 1 1 A 114 114 ALA C C 114 177.490 177.413 0.077 1 1 1082 . 13 1 1 A 114 114 ALA CA C 114 51.340 53.885 -2.545 1 1 1083 . 13 1 1 A 114 114 ALA CB C 114 19.940 18.190 1.750 1 1 1084 . 13 1 1 A 114 114 ALA N N 114 121.460 120.753 0.707 1 1 1085 . 13 1 1 A 115 115 LYS H H 115 9.000 8.955 0.045 1 1 1086 . 13 1 1 A 115 115 LYS HA H 115 3.930 3.847 0.083 1 1 1095 . 13 1 1 A 115 115 LYS C C 115 175.740 175.010 0.730 1 1 1096 . 13 1 1 A 115 115 LYS CA C 115 57.580 57.673 -0.093 1 1 1097 . 13 1 1 A 115 115 LYS CB C 115 29.510 30.732 -1.222 1 1 1101 . 13 1 1 A 115 115 LYS N N 115 112.560 115.919 -3.359 1 1 1102 . 13 1 1 A 116 116 GLU H H 116 7.620 7.677 -0.057 1 1 1103 . 13 1 1 A 116 116 GLU HA H 116 4.550 4.681 -0.131 1 1 1108 . 13 1 1 A 116 116 GLU C C 116 176.110 174.460 1.650 1 1 1109 . 13 1 1 A 116 116 GLU CA C 116 54.570 55.425 -0.855 1 1 1110 . 13 1 1 A 116 116 GLU CB C 116 33.680 33.307 0.373 1 1 1112 . 13 1 1 A 116 116 GLU N N 116 115.710 117.881 -2.171 1 1 1113 . 13 1 1 A 117 117 VAL H H 117 8.770 8.799 -0.029 1 1 1114 . 13 1 1 A 117 117 VAL HA H 117 3.200 3.994 -0.794 1 1 1122 . 13 1 1 A 117 117 VAL C C 117 175.740 175.936 -0.196 1 1 1123 . 13 1 1 A 117 117 VAL CA C 117 65.340 63.505 1.835 1 1 1124 . 13 1 1 A 117 117 VAL CB C 117 31.290 31.049 0.241 1 1 1127 . 13 1 1 A 117 117 VAL N N 117 124.450 126.574 -2.124 1 1 1128 . 13 1 1 A 118 118 LEU H H 118 8.550 9.000 -0.450 1 1 1129 . 13 1 1 A 118 118 LEU HA H 118 4.540 4.482 0.058 1 1 1139 . 13 1 1 A 118 118 LEU C C 118 176.210 177.086 -0.876 1 1 1140 . 13 1 1 A 118 118 LEU CA C 118 55.510 55.846 -0.336 1 1 1141 . 13 1 1 A 118 118 LEU CB C 118 44.600 42.792 1.808 1 1 1145 . 13 1 1 A 118 118 LEU N N 118 128.440 129.148 -0.708 1 1 1146 . 13 1 1 A 119 119 ALA H H 119 7.970 7.688 0.282 1 1 1147 . 13 1 1 A 119 119 ALA HA H 119 4.740 4.853 -0.113 1 1 1151 . 13 1 1 A 119 119 ALA C C 119 174.570 175.247 -0.677 1 1 1152 . 13 1 1 A 119 119 ALA CA C 119 50.770 51.688 -0.918 1 1 1153 . 13 1 1 A 119 119 ALA CB C 119 22.450 22.378 0.072 1 1 1154 . 13 1 1 A 119 119 ALA N N 119 118.100 117.428 0.672 1 1 1155 . 13 1 1 A 120 120 LYS H H 120 8.760 8.790 -0.030 1 1 1156 . 13 1 1 A 120 120 LYS HA H 120 5.240 5.351 -0.111 1 1 1165 . 13 1 1 A 120 120 LYS C C 120 175.340 175.385 -0.045 1 1 1166 . 13 1 1 A 120 120 LYS CA C 120 54.220 54.926 -0.706 1 1 1167 . 13 1 1 A 120 120 LYS CB C 120 34.340 34.224 0.116 1 1 1171 . 13 1 1 A 120 120 LYS N N 120 120.010 121.701 -1.691 1 1 1172 . 13 1 1 A 121 121 VAL H H 121 9.410 9.046 0.364 1 1 1173 . 13 1 1 A 121 121 VAL HA H 121 4.230 4.584 -0.354 1 1 1181 . 13 1 1 A 121 121 VAL C C 121 173.980 174.854 -0.874 1 1 1182 . 13 1 1 A 121 121 VAL CA C 121 62.370 62.113 0.257 1 1 1183 . 13 1 1 A 121 121 VAL CB C 121 32.410 31.837 0.573 1 1 1186 . 13 1 1 A 121 121 VAL N N 121 124.960 125.626 -0.666 1 1 1187 . 13 1 1 A 122 122 VAL H H 122 9.280 8.761 0.519 1 1 1188 . 13 1 1 A 122 122 VAL HA H 122 4.360 4.999 -0.639 1 1 1196 . 13 1 1 A 122 122 VAL C C 122 174.190 173.857 0.333 1 1 1197 . 13 1 1 A 122 122 VAL CA C 122 62.760 61.487 1.273 1 1 1198 . 13 1 1 A 122 122 VAL CB C 122 32.020 33.030 -1.010 1 1 1201 . 13 1 1 A 122 122 VAL N N 122 128.990 128.611 0.379 1 1 1202 . 13 1 1 A 123 123 LEU H H 123 8.610 8.337 0.273 1 1 1203 . 13 1 1 A 123 123 LEU HA H 123 4.900 4.762 0.138 1 1 1213 . 13 1 1 A 123 123 LEU C C 123 174.950 176.606 -1.656 1 1 1214 . 13 1 1 A 123 123 LEU CA C 123 52.050 53.453 -1.403 1 1 1215 . 13 1 1 A 123 123 LEU CB C 123 45.210 42.145 3.065 1 1 1219 . 13 1 1 A 123 123 LEU N N 123 127.200 129.853 -2.653 1 1 1220 . 13 1 1 A 124 124 ARG H H 124 9.540 9.043 0.497 1 1 1221 . 13 1 1 A 124 124 ARG HA H 124 4.900 4.454 0.446 1 1 1229 . 13 1 1 A 124 124 ARG C C 124 176.320 175.727 0.593 1 1 1230 . 13 1 1 A 124 124 ARG CA C 124 55.320 57.188 -1.868 1 1 1231 . 13 1 1 A 124 124 ARG CB C 124 31.750 30.580 1.170 1 1 1234 . 13 1 1 A 124 124 ARG N N 124 124.290 125.883 -1.593 1 1 1236 . 13 1 1 A 125 125 ALA H H 125 8.880 8.275 0.605 1 1 1237 . 13 1 1 A 125 125 ALA HA H 125 4.380 3.950 0.430 1 1 1241 . 13 1 1 A 125 125 ALA C C 125 177.290 177.672 -0.382 1 1 1242 . 13 1 1 A 125 125 ALA CA C 125 52.530 51.237 1.293 1 1 1243 . 13 1 1 A 125 125 ALA CB C 125 19.870 17.185 2.685 1 1 1244 . 13 1 1 A 125 125 ALA N N 125 130.790 130.331 0.459 1 1 1245 . 13 1 1 A 126 126 GLU H H 126 9.260 8.481 0.779 1 1 1246 . 13 1 1 A 126 126 GLU HA H 126 4.460 4.418 0.042 1 1 1251 . 13 1 1 A 126 126 GLU C C 126 176.120 175.969 0.151 1 1 1252 . 13 1 1 A 126 126 GLU CA C 126 56.940 57.042 -0.102 1 1 1253 . 13 1 1 A 126 126 GLU CB C 126 32.450 30.242 2.208 1 1 1255 . 13 1 1 A 126 126 GLU N N 126 125.740 123.120 2.620 1 1 1256 . 13 1 1 A 127 127 ALA H H 127 7.460 7.472 -0.012 1 1 1257 . 13 1 1 A 127 127 ALA HA H 127 4.360 4.592 -0.232 1 1 1261 . 13 1 1 A 127 127 ALA C C 127 173.400 175.739 -2.339 1 1 1262 . 13 1 1 A 127 127 ALA CA C 127 51.360 51.690 -0.330 1 1 1263 . 13 1 1 A 127 127 ALA CB C 127 22.180 22.063 0.117 1 1 1264 . 13 1 1 A 127 127 ALA N N 127 120.910 119.275 1.635 1 1 1265 . 13 1 1 A 128 128 LYS H H 128 7.940 8.681 -0.741 1 1 1266 . 13 1 1 A 128 128 LYS HA H 128 3.580 4.116 -0.536 1 1 1275 . 13 1 1 A 128 128 LYS C C 128 176.080 175.883 0.197 1 1 1276 . 13 1 1 A 128 128 LYS CA C 128 56.860 57.184 -0.324 1 1 1277 . 13 1 1 A 128 128 LYS CB C 128 33.170 33.252 -0.082 1 1 1281 . 13 1 1 A 128 128 LYS N N 128 116.520 124.669 -8.149 1 1 1282 . 13 1 1 A 129 129 ALA H H 129 8.590 8.600 -0.010 1 1 1283 . 13 1 1 A 129 129 ALA HA H 129 4.390 4.699 -0.309 1 1 1287 . 13 1 1 A 129 129 ALA C C 129 174.970 176.315 -1.345 1 1 1288 . 13 1 1 A 129 129 ALA CA C 129 52.970 51.096 1.874 1 1 1289 . 13 1 1 A 129 129 ALA CB C 129 21.500 19.249 2.251 1 1 1290 . 13 1 1 A 129 129 ALA N N 129 124.710 128.639 -3.929 1 1 1291 . 13 1 1 A 130 130 GLU H H 130 8.660 7.955 0.705 1 1 1292 . 13 1 1 A 130 130 GLU HA H 130 4.660 4.027 0.633 1 1 1297 . 13 1 1 A 130 130 GLU C C 130 177.390 177.701 -0.311 1 1 1298 . 13 1 1 A 130 130 GLU CA C 130 55.070 58.642 -3.572 1 1 1299 . 13 1 1 A 130 130 GLU CB C 130 30.860 29.471 1.389 1 1 1301 . 13 1 1 A 130 130 GLU N N 130 123.180 119.951 3.229 1 1 1302 . 13 1 1 A 131 131 GLY H H 131 9.170 9.068 0.102 1 1 1303 . 13 1 1 A 131 131 GLY HA2 H 131 3.560 3.984 -0.424 1 1 1304 . 13 1 1 A 131 131 GLY HA3 H 131 3.750 3.990 -0.240 1 1 1305 . 13 1 1 A 131 131 GLY C C 131 174.550 174.326 0.224 1 1 1306 . 13 1 1 A 131 131 GLY CA C 131 47.660 45.483 2.177 1 1 1307 . 13 1 1 A 131 131 GLY N N 131 115.530 113.625 1.905 1 1 1308 . 13 1 1 A 132 132 SER H H 132 8.430 8.332 0.098 1 1 1309 . 13 1 1 A 132 132 SER HA H 132 4.170 4.554 -0.384 1 1 1312 . 13 1 1 A 132 132 SER C C 132 175.350 173.830 1.520 1 1 1313 . 13 1 1 A 132 132 SER CA C 132 59.050 57.243 1.807 1 1 1314 . 13 1 1 A 132 132 SER CB C 132 64.880 61.628 3.252 1 1 1315 . 13 1 1 A 132 132 SER N N 132 115.930 117.432 -1.502 1 1 1316 . 13 1 1 A 133 133 ASN H H 133 8.850 9.118 -0.268 1 1 1317 . 13 1 1 A 133 133 ASN HA H 133 4.910 5.098 -0.188 1 1 1322 . 13 1 1 A 133 133 ASN C C 133 175.450 174.689 0.761 1 1 1323 . 13 1 1 A 133 133 ASN CA C 133 54.920 54.108 0.812 1 1 1324 . 13 1 1 A 133 133 ASN CB C 133 41.060 38.996 2.064 1 1 1325 . 13 1 1 A 133 133 ASN N N 133 125.590 125.785 -0.195 1 1 1327 . 13 1 1 A 134 134 LEU H H 134 9.070 9.648 -0.578 1 1 1328 . 13 1 1 A 134 134 LEU HA H 134 5.230 5.373 -0.143 1 1 1338 . 13 1 1 A 134 134 LEU C C 134 175.240 175.441 -0.201 1 1 1339 . 13 1 1 A 134 134 LEU CA C 134 53.470 53.429 0.041 1 1 1340 . 13 1 1 A 134 134 LEU CB C 134 45.090 44.311 0.779 1 1 1344 . 13 1 1 A 134 134 LEU N N 134 129.210 125.299 3.911 1 1 1345 . 13 1 1 A 135 135 SER H H 135 8.690 8.874 -0.184 1 1 1346 . 13 1 1 A 135 135 SER HA H 135 5.280 5.283 -0.003 1 1 1349 . 13 1 1 A 135 135 SER C C 135 173.590 173.300 0.290 1 1 1350 . 13 1 1 A 135 135 SER CA C 135 56.220 57.212 -0.992 1 1 1351 . 13 1 1 A 135 135 SER CB C 135 66.510 64.759 1.751 1 1 1352 . 13 1 1 A 135 135 SER N N 135 113.020 121.711 -8.691 1 1 1353 . 13 1 1 A 136 136 VAL H H 136 8.940 8.663 0.277 1 1 1354 . 13 1 1 A 136 136 VAL HA H 136 5.500 4.953 0.547 1 1 1362 . 13 1 1 A 136 136 VAL C C 136 175.730 174.755 0.975 1 1 1363 . 13 1 1 A 136 136 VAL CA C 136 60.960 60.800 0.160 1 1 1364 . 13 1 1 A 136 136 VAL CB C 136 33.630 32.919 0.711 1 1 1367 . 13 1 1 A 136 136 VAL N N 136 124.340 120.460 3.880 1 1 1368 . 13 1 1 A 137 137 THR H H 137 9.240 8.537 0.703 1 1 1369 . 13 1 1 A 137 137 THR HA H 137 4.920 4.804 0.116 1 1 1374 . 13 1 1 A 137 137 THR C C 137 173.500 174.266 -0.766 1 1 1375 . 13 1 1 A 137 137 THR CA C 137 59.120 60.200 -1.080 1 1 1376 . 13 1 1 A 137 137 THR CB C 137 72.500 70.535 1.965 1 1 1378 . 13 1 1 A 137 137 THR N N 137 117.010 118.928 -1.918 1 1 1379 . 13 1 1 A 138 138 ASN H H 138 9.190 8.932 0.258 1 1 1380 . 13 1 1 A 138 138 ASN HA H 138 4.420 4.264 0.156 1 1 1385 . 13 1 1 A 138 138 ASN C C 138 175.550 174.338 1.212 1 1 1386 . 13 1 1 A 138 138 ASN CA C 138 54.350 54.224 0.126 1 1 1387 . 13 1 1 A 138 138 ASN CB C 138 37.380 36.261 1.119 1 1 1388 . 13 1 1 A 138 138 ASN N N 138 115.270 119.574 -4.304 1 1 1390 . 13 1 1 A 139 139 SER H H 139 8.560 7.930 0.630 1 1 1391 . 13 1 1 A 139 139 SER HA H 139 5.800 4.445 1.355 1 1 1394 . 13 1 1 A 139 139 SER C C 139 175.750 174.102 1.648 1 1 1395 . 13 1 1 A 139 139 SER CA C 139 56.020 60.223 -4.203 1 1 1396 . 13 1 1 A 139 139 SER CB C 139 65.320 63.626 1.694 1 1 1397 . 13 1 1 A 139 139 SER N N 139 112.360 114.791 -2.431 1 1 1398 . 13 1 1 A 140 140 SER H H 140 9.900 8.222 1.678 1 1 1399 . 13 1 1 A 140 140 SER HA H 140 5.360 5.196 0.164 1 1 1402 . 13 1 1 A 140 140 SER C C 140 172.620 173.640 -1.020 1 1 1403 . 13 1 1 A 140 140 SER CA C 140 57.400 56.830 0.570 1 1 1404 . 13 1 1 A 140 140 SER CB C 140 66.550 65.716 0.834 1 1 1405 . 13 1 1 A 140 140 SER N N 140 119.130 122.599 -3.469 1 1 1406 . 13 1 1 A 141 141 VAL H H 141 9.030 8.716 0.314 1 1 1407 . 13 1 1 A 141 141 VAL HA H 141 5.520 5.023 0.497 1 1 1415 . 13 1 1 A 141 141 VAL C C 141 174.750 174.948 -0.198 1 1 1416 . 13 1 1 A 141 141 VAL CA C 141 58.310 60.055 -1.745 1 1 1417 . 13 1 1 A 141 141 VAL CB C 141 35.030 35.423 -0.393 1 1 1420 . 13 1 1 A 141 141 VAL N N 141 111.410 115.388 -3.978 1 1 1421 . 13 1 1 A 142 142 GLY H H 142 8.790 9.077 -0.287 1 1 1422 . 13 1 1 A 142 142 GLY HA2 H 142 3.600 4.006 -0.406 1 1 1423 . 13 1 1 A 142 142 GLY HA3 H 142 5.310 4.049 1.261 1 1 1424 . 13 1 1 A 142 142 GLY C C 142 174.180 173.364 0.816 1 1 1425 . 13 1 1 A 142 142 GLY CA C 142 44.110 46.199 -2.089 1 1 1426 . 13 1 1 A 142 142 GLY N N 142 109.330 111.647 -2.317 1 1 1427 . 13 1 1 A 143 143 ASP H H 143 8.840 8.241 0.599 1 1 1428 . 13 1 1 A 143 143 ASP HA H 143 5.790 4.983 0.807 1 1 1431 . 13 1 1 A 143 143 ASP C C 143 178.860 177.819 1.041 1 1 1432 . 13 1 1 A 143 143 ASP CA C 143 53.040 54.581 -1.541 1 1 1433 . 13 1 1 A 143 143 ASP CB C 143 43.660 42.470 1.190 1 1 1434 . 13 1 1 A 143 143 ASP N N 143 125.390 126.483 -1.093 1 1 1435 . 13 1 1 A 144 144 GLY H H 144 9.150 8.596 0.554 1 1 1436 . 13 1 1 A 144 144 GLY HA2 H 144 3.450 2.862 0.588 1 1 1437 . 13 1 1 A 144 144 GLY HA3 H 144 3.720 3.584 0.136 1 1 1438 . 13 1 1 A 144 144 GLY C C 144 174.770 176.010 -1.240 1 1 1439 . 13 1 1 A 144 144 GLY CA C 144 46.930 46.740 0.190 1 1 1440 . 13 1 1 A 144 144 GLY N N 144 106.470 109.850 -3.380 1 1 1441 . 13 1 1 A 145 145 GLU H H 145 8.470 8.134 0.336 1 1 1442 . 13 1 1 A 145 145 GLU HA H 145 4.460 4.108 0.352 1 1 1447 . 13 1 1 A 145 145 GLU C C 145 176.520 176.134 0.386 1 1 1448 . 13 1 1 A 145 145 GLU CA C 145 55.330 57.835 -2.505 1 1 1449 . 13 1 1 A 145 145 GLU CB C 145 30.620 30.160 0.460 1 1 1451 . 13 1 1 A 145 145 GLU N N 145 119.170 120.110 -0.940 1 1 1452 . 13 1 1 A 146 146 GLY H H 146 7.950 7.689 0.261 1 1 1453 . 13 1 1 A 146 146 GLY HA2 H 146 3.630 3.967 -0.337 1 1 1454 . 13 1 1 A 146 146 GLY HA3 H 146 4.130 3.986 0.144 1 1 1455 . 13 1 1 A 146 146 GLY C C 146 174.350 174.622 -0.272 1 1 1456 . 13 1 1 A 146 146 GLY CA C 146 45.330 45.352 -0.022 1 1 1457 . 13 1 1 A 146 146 GLY N N 146 108.130 106.722 1.408 1 1 1458 . 13 1 1 A 147 147 LEU H H 147 8.440 7.918 0.522 1 1 1459 . 13 1 1 A 147 147 LEU HA H 147 4.340 4.135 0.205 1 1 1469 . 13 1 1 A 147 147 LEU C C 147 175.950 175.820 0.130 1 1 1470 . 13 1 1 A 147 147 LEU CA C 147 54.860 54.132 0.728 1 1 1471 . 13 1 1 A 147 147 LEU CB C 147 41.590 40.899 0.691 1 1 1475 . 13 1 1 A 147 147 LEU N N 147 124.000 122.348 1.652 1 1 1476 . 13 1 1 A 148 148 VAL H H 148 7.780 8.282 -0.502 1 1 1477 . 13 1 1 A 148 148 VAL HA H 148 4.830 4.297 0.533 1 1 1485 . 13 1 1 A 148 148 VAL C C 148 175.740 174.825 0.915 1 1 1486 . 13 1 1 A 148 148 VAL CA C 148 61.140 62.478 -1.338 1 1 1487 . 13 1 1 A 148 148 VAL CB C 148 33.640 32.691 0.949 1 1 1490 . 13 1 1 A 148 148 VAL N N 148 120.440 125.795 -5.355 1 1 1491 . 13 1 1 A 149 149 HIS H H 149 9.170 8.573 0.597 1 1 1492 . 13 1 1 A 149 149 HIS HA H 149 4.950 5.064 -0.114 1 1 1496 . 13 1 1 A 149 149 HIS C C 149 174.780 174.753 0.027 1 1 1497 . 13 1 1 A 149 149 HIS CA C 149 53.900 54.348 -0.448 1 1 1498 . 13 1 1 A 149 149 HIS CB C 149 32.200 30.400 1.800 1 1 1499 . 13 1 1 A 149 149 HIS N N 149 124.700 126.158 -1.458 1 1 1500 . 13 1 1 A 150 150 GLU H H 150 9.060 8.653 0.407 1 1 1501 . 13 1 1 A 150 150 GLU HA H 150 4.420 4.275 0.145 1 1 1506 . 13 1 1 A 150 150 GLU C C 150 176.520 176.747 -0.227 1 1 1507 . 13 1 1 A 150 150 GLU CA C 150 57.630 57.019 0.611 1 1 1508 . 13 1 1 A 150 150 GLU CB C 150 30.370 29.816 0.554 1 1 1510 . 13 1 1 A 150 150 GLU N N 150 125.540 123.804 1.736 1 1 1511 . 13 1 1 A 151 151 ILE H H 151 8.150 8.097 0.053 1 1 1512 . 13 1 1 A 151 151 ILE HA H 151 4.780 4.478 0.302 1 1 1522 . 13 1 1 A 151 151 ILE C C 151 174.570 176.279 -1.709 1 1 1523 . 13 1 1 A 151 151 ILE CA C 151 59.390 59.567 -0.177 1 1 1524 . 13 1 1 A 151 151 ILE CB C 151 42.040 39.291 2.749 1 1 1528 . 13 1 1 A 151 151 ILE N N 151 115.880 122.728 -6.848 1 1 1529 . 13 1 1 A 152 152 ALA H H 152 8.010 8.414 -0.404 1 1 1530 . 13 1 1 A 152 152 ALA HA H 152 4.310 4.364 -0.054 1 1 1534 . 13 1 1 A 152 152 ALA C C 152 177.500 176.898 0.602 1 1 1535 . 13 1 1 A 152 152 ALA CA C 152 53.680 51.941 1.739 1 1 1536 . 13 1 1 A 152 152 ALA CB C 152 20.050 19.952 0.098 1 1 1537 . 13 1 1 A 152 152 ALA N N 152 126.640 124.448 2.192 1 1 1538 . 13 1 1 A 153 153 GLY H H 153 8.340 8.339 0.001 1 1 1539 . 13 1 1 A 153 153 GLY HA2 H 153 4.050 4.321 -0.271 1 1 1540 . 13 1 1 A 153 153 GLY HA3 H 153 4.140 4.326 -0.186 1 1 1541 . 13 1 1 A 153 153 GLY C C 153 173.140 171.815 1.325 1 1 1542 . 13 1 1 A 153 153 GLY CA C 153 44.130 45.947 -1.817 1 1 1543 . 13 1 1 A 153 153 GLY N N 153 107.490 105.133 2.357 1 1 1544 . 13 1 1 A 154 154 THR H H 154 7.380 7.877 -0.497 1 1 1545 . 13 1 1 A 154 154 THR HA H 154 4.700 4.767 -0.067 1 1 1550 . 13 1 1 A 154 154 THR C C 154 171.120 171.853 -0.733 1 1 1551 . 13 1 1 A 154 154 THR CA C 154 60.830 60.258 0.572 1 1 1552 . 13 1 1 A 154 154 THR CB C 154 68.850 69.717 -0.867 1 1 1554 . 13 1 1 A 154 154 THR N N 154 109.340 112.083 -2.743 1 1 1555 . 13 1 1 A 155 155 GLU H H 155 8.020 8.657 -0.637 1 1 1556 . 13 1 1 A 155 155 GLU HA H 155 5.370 5.148 0.222 1 1 1561 . 13 1 1 A 155 155 GLU C C 155 174.240 174.062 0.178 1 1 1562 . 13 1 1 A 155 155 GLU CA C 155 54.830 55.728 -0.898 1 1 1563 . 13 1 1 A 155 155 GLU CB C 155 33.620 33.619 0.001 1 1 1565 . 13 1 1 A 155 155 GLU N N 155 118.690 124.061 -5.371 1 1 1566 . 13 1 1 A 156 156 LYS H H 156 9.230 9.160 0.070 1 1 1567 . 13 1 1 A 156 156 LYS HA H 156 4.650 4.958 -0.308 1 1 1576 . 13 1 1 A 156 156 LYS C C 156 174.000 174.588 -0.588 1 1 1577 . 13 1 1 A 156 156 LYS CA C 156 55.840 55.317 0.523 1 1 1578 . 13 1 1 A 156 156 LYS CB C 156 37.550 36.514 1.036 1 1 1582 . 13 1 1 A 156 156 LYS N N 156 121.940 124.361 -2.421 1 1 1583 . 13 1 1 A 157 157 THR H H 157 8.160 8.648 -0.488 1 1 1584 . 13 1 1 A 157 157 THR HA H 157 5.440 5.119 0.321 1 1 1589 . 13 1 1 A 157 157 THR C C 157 174.360 173.503 0.857 1 1 1590 . 13 1 1 A 157 157 THR CA C 157 60.410 60.712 -0.302 1 1 1591 . 13 1 1 A 157 157 THR CB C 157 71.500 71.176 0.324 1 1 1593 . 13 1 1 A 157 157 THR N N 157 113.240 112.904 0.336 1 1 1594 . 13 1 1 A 158 158 VAL H H 158 9.120 9.069 0.051 1 1 1595 . 13 1 1 A 158 158 VAL HA H 158 4.580 4.988 -0.408 1 1 1603 . 13 1 1 A 158 158 VAL C C 158 172.800 174.630 -1.830 1 1 1604 . 13 1 1 A 158 158 VAL CA C 158 59.980 60.503 -0.523 1 1 1605 . 13 1 1 A 158 158 VAL CB C 158 36.290 34.104 2.186 1 1 1608 . 13 1 1 A 158 158 VAL N N 158 121.710 122.291 -0.581 1 1 1609 . 13 1 1 A 159 159 ASN H H 159 8.240 8.643 -0.403 1 1 1610 . 13 1 1 A 159 159 ASN HA H 159 5.420 5.049 0.371 1 1 1615 . 13 1 1 A 159 159 ASN C C 159 173.800 174.283 -0.483 1 1 1616 . 13 1 1 A 159 159 ASN CA C 159 51.740 52.585 -0.845 1 1 1617 . 13 1 1 A 159 159 ASN CB C 159 40.380 39.280 1.100 1 1 1618 . 13 1 1 A 159 159 ASN N N 159 122.730 125.306 -2.576 1 1 1620 . 13 1 1 A 160 160 ILE H H 160 9.160 8.607 0.553 1 1 1621 . 13 1 1 A 160 160 ILE HA H 160 5.130 4.898 0.232 1 1 1631 . 13 1 1 A 160 160 ILE C C 160 177.320 175.659 1.661 1 1 1632 . 13 1 1 A 160 160 ILE CA C 160 60.640 61.204 -0.564 1 1 1633 . 13 1 1 A 160 160 ILE CB C 160 38.520 37.794 0.726 1 1 1637 . 13 1 1 A 160 160 ILE N N 160 123.690 125.847 -2.157 1 1 1638 . 13 1 1 A 161 161 ILE H H 161 8.780 9.010 -0.230 1 1 1639 . 13 1 1 A 161 161 ILE HA H 161 4.590 4.601 -0.011 1 1 1649 . 13 1 1 A 161 161 ILE C C 161 174.960 175.890 -0.930 1 1 1650 . 13 1 1 A 161 161 ILE CA C 161 59.320 60.574 -1.254 1 1 1651 . 13 1 1 A 161 161 ILE CB C 161 41.030 39.559 1.471 1 1 1655 . 13 1 1 A 161 161 ILE N N 161 122.490 129.165 -6.675 1 1 1656 . 13 1 1 A 162 162 GLU H H 162 8.620 8.642 -0.022 1 1 1657 . 13 1 1 A 162 162 GLU HA H 162 4.290 4.213 0.077 1 1 1662 . 13 1 1 A 162 162 GLU C C 162 176.660 176.777 -0.117 1 1 1663 . 13 1 1 A 162 162 GLU CA C 162 56.470 58.130 -1.660 1 1 1664 . 13 1 1 A 162 162 GLU CB C 162 31.150 30.138 1.012 1 1 1666 . 13 1 1 A 162 162 GLU N N 162 120.520 127.293 -6.773 1 1 1667 . 13 1 1 A 163 163 GLY H H 163 8.480 8.345 0.135 1 1 1668 . 13 1 1 A 163 163 GLY HA2 H 163 3.910 4.111 -0.201 1 1 1669 . 13 1 1 A 163 163 GLY HA3 H 163 4.150 4.111 0.039 1 1 1670 . 13 1 1 A 163 163 GLY C C 163 174.000 171.924 2.076 1 1 1671 . 13 1 1 A 163 163 GLY CA C 163 45.270 45.847 -0.577 1 1 1672 . 13 1 1 A 163 163 GLY N N 163 110.210 109.798 0.412 1 1 1673 . 13 1 1 A 164 164 THR H H 164 8.170 8.827 -0.657 1 1 1674 . 13 1 1 A 164 164 THR HA H 164 4.410 4.837 -0.427 1 1 1679 . 13 1 1 A 164 164 THR C C 164 174.100 173.611 0.489 1 1 1680 . 13 1 1 A 164 164 THR CA C 164 61.620 60.627 0.993 1 1 1681 . 13 1 1 A 164 164 THR CB C 164 70.060 72.695 -2.635 1 1 1683 . 13 1 1 A 164 164 THR N N 164 113.480 120.356 -6.876 1 1 1 . 14 1 1 A 13 13 GLY H H 13 8.350 8.389 -0.039 1 1 2 . 14 1 1 A 13 13 GLY HA2 H 13 3.920 4.283 -0.363 1 1 3 . 14 1 1 A 13 13 GLY HA3 H 13 3.920 4.295 -0.375 1 1 4 . 14 1 1 A 13 13 GLY CA C 13 45.290 46.140 -0.850 1 1 5 . 14 1 1 A 13 13 GLY N N 13 110.450 108.753 1.697 1 1 6 . 14 1 1 A 14 14 LEU H H 14 8.050 8.403 -0.353 1 1 7 . 14 1 1 A 14 14 LEU N N 14 121.500 123.132 -1.632 1 1 8 . 14 1 1 A 15 15 VAL H H 15 8.070 8.753 -0.683 1 1 9 . 14 1 1 A 15 15 VAL N N 15 122.390 123.798 -1.408 1 1 10 . 14 1 1 A 16 16 PRO HA H 16 4.360 4.356 0.004 1 1 17 . 14 1 1 A 16 16 PRO CA C 16 62.770 65.696 -2.926 1 1 18 . 14 1 1 A 16 16 PRO CB C 16 32.020 31.452 0.568 1 1 21 . 14 1 1 A 21 21 MET H H 21 8.180 8.763 -0.583 1 1 22 . 14 1 1 A 21 21 MET N N 21 121.310 116.886 4.424 1 1 23 . 14 1 1 A 22 22 ALA H H 22 8.290 7.724 0.566 1 1 24 . 14 1 1 A 22 22 ALA N N 22 124.800 120.438 4.362 1 1 25 . 14 1 1 A 23 23 SER H H 23 8.210 9.174 -0.964 1 1 26 . 14 1 1 A 23 23 SER N N 23 114.830 113.749 1.081 1 1 27 . 14 1 1 A 24 24 LYS H H 24 8.250 7.568 0.682 1 1 28 . 14 1 1 A 24 24 LYS N N 24 122.980 118.132 4.848 1 1 29 . 14 1 1 A 25 25 LEU H H 25 8.140 8.724 -0.584 1 1 30 . 14 1 1 A 25 25 LEU HA H 25 4.290 4.310 -0.020 1 1 40 . 14 1 1 A 25 25 LEU C C 25 177.410 177.904 -0.494 1 1 41 . 14 1 1 A 25 25 LEU CA C 25 55.430 56.294 -0.864 1 1 42 . 14 1 1 A 25 25 LEU CB C 25 42.350 42.524 -0.174 1 1 46 . 14 1 1 A 25 25 LEU N N 25 122.580 127.504 -4.924 1 1 47 . 14 1 1 A 26 26 LYS H H 26 8.200 7.921 0.279 1 1 48 . 14 1 1 A 26 26 LYS HA H 26 4.260 4.169 0.091 1 1 57 . 14 1 1 A 26 26 LYS C C 26 176.520 176.156 0.364 1 1 58 . 14 1 1 A 26 26 LYS CA C 26 56.700 58.871 -2.171 1 1 59 . 14 1 1 A 26 26 LYS CB C 26 33.060 33.117 -0.057 1 1 63 . 14 1 1 A 26 26 LYS N N 26 121.800 118.782 3.018 1 1 64 . 14 1 1 A 27 27 GLU H H 27 8.380 8.167 0.213 1 1 65 . 14 1 1 A 27 27 GLU HA H 27 4.240 4.392 -0.152 1 1 70 . 14 1 1 A 27 27 GLU C C 27 176.130 175.692 0.438 1 1 71 . 14 1 1 A 27 27 GLU CA C 27 56.700 58.727 -2.027 1 1 72 . 14 1 1 A 27 27 GLU CB C 27 30.370 28.663 1.707 1 1 74 . 14 1 1 A 27 27 GLU N N 27 121.700 117.873 3.827 1 1 75 . 14 1 1 A 28 28 ALA H H 28 8.230 8.730 -0.500 1 1 76 . 14 1 1 A 28 28 ALA HA H 28 4.280 5.367 -1.087 1 1 80 . 14 1 1 A 28 28 ALA C C 28 177.090 176.126 0.964 1 1 81 . 14 1 1 A 28 28 ALA CA C 28 52.530 50.080 2.450 1 1 82 . 14 1 1 A 28 28 ALA CB C 28 19.360 22.578 -3.218 1 1 83 . 14 1 1 A 28 28 ALA N N 28 124.640 124.489 0.151 1 1 84 . 14 1 1 A 29 29 ALA H H 29 8.150 8.573 -0.423 1 1 85 . 14 1 1 A 29 29 ALA HA H 29 4.320 4.694 -0.374 1 1 89 . 14 1 1 A 29 29 ALA C C 29 177.120 175.820 1.300 1 1 90 . 14 1 1 A 29 29 ALA CA C 29 52.040 51.955 0.085 1 1 91 . 14 1 1 A 29 29 ALA CB C 29 19.430 18.869 0.561 1 1 92 . 14 1 1 A 29 29 ALA N N 29 123.430 123.561 -0.131 1 1 93 . 14 1 1 A 30 30 GLU H H 30 8.310 8.794 -0.484 1 1 94 . 14 1 1 A 30 30 GLU HA H 30 4.220 4.628 -0.408 1 1 99 . 14 1 1 A 30 30 GLU C C 30 176.310 175.138 1.172 1 1 100 . 14 1 1 A 30 30 GLU CA C 30 56.630 55.329 1.301 1 1 101 . 14 1 1 A 30 30 GLU CB C 30 30.320 29.442 0.878 1 1 103 . 14 1 1 A 30 30 GLU N N 30 120.630 122.616 -1.986 1 1 104 . 14 1 1 A 31 31 VAL H H 31 8.630 8.600 0.030 1 1 105 . 14 1 1 A 31 31 VAL HA H 31 4.430 4.842 -0.412 1 1 113 . 14 1 1 A 31 31 VAL C C 31 176.510 175.898 0.612 1 1 114 . 14 1 1 A 31 31 VAL CA C 31 62.360 63.093 -0.733 1 1 115 . 14 1 1 A 31 31 VAL CB C 31 32.370 31.977 0.393 1 1 118 . 14 1 1 A 31 31 VAL N N 31 127.110 125.795 1.315 1 1 119 . 14 1 1 A 32 32 THR H H 32 7.640 8.684 -1.044 1 1 120 . 14 1 1 A 32 32 THR HA H 32 4.870 4.018 0.852 1 1 125 . 14 1 1 A 32 32 THR C C 32 172.220 174.689 -2.469 1 1 126 . 14 1 1 A 32 32 THR CA C 32 59.510 64.348 -4.838 1 1 127 . 14 1 1 A 32 32 THR CB C 32 71.630 70.175 1.455 1 1 129 . 14 1 1 A 32 32 THR N N 32 118.860 121.709 -2.849 1 1 130 . 14 1 1 A 33 33 GLY H H 33 8.350 7.818 0.532 1 1 131 . 14 1 1 A 33 33 GLY HA2 H 33 4.160 4.026 0.134 1 1 132 . 14 1 1 A 33 33 GLY HA3 H 33 4.250 4.045 0.205 1 1 133 . 14 1 1 A 33 33 GLY C C 33 172.820 173.127 -0.307 1 1 134 . 14 1 1 A 33 33 GLY CA C 33 46.680 44.912 1.768 1 1 135 . 14 1 1 A 33 33 GLY N N 33 106.720 109.367 -2.647 1 1 136 . 14 1 1 A 34 34 SER H H 34 8.810 8.715 0.095 1 1 137 . 14 1 1 A 34 34 SER HA H 34 5.390 5.101 0.289 1 1 140 . 14 1 1 A 34 34 SER C C 34 173.780 172.711 1.069 1 1 141 . 14 1 1 A 34 34 SER CA C 34 57.380 57.469 -0.089 1 1 142 . 14 1 1 A 34 34 SER CB C 34 65.730 66.934 -1.204 1 1 143 . 14 1 1 A 34 34 SER N N 34 112.690 118.362 -5.672 1 1 144 . 14 1 1 A 35 35 VAL H H 35 8.470 8.680 -0.210 1 1 145 . 14 1 1 A 35 35 VAL HA H 35 4.120 4.700 -0.580 1 1 153 . 14 1 1 A 35 35 VAL C C 35 174.750 174.243 0.507 1 1 154 . 14 1 1 A 35 35 VAL CA C 35 62.310 60.563 1.747 1 1 155 . 14 1 1 A 35 35 VAL CB C 35 34.550 33.195 1.355 1 1 158 . 14 1 1 A 35 35 VAL N N 35 123.150 120.006 3.144 1 1 159 . 14 1 1 A 36 36 SER H H 36 8.240 8.761 -0.521 1 1 160 . 14 1 1 A 36 36 SER HA H 36 4.690 4.699 -0.009 1 1 163 . 14 1 1 A 36 36 SER C C 36 171.860 173.381 -1.521 1 1 164 . 14 1 1 A 36 36 SER CA C 36 56.020 56.556 -0.536 1 1 165 . 14 1 1 A 36 36 SER CB C 36 66.050 63.745 2.305 1 1 166 . 14 1 1 A 36 36 SER N N 36 118.760 120.458 -1.698 1 1 167 . 14 1 1 A 37 37 LEU H H 37 8.310 8.950 -0.640 1 1 168 . 14 1 1 A 37 37 LEU HA H 37 4.870 4.908 -0.038 1 1 178 . 14 1 1 A 37 37 LEU C C 37 174.190 175.482 -1.292 1 1 179 . 14 1 1 A 37 37 LEU CA C 37 53.870 53.846 0.024 1 1 180 . 14 1 1 A 37 37 LEU CB C 37 47.000 43.704 3.296 1 1 184 . 14 1 1 A 37 37 LEU N N 37 124.790 130.436 -5.646 1 1 185 . 14 1 1 A 38 38 GLU H H 38 9.270 8.833 0.437 1 1 186 . 14 1 1 A 38 38 GLU HA H 38 4.650 4.970 -0.320 1 1 191 . 14 1 1 A 38 38 GLU C C 38 173.970 175.166 -1.196 1 1 192 . 14 1 1 A 38 38 GLU CA C 38 54.410 55.885 -1.475 1 1 193 . 14 1 1 A 38 38 GLU CB C 38 32.460 32.078 0.382 1 1 195 . 14 1 1 A 38 38 GLU N N 38 126.550 127.556 -1.006 1 1 196 . 14 1 1 A 39 39 ALA H H 39 8.120 8.580 -0.460 1 1 197 . 14 1 1 A 39 39 ALA HA H 39 4.600 4.741 -0.141 1 1 201 . 14 1 1 A 39 39 ALA C C 39 175.930 176.986 -1.056 1 1 202 . 14 1 1 A 39 39 ALA CA C 39 51.570 50.332 1.238 1 1 203 . 14 1 1 A 39 39 ALA CB C 39 21.780 22.709 -0.929 1 1 204 . 14 1 1 A 39 39 ALA N N 39 124.410 129.484 -5.074 1 1 205 . 14 1 1 A 40 40 LEU H H 40 7.860 9.078 -1.218 1 1 206 . 14 1 1 A 40 40 LEU HA H 40 4.230 3.918 0.312 1 1 216 . 14 1 1 A 40 40 LEU C C 40 175.940 176.480 -0.540 1 1 217 . 14 1 1 A 40 40 LEU CA C 40 55.360 57.437 -2.077 1 1 218 . 14 1 1 A 40 40 LEU CB C 40 42.990 42.457 0.533 1 1 222 . 14 1 1 A 40 40 LEU N N 40 120.640 120.888 -0.248 1 1 223 . 14 1 1 A 41 41 GLU H H 41 8.210 7.947 0.263 1 1 224 . 14 1 1 A 41 41 GLU HA H 41 4.240 3.986 0.254 1 1 229 . 14 1 1 A 41 41 GLU C C 41 176.920 174.795 2.125 1 1 230 . 14 1 1 A 41 41 GLU CA C 41 58.090 57.520 0.570 1 1 231 . 14 1 1 A 41 41 GLU CB C 41 30.530 27.083 3.447 1 1 233 . 14 1 1 A 41 41 GLU N N 41 114.680 116.311 -1.631 1 1 234 . 14 1 1 A 42 42 GLU H H 42 7.490 7.750 -0.260 1 1 235 . 14 1 1 A 42 42 GLU HA H 42 5.680 4.926 0.754 1 1 240 . 14 1 1 A 42 42 GLU C C 42 173.790 174.195 -0.405 1 1 241 . 14 1 1 A 42 42 GLU CA C 42 54.360 56.290 -1.930 1 1 242 . 14 1 1 A 42 42 GLU CB C 42 33.850 32.615 1.235 1 1 244 . 14 1 1 A 42 42 GLU N N 42 116.670 118.129 -1.459 1 1 245 . 14 1 1 A 43 43 VAL H H 43 8.550 9.254 -0.704 1 1 246 . 14 1 1 A 43 43 VAL HA H 43 4.550 5.046 -0.496 1 1 254 . 14 1 1 A 43 43 VAL C C 43 172.220 173.146 -0.926 1 1 255 . 14 1 1 A 43 43 VAL CA C 43 59.470 59.313 0.157 1 1 256 . 14 1 1 A 43 43 VAL CB C 43 35.470 35.919 -0.449 1 1 259 . 14 1 1 A 43 43 VAL N N 43 120.030 125.815 -5.785 1 1 260 . 14 1 1 A 44 44 GLN H H 44 8.470 8.904 -0.434 1 1 261 . 14 1 1 A 44 44 GLN HA H 44 4.890 5.220 -0.330 1 1 268 . 14 1 1 A 44 44 GLN C C 44 176.130 174.961 1.169 1 1 269 . 14 1 1 A 44 44 GLN CA C 44 54.360 54.150 0.210 1 1 270 . 14 1 1 A 44 44 GLN CB C 44 30.610 32.197 -1.587 1 1 272 . 14 1 1 A 44 44 GLN N N 44 124.690 125.801 -1.111 1 1 274 . 14 1 1 A 45 45 VAL H H 45 8.130 8.591 -0.461 1 1 275 . 14 1 1 A 45 45 VAL HA H 45 3.030 3.968 -0.938 1 1 283 . 14 1 1 A 45 45 VAL C C 45 176.710 177.137 -0.427 1 1 284 . 14 1 1 A 45 45 VAL CA C 45 65.810 64.966 0.844 1 1 285 . 14 1 1 A 45 45 VAL CB C 45 31.960 31.524 0.436 1 1 288 . 14 1 1 A 45 45 VAL N N 45 120.450 127.342 -6.892 1 1 289 . 14 1 1 A 46 46 GLY H H 46 8.950 9.448 -0.498 1 1 290 . 14 1 1 A 46 46 GLY HA2 H 46 3.590 3.996 -0.406 1 1 291 . 14 1 1 A 46 46 GLY HA3 H 46 4.410 3.996 0.414 1 1 292 . 14 1 1 A 46 46 GLY C C 46 174.390 174.391 -0.001 1 1 293 . 14 1 1 A 46 46 GLY CA C 46 44.730 45.167 -0.437 1 1 294 . 14 1 1 A 46 46 GLY N N 46 116.490 115.223 1.267 1 1 295 . 14 1 1 A 47 47 GLU H H 47 8.260 7.815 0.445 1 1 296 . 14 1 1 A 47 47 GLU HA H 47 4.460 4.763 -0.303 1 1 301 . 14 1 1 A 47 47 GLU C C 47 174.780 175.418 -0.638 1 1 302 . 14 1 1 A 47 47 GLU CA C 47 54.830 54.961 -0.131 1 1 303 . 14 1 1 A 47 47 GLU CB C 47 31.140 31.575 -0.435 1 1 305 . 14 1 1 A 47 47 GLU N N 47 120.520 120.147 0.373 1 1 306 . 14 1 1 A 48 48 ASN H H 48 8.440 8.707 -0.267 1 1 307 . 14 1 1 A 48 48 ASN HA H 48 5.380 5.479 -0.099 1 1 312 . 14 1 1 A 48 48 ASN C C 48 174.770 173.815 0.955 1 1 313 . 14 1 1 A 48 48 ASN CA C 48 51.570 51.993 -0.423 1 1 314 . 14 1 1 A 48 48 ASN CB C 48 39.010 41.916 -2.906 1 1 315 . 14 1 1 A 48 48 ASN N N 48 117.180 118.319 -1.139 1 1 317 . 14 1 1 A 49 49 LEU H H 49 9.810 8.748 1.062 1 1 318 . 14 1 1 A 49 49 LEU HA H 49 4.510 5.255 -0.745 1 1 328 . 14 1 1 A 49 49 LEU C C 49 174.560 174.602 -0.042 1 1 329 . 14 1 1 A 49 49 LEU CA C 49 53.460 53.526 -0.066 1 1 330 . 14 1 1 A 49 49 LEU CB C 49 45.520 46.487 -0.967 1 1 333 . 14 1 1 A 49 49 LEU N N 49 125.620 123.859 1.761 1 1 334 . 14 1 1 A 50 50 GLU H H 50 8.750 8.877 -0.127 1 1 335 . 14 1 1 A 50 50 GLU HA H 50 4.360 4.877 -0.517 1 1 340 . 14 1 1 A 50 50 GLU C C 50 175.340 174.763 0.577 1 1 341 . 14 1 1 A 50 50 GLU CA C 50 55.550 55.269 0.281 1 1 342 . 14 1 1 A 50 50 GLU CB C 50 29.890 31.108 -1.218 1 1 344 . 14 1 1 A 50 50 GLU N N 50 125.420 124.864 0.556 1 1 345 . 14 1 1 A 51 51 VAL H H 51 9.230 8.984 0.246 1 1 346 . 14 1 1 A 51 51 VAL HA H 51 4.190 4.745 -0.555 1 1 354 . 14 1 1 A 51 51 VAL C C 51 175.310 174.977 0.333 1 1 355 . 14 1 1 A 51 51 VAL CA C 51 62.520 61.072 1.448 1 1 356 . 14 1 1 A 51 51 VAL CB C 51 31.470 33.255 -1.785 1 1 359 . 14 1 1 A 51 51 VAL N N 51 129.810 125.817 3.993 1 1 360 . 14 1 1 A 52 52 GLY H H 52 9.410 8.952 0.458 1 1 361 . 14 1 1 A 52 52 GLY HA2 H 52 3.460 3.905 -0.445 1 1 362 . 14 1 1 A 52 52 GLY HA3 H 52 4.680 3.940 0.740 1 1 363 . 14 1 1 A 52 52 GLY C C 52 173.000 173.222 -0.222 1 1 364 . 14 1 1 A 52 52 GLY CA C 52 46.470 47.443 -0.973 1 1 365 . 14 1 1 A 52 52 GLY N N 52 116.600 116.699 -0.099 1 1 366 . 14 1 1 A 53 53 VAL H H 53 9.130 8.640 0.490 1 1 367 . 14 1 1 A 53 53 VAL HA H 53 4.840 4.892 -0.052 1 1 375 . 14 1 1 A 53 53 VAL C C 53 175.470 175.167 0.303 1 1 376 . 14 1 1 A 53 53 VAL CA C 53 61.350 61.513 -0.163 1 1 377 . 14 1 1 A 53 53 VAL CB C 53 34.300 31.613 2.687 1 1 380 . 14 1 1 A 53 53 VAL N N 53 129.050 123.113 5.937 1 1 381 . 14 1 1 A 54 54 GLY H H 54 8.420 8.122 0.298 1 1 382 . 14 1 1 A 54 54 GLY HA2 H 54 3.850 3.923 -0.073 1 1 383 . 14 1 1 A 54 54 GLY HA3 H 54 3.850 3.951 -0.101 1 1 384 . 14 1 1 A 54 54 GLY C C 54 173.310 173.034 0.276 1 1 385 . 14 1 1 A 54 54 GLY CA C 54 45.180 44.284 0.896 1 1 386 . 14 1 1 A 54 54 GLY N N 54 116.890 115.473 1.417 1 1 387 . 14 1 1 A 55 55 ILE H H 55 10.190 7.996 2.194 1 1 388 . 14 1 1 A 55 55 ILE HA H 55 4.010 4.569 -0.559 1 1 398 . 14 1 1 A 55 55 ILE C C 55 174.380 175.000 -0.620 1 1 399 . 14 1 1 A 55 55 ILE CA C 55 61.350 60.072 1.278 1 1 400 . 14 1 1 A 55 55 ILE CB C 55 40.840 39.768 1.072 1 1 404 . 14 1 1 A 55 55 ILE N N 55 129.330 121.647 7.683 1 1 405 . 14 1 1 A 56 56 ASP H H 56 8.810 9.702 -0.892 1 1 406 . 14 1 1 A 56 56 ASP HA H 56 4.440 4.835 -0.395 1 1 409 . 14 1 1 A 56 56 ASP C C 56 175.530 175.892 -0.362 1 1 410 . 14 1 1 A 56 56 ASP CA C 56 56.460 55.674 0.786 1 1 411 . 14 1 1 A 56 56 ASP CB C 56 42.720 43.127 -0.407 1 1 412 . 14 1 1 A 56 56 ASP N N 56 128.310 127.430 0.880 1 1 413 . 14 1 1 A 57 57 GLU H H 57 7.270 7.237 0.033 1 1 414 . 14 1 1 A 57 57 GLU HA H 57 4.290 4.588 -0.298 1 1 419 . 14 1 1 A 57 57 GLU C C 57 173.370 174.138 -0.768 1 1 420 . 14 1 1 A 57 57 GLU CA C 57 54.840 55.474 -0.634 1 1 421 . 14 1 1 A 57 57 GLU CB C 57 33.190 32.383 0.807 1 1 423 . 14 1 1 A 57 57 GLU N N 57 112.810 113.194 -0.384 1 1 424 . 14 1 1 A 58 58 LEU H H 58 8.370 8.713 -0.343 1 1 425 . 14 1 1 A 58 58 LEU HA H 58 4.830 5.022 -0.192 1 1 434 . 14 1 1 A 58 58 LEU C C 58 174.180 175.920 -1.740 1 1 435 . 14 1 1 A 58 58 LEU CA C 58 55.320 53.453 1.867 1 1 436 . 14 1 1 A 58 58 LEU CB C 58 44.300 43.606 0.694 1 1 439 . 14 1 1 A 58 58 LEU N N 58 123.130 121.381 1.749 1 1 440 . 14 1 1 A 59 59 VAL H H 59 9.120 8.638 0.482 1 1 441 . 14 1 1 A 59 59 VAL HA H 59 4.240 4.278 -0.038 1 1 449 . 14 1 1 A 59 59 VAL C C 59 174.960 176.075 -1.115 1 1 450 . 14 1 1 A 59 59 VAL CA C 59 61.760 61.603 0.157 1 1 451 . 14 1 1 A 59 59 VAL CB C 59 33.760 31.831 1.929 1 1 454 . 14 1 1 A 59 59 VAL N N 59 127.930 122.203 5.727 1 1 455 . 14 1 1 A 60 60 ASN H H 60 8.770 8.863 -0.093 1 1 456 . 14 1 1 A 60 60 ASN HA H 60 4.250 4.345 -0.095 1 1 461 . 14 1 1 A 60 60 ASN C C 60 172.810 173.796 -0.986 1 1 462 . 14 1 1 A 60 60 ASN CA C 60 54.830 54.337 0.493 1 1 463 . 14 1 1 A 60 60 ASN CB C 60 36.030 36.653 -0.623 1 1 464 . 14 1 1 A 60 60 ASN N N 60 115.500 119.135 -3.635 1 1 466 . 14 1 1 A 61 61 ALA H H 61 7.330 7.356 -0.026 1 1 467 . 14 1 1 A 61 61 ALA HA H 61 4.520 5.043 -0.523 1 1 471 . 14 1 1 A 61 61 ALA C C 61 174.580 175.721 -1.141 1 1 472 . 14 1 1 A 61 61 ALA CA C 61 51.560 50.722 0.838 1 1 473 . 14 1 1 A 61 61 ALA CB C 61 22.870 23.096 -0.226 1 1 474 . 14 1 1 A 61 61 ALA N N 61 115.640 118.404 -2.764 1 1 475 . 14 1 1 A 62 62 GLU H H 62 7.900 9.316 -1.416 1 1 476 . 14 1 1 A 62 62 GLU HA H 62 4.310 5.008 -0.698 1 1 481 . 14 1 1 A 62 62 GLU C C 62 173.790 175.380 -1.590 1 1 482 . 14 1 1 A 62 62 GLU CA C 62 55.080 55.226 -0.146 1 1 483 . 14 1 1 A 62 62 GLU CB C 62 32.610 30.738 1.872 1 1 485 . 14 1 1 A 62 62 GLU N N 62 117.400 120.843 -3.443 1 1 486 . 14 1 1 A 63 63 ALA H H 63 8.910 8.482 0.428 1 1 487 . 14 1 1 A 63 63 ALA HA H 63 4.690 4.488 0.202 1 1 491 . 14 1 1 A 63 63 ALA C C 63 175.720 176.925 -1.205 1 1 492 . 14 1 1 A 63 63 ALA CA C 63 50.600 53.390 -2.790 1 1 493 . 14 1 1 A 63 63 ALA CB C 63 20.660 19.243 1.417 1 1 494 . 14 1 1 A 63 63 ALA N N 63 122.480 126.182 -3.702 1 1 495 . 14 1 1 A 64 64 PHE H H 64 9.220 9.251 -0.031 1 1 496 . 14 1 1 A 64 64 PHE HA H 64 4.320 4.711 -0.391 1 1 501 . 14 1 1 A 64 64 PHE C C 64 174.380 176.286 -1.906 1 1 502 . 14 1 1 A 64 64 PHE CA C 64 59.770 58.721 1.049 1 1 503 . 14 1 1 A 64 64 PHE CB C 64 40.830 41.012 -0.182 1 1 504 . 14 1 1 A 64 64 PHE N N 64 120.870 122.590 -1.720 1 1 505 . 14 1 1 A 65 65 ALA H H 65 8.150 7.897 0.253 1 1 506 . 14 1 1 A 65 65 ALA HA H 65 5.280 4.791 0.489 1 1 510 . 14 1 1 A 65 65 ALA C C 65 175.950 174.961 0.989 1 1 511 . 14 1 1 A 65 65 ALA CA C 65 51.120 51.412 -0.292 1 1 512 . 14 1 1 A 65 65 ALA CB C 65 22.850 21.181 1.669 1 1 513 . 14 1 1 A 65 65 ALA N N 65 122.350 119.757 2.593 1 1 514 . 14 1 1 A 66 66 TYR H H 66 9.260 9.338 -0.078 1 1 515 . 14 1 1 A 66 66 TYR HA H 66 5.710 5.279 0.431 1 1 520 . 14 1 1 A 66 66 TYR C C 66 175.690 173.881 1.809 1 1 521 . 14 1 1 A 66 66 TYR CA C 66 54.390 56.319 -1.929 1 1 522 . 14 1 1 A 66 66 TYR CB C 66 41.560 40.003 1.557 1 1 523 . 14 1 1 A 66 66 TYR N N 66 124.350 126.793 -2.443 1 1 524 . 14 1 1 A 67 67 ASP H H 67 9.070 8.918 0.152 1 1 525 . 14 1 1 A 67 67 ASP HA H 67 5.630 5.599 0.031 1 1 528 . 14 1 1 A 67 67 ASP C C 67 174.300 175.215 -0.915 1 1 529 . 14 1 1 A 67 67 ASP CA C 67 51.590 52.446 -0.856 1 1 530 . 14 1 1 A 67 67 ASP CB C 67 44.380 42.786 1.594 1 1 531 . 14 1 1 A 67 67 ASP N N 67 130.490 125.976 4.514 1 1 532 . 14 1 1 A 68 68 PHE H H 68 8.670 8.458 0.212 1 1 533 . 14 1 1 A 68 68 PHE HA H 68 4.890 5.341 -0.451 1 1 538 . 14 1 1 A 68 68 PHE C C 68 172.220 173.213 -0.993 1 1 539 . 14 1 1 A 68 68 PHE CA C 68 57.360 55.335 2.025 1 1 540 . 14 1 1 A 68 68 PHE CB C 68 40.360 41.812 -1.452 1 1 541 . 14 1 1 A 68 68 PHE N N 68 118.200 117.456 0.744 1 1 542 . 14 1 1 A 69 69 THR H H 69 8.390 8.400 -0.010 1 1 543 . 14 1 1 A 69 69 THR HA H 69 5.170 4.971 0.199 1 1 548 . 14 1 1 A 69 69 THR C C 69 172.620 174.586 -1.966 1 1 549 . 14 1 1 A 69 69 THR CA C 69 61.370 61.407 -0.037 1 1 550 . 14 1 1 A 69 69 THR CB C 69 64.880 70.662 -5.782 1 1 552 . 14 1 1 A 69 69 THR N N 69 115.810 114.069 1.741 1 1 553 . 14 1 1 A 70 70 LEU H H 70 9.560 8.576 0.984 1 1 554 . 14 1 1 A 70 70 LEU HA H 70 5.270 4.695 0.575 1 1 564 . 14 1 1 A 70 70 LEU C C 70 173.800 175.957 -2.157 1 1 565 . 14 1 1 A 70 70 LEU CA C 70 53.460 54.212 -0.752 1 1 566 . 14 1 1 A 70 70 LEU CB C 70 45.040 43.151 1.889 1 1 570 . 14 1 1 A 70 70 LEU N N 70 129.220 124.635 4.585 1 1 571 . 14 1 1 A 71 71 ASN H H 71 9.590 8.228 1.362 1 1 572 . 14 1 1 A 71 71 ASN HA H 71 5.880 5.562 0.318 1 1 577 . 14 1 1 A 71 71 ASN C C 71 177.970 174.545 3.425 1 1 578 . 14 1 1 A 71 71 ASN CA C 71 52.060 52.227 -0.167 1 1 579 . 14 1 1 A 71 71 ASN CB C 71 41.020 39.942 1.078 1 1 580 . 14 1 1 A 71 71 ASN N N 71 125.970 118.302 7.668 1 1 582 . 14 1 1 A 72 72 TYR H H 72 8.740 9.347 -0.607 1 1 583 . 14 1 1 A 72 72 TYR HA H 72 5.110 5.370 -0.260 1 1 588 . 14 1 1 A 72 72 TYR C C 72 177.720 172.738 4.982 1 1 589 . 14 1 1 A 72 72 TYR CA C 72 55.310 55.335 -0.025 1 1 590 . 14 1 1 A 72 72 TYR CB C 72 41.510 41.223 0.287 1 1 591 . 14 1 1 A 72 72 TYR N N 72 119.640 121.780 -2.140 1 1 592 . 14 1 1 A 73 73 ASP H H 73 9.780 9.056 0.724 1 1 593 . 14 1 1 A 73 73 ASP HA H 73 4.680 4.955 -0.275 1 1 596 . 14 1 1 A 73 73 ASP C C 73 177.290 176.331 0.959 1 1 597 . 14 1 1 A 73 73 ASP CA C 73 53.650 52.768 0.882 1 1 598 . 14 1 1 A 73 73 ASP CB C 73 40.900 42.518 -1.618 1 1 599 . 14 1 1 A 73 73 ASP N N 73 119.290 121.213 -1.923 1 1 600 . 14 1 1 A 74 74 GLU H H 74 9.430 8.921 0.509 1 1 601 . 14 1 1 A 74 74 GLU HA H 74 4.740 4.258 0.482 1 1 606 . 14 1 1 A 74 74 GLU C C 74 176.320 178.149 -1.829 1 1 607 . 14 1 1 A 74 74 GLU CA C 74 57.410 59.282 -1.872 1 1 608 . 14 1 1 A 74 74 GLU CB C 74 29.490 29.325 0.165 1 1 610 . 14 1 1 A 74 74 GLU N N 74 130.930 126.722 4.208 1 1 611 . 14 1 1 A 75 75 ASN H H 75 8.680 8.226 0.454 1 1 612 . 14 1 1 A 75 75 ASN HA H 75 4.600 4.450 0.150 1 1 617 . 14 1 1 A 75 75 ASN C C 75 175.340 176.950 -1.610 1 1 618 . 14 1 1 A 75 75 ASN CA C 75 54.620 56.297 -1.677 1 1 619 . 14 1 1 A 75 75 ASN CB C 75 38.770 38.354 0.416 1 1 620 . 14 1 1 A 75 75 ASN N N 75 115.040 118.316 -3.276 1 1 622 . 14 1 1 A 76 76 ALA H H 76 7.740 7.416 0.324 1 1 623 . 14 1 1 A 76 76 ALA HA H 76 4.310 4.340 -0.030 1 1 627 . 14 1 1 A 76 76 ALA C C 76 175.550 176.786 -1.236 1 1 628 . 14 1 1 A 76 76 ALA CA C 76 53.260 54.035 -0.775 1 1 629 . 14 1 1 A 76 76 ALA CB C 76 21.450 19.889 1.561 1 1 630 . 14 1 1 A 76 76 ALA N N 76 122.200 119.799 2.401 1 1 631 . 14 1 1 A 77 77 PHE H H 77 8.070 8.156 -0.086 1 1 632 . 14 1 1 A 77 77 PHE HA H 77 5.650 4.928 0.722 1 1 637 . 14 1 1 A 77 77 PHE C C 77 174.570 175.338 -0.768 1 1 638 . 14 1 1 A 77 77 PHE CA C 77 56.360 57.669 -1.309 1 1 639 . 14 1 1 A 77 77 PHE CB C 77 46.080 41.130 4.950 1 1 640 . 14 1 1 A 77 77 PHE N N 77 114.160 113.398 0.762 1 1 641 . 14 1 1 A 78 78 GLU H H 78 8.800 8.733 0.067 1 1 642 . 14 1 1 A 78 78 GLU HA H 78 4.900 5.071 -0.171 1 1 647 . 14 1 1 A 78 78 GLU C C 78 175.950 175.067 0.883 1 1 648 . 14 1 1 A 78 78 GLU CA C 78 53.670 55.610 -1.940 1 1 649 . 14 1 1 A 78 78 GLU CB C 78 33.600 33.240 0.360 1 1 651 . 14 1 1 A 78 78 GLU N N 78 117.590 120.836 -3.246 1 1 652 . 14 1 1 A 79 79 TYR H H 79 8.770 8.926 -0.156 1 1 653 . 14 1 1 A 79 79 TYR HA H 79 4.250 4.194 0.056 1 1 658 . 14 1 1 A 79 79 TYR C C 79 174.580 175.008 -0.428 1 1 659 . 14 1 1 A 79 79 TYR CA C 79 59.250 59.629 -0.379 1 1 660 . 14 1 1 A 79 79 TYR CB C 79 38.310 39.140 -0.830 1 1 661 . 14 1 1 A 79 79 TYR N N 79 126.560 129.721 -3.161 1 1 662 . 14 1 1 A 80 80 VAL H H 80 8.220 8.834 -0.614 1 1 663 . 14 1 1 A 80 80 VAL HA H 80 3.690 3.843 -0.153 1 1 671 . 14 1 1 A 80 80 VAL C C 80 174.780 175.101 -0.321 1 1 672 . 14 1 1 A 80 80 VAL CA C 80 64.400 63.196 1.204 1 1 673 . 14 1 1 A 80 80 VAL CB C 80 33.510 32.558 0.952 1 1 676 . 14 1 1 A 80 80 VAL N N 80 129.460 126.318 3.142 1 1 677 . 14 1 1 A 81 81 GLU H H 81 6.920 7.557 -0.637 1 1 678 . 14 1 1 A 81 81 GLU HA H 81 4.260 4.585 -0.325 1 1 683 . 14 1 1 A 81 81 GLU C C 81 171.840 175.244 -3.404 1 1 684 . 14 1 1 A 81 81 GLU CA C 81 55.310 55.127 0.183 1 1 685 . 14 1 1 A 81 81 GLU CB C 81 30.520 33.355 -2.835 1 1 687 . 14 1 1 A 81 81 GLU N N 81 112.430 117.296 -4.866 1 1 688 . 14 1 1 A 82 82 ALA H H 82 8.310 8.561 -0.251 1 1 689 . 14 1 1 A 82 82 ALA HA H 82 5.650 4.993 0.657 1 1 693 . 14 1 1 A 82 82 ALA C C 82 176.110 176.941 -0.831 1 1 694 . 14 1 1 A 82 82 ALA CA C 82 50.620 51.715 -1.095 1 1 695 . 14 1 1 A 82 82 ALA CB C 82 21.770 19.793 1.977 1 1 696 . 14 1 1 A 82 82 ALA N N 82 121.240 125.261 -4.021 1 1 697 . 14 1 1 A 83 83 ILE H H 83 9.150 8.897 0.253 1 1 698 . 14 1 1 A 83 83 ILE HA H 83 4.600 4.755 -0.155 1 1 708 . 14 1 1 A 83 83 ILE C C 83 174.810 175.118 -0.308 1 1 709 . 14 1 1 A 83 83 ILE CA C 83 60.060 59.309 0.751 1 1 710 . 14 1 1 A 83 83 ILE CB C 83 42.440 41.292 1.148 1 1 714 . 14 1 1 A 83 83 ILE N N 83 119.720 120.428 -0.708 1 1 715 . 14 1 1 A 84 84 SER H H 84 8.350 9.072 -0.722 1 1 716 . 14 1 1 A 84 84 SER HA H 84 4.660 4.823 -0.163 1 1 719 . 14 1 1 A 84 84 SER C C 84 177.550 172.227 5.323 1 1 720 . 14 1 1 A 84 84 SER CA C 84 57.330 55.647 1.683 1 1 721 . 14 1 1 A 84 84 SER CB C 84 66.490 65.266 1.224 1 1 722 . 14 1 1 A 84 84 SER N N 84 116.740 120.107 -3.367 1 1 723 . 14 1 1 A 85 85 ASP H H 85 8.740 8.721 0.019 1 1 724 . 14 1 1 A 85 85 ASP HA H 85 4.820 4.817 0.003 1 1 727 . 14 1 1 A 85 85 ASP C C 85 176.090 175.953 0.137 1 1 728 . 14 1 1 A 85 85 ASP CA C 85 53.480 52.114 1.366 1 1 729 . 14 1 1 A 85 85 ASP CB C 85 42.480 43.397 -0.917 1 1 730 . 14 1 1 A 85 85 ASP N N 85 120.960 121.825 -0.865 1 1 731 . 14 1 1 A 86 86 ASP H H 86 8.380 8.638 -0.258 1 1 732 . 14 1 1 A 86 86 ASP HA H 86 4.450 4.873 -0.423 1 1 735 . 14 1 1 A 86 86 ASP C C 86 177.100 176.609 0.491 1 1 736 . 14 1 1 A 86 86 ASP CA C 86 56.240 54.147 2.093 1 1 737 . 14 1 1 A 86 86 ASP CB C 86 41.100 41.342 -0.242 1 1 738 . 14 1 1 A 86 86 ASP N N 86 117.710 120.689 -2.979 1 1 739 . 14 1 1 A 87 87 GLY H H 87 8.690 7.584 1.106 1 1 740 . 14 1 1 A 87 87 GLY HA2 H 87 3.870 4.057 -0.187 1 1 741 . 14 1 1 A 87 87 GLY HA3 H 87 4.090 4.066 0.024 1 1 742 . 14 1 1 A 87 87 GLY C C 87 173.800 174.468 -0.668 1 1 743 . 14 1 1 A 87 87 GLY CA C 87 45.770 45.585 0.185 1 1 744 . 14 1 1 A 87 87 GLY N N 87 108.540 106.502 2.038 1 1 745 . 14 1 1 A 88 88 VAL H H 88 7.910 7.748 0.162 1 1 746 . 14 1 1 A 88 88 VAL HA H 88 4.780 4.304 0.476 1 1 754 . 14 1 1 A 88 88 VAL C C 88 173.970 175.324 -1.354 1 1 755 . 14 1 1 A 88 88 VAL CA C 88 60.900 62.152 -1.252 1 1 756 . 14 1 1 A 88 88 VAL CB C 88 35.460 33.117 2.343 1 1 759 . 14 1 1 A 88 88 VAL N N 88 119.790 120.505 -0.715 1 1 760 . 14 1 1 A 89 89 PHE H H 89 9.210 9.650 -0.440 1 1 761 . 14 1 1 A 89 89 PHE HA H 89 4.930 5.324 -0.394 1 1 766 . 14 1 1 A 89 89 PHE C C 89 173.970 173.842 0.128 1 1 767 . 14 1 1 A 89 89 PHE CA C 89 56.450 55.895 0.555 1 1 768 . 14 1 1 A 89 89 PHE CB C 89 41.120 42.680 -1.560 1 1 769 . 14 1 1 A 89 89 PHE N N 89 126.780 126.152 0.628 1 1 770 . 14 1 1 A 90 90 VAL H H 90 7.880 8.208 -0.328 1 1 771 . 14 1 1 A 90 90 VAL HA H 90 4.860 4.650 0.210 1 1 779 . 14 1 1 A 90 90 VAL C C 90 173.190 173.901 -0.711 1 1 780 . 14 1 1 A 90 90 VAL CA C 90 59.750 61.185 -1.435 1 1 781 . 14 1 1 A 90 90 VAL CB C 90 34.770 33.873 0.897 1 1 784 . 14 1 1 A 90 90 VAL N N 90 124.990 126.220 -1.230 1 1 785 . 14 1 1 A 91 91 ASN H H 91 8.670 9.598 -0.928 1 1 786 . 14 1 1 A 91 91 ASN HA H 91 4.730 5.308 -0.578 1 1 791 . 14 1 1 A 91 91 ASN C C 91 173.200 174.706 -1.506 1 1 792 . 14 1 1 A 91 91 ASN CA C 91 51.970 51.460 0.510 1 1 793 . 14 1 1 A 91 91 ASN CB C 91 41.340 41.407 -0.067 1 1 794 . 14 1 1 A 91 91 ASN N N 91 124.860 127.993 -3.133 1 1 796 . 14 1 1 A 92 92 ALA H H 92 8.840 8.872 -0.032 1 1 797 . 14 1 1 A 92 92 ALA HA H 92 5.290 4.633 0.657 1 1 801 . 14 1 1 A 92 92 ALA C C 92 176.330 176.492 -0.162 1 1 802 . 14 1 1 A 92 92 ALA CA C 92 50.170 51.196 -1.026 1 1 803 . 14 1 1 A 92 92 ALA CB C 92 23.610 21.175 2.435 1 1 804 . 14 1 1 A 92 92 ALA N N 92 128.510 129.265 -0.755 1 1 805 . 14 1 1 A 93 93 LYS H H 93 8.670 8.756 -0.086 1 1 806 . 14 1 1 A 93 93 LYS HA H 93 4.460 4.709 -0.249 1 1 815 . 14 1 1 A 93 93 LYS C C 93 174.170 174.854 -0.684 1 1 816 . 14 1 1 A 93 93 LYS CA C 93 55.010 55.732 -0.722 1 1 817 . 14 1 1 A 93 93 LYS CB C 93 36.430 35.058 1.372 1 1 821 . 14 1 1 A 93 93 LYS N N 93 121.300 117.442 3.858 1 1 822 . 14 1 1 A 94 94 LYS H H 94 8.960 8.926 0.034 1 1 823 . 14 1 1 A 94 94 LYS HA H 94 4.460 4.273 0.187 1 1 832 . 14 1 1 A 94 94 LYS C C 94 176.330 176.676 -0.346 1 1 833 . 14 1 1 A 94 94 LYS CA C 94 56.720 57.022 -0.302 1 1 834 . 14 1 1 A 94 94 LYS CB C 94 31.930 32.750 -0.820 1 1 837 . 14 1 1 A 94 94 LYS N N 94 127.060 127.531 -0.471 1 1 838 . 14 1 1 A 95 95 ILE H H 95 8.290 8.938 -0.648 1 1 839 . 14 1 1 A 95 95 ILE HA H 95 4.120 4.322 -0.202 1 1 849 . 14 1 1 A 95 95 ILE C C 95 175.740 174.792 0.948 1 1 850 . 14 1 1 A 95 95 ILE CA C 95 62.760 62.297 0.463 1 1 851 . 14 1 1 A 95 95 ILE CB C 95 38.890 39.976 -1.086 1 1 855 . 14 1 1 A 95 95 ILE N N 95 126.530 129.155 -2.625 1 1 856 . 14 1 1 A 96 96 GLU H H 96 8.030 7.394 0.636 1 1 857 . 14 1 1 A 96 96 GLU HA H 96 4.450 4.766 -0.316 1 1 862 . 14 1 1 A 96 96 GLU C C 96 174.380 175.328 -0.948 1 1 863 . 14 1 1 A 96 96 GLU CA C 96 54.320 54.814 -0.494 1 1 864 . 14 1 1 A 96 96 GLU CB C 96 32.770 34.004 -1.234 1 1 866 . 14 1 1 A 96 96 GLU N N 96 117.080 119.036 -1.956 1 1 867 . 14 1 1 A 97 97 ASP H H 97 8.730 8.777 -0.047 1 1 868 . 14 1 1 A 97 97 ASP HA H 97 4.360 4.281 0.079 1 1 871 . 14 1 1 A 97 97 ASP C C 97 177.100 177.140 -0.040 1 1 872 . 14 1 1 A 97 97 ASP CA C 97 57.160 55.878 1.282 1 1 873 . 14 1 1 A 97 97 ASP CB C 97 39.920 40.319 -0.399 1 1 874 . 14 1 1 A 97 97 ASP N N 97 120.570 121.473 -0.903 1 1 875 . 14 1 1 A 98 98 GLY H H 98 8.760 8.538 0.222 1 1 876 . 14 1 1 A 98 98 GLY HA2 H 98 2.120 1.571 0.549 1 1 877 . 14 1 1 A 98 98 GLY HA3 H 98 3.910 3.346 0.564 1 1 878 . 14 1 1 A 98 98 GLY C C 98 174.000 172.858 1.142 1 1 879 . 14 1 1 A 98 98 GLY CA C 98 45.720 45.120 0.600 1 1 880 . 14 1 1 A 98 98 GLY N N 98 112.090 111.213 0.877 1 1 881 . 14 1 1 A 99 99 LYS H H 99 7.890 6.830 1.060 1 1 882 . 14 1 1 A 99 99 LYS HA H 99 5.330 5.156 0.174 1 1 891 . 14 1 1 A 99 99 LYS C C 99 174.750 174.381 0.369 1 1 892 . 14 1 1 A 99 99 LYS CA C 99 55.990 54.878 1.112 1 1 893 . 14 1 1 A 99 99 LYS CB C 99 37.840 35.501 2.339 1 1 897 . 14 1 1 A 99 99 LYS N N 99 118.050 114.906 3.144 1 1 898 . 14 1 1 A 100 100 VAL H H 100 8.980 8.300 0.680 1 1 899 . 14 1 1 A 100 100 VAL HA H 100 4.510 4.725 -0.215 1 1 907 . 14 1 1 A 100 100 VAL C C 100 174.760 173.787 0.973 1 1 908 . 14 1 1 A 100 100 VAL CA C 100 60.130 59.016 1.114 1 1 909 . 14 1 1 A 100 100 VAL CB C 100 35.240 35.734 -0.494 1 1 912 . 14 1 1 A 100 100 VAL N N 100 123.850 119.535 4.315 1 1 913 . 14 1 1 A 101 101 ARG H H 101 8.810 8.079 0.731 1 1 914 . 14 1 1 A 101 101 ARG HA H 101 4.850 4.529 0.321 1 1 921 . 14 1 1 A 101 101 ARG C C 101 174.770 174.297 0.473 1 1 922 . 14 1 1 A 101 101 ARG CA C 101 54.580 55.085 -0.505 1 1 923 . 14 1 1 A 101 101 ARG CB C 101 32.400 31.257 1.143 1 1 926 . 14 1 1 A 101 101 ARG N N 101 129.210 123.921 5.289 1 1 927 . 14 1 1 A 102 102 VAL H H 102 9.100 8.366 0.734 1 1 928 . 14 1 1 A 102 102 VAL HA H 102 4.120 4.339 -0.219 1 1 936 . 14 1 1 A 102 102 VAL C C 102 171.640 173.802 -2.162 1 1 937 . 14 1 1 A 102 102 VAL CA C 102 61.350 60.486 0.864 1 1 938 . 14 1 1 A 102 102 VAL CB C 102 32.530 32.745 -0.215 1 1 941 . 14 1 1 A 102 102 VAL N N 102 130.470 123.685 6.785 1 1 942 . 14 1 1 A 103 103 LEU H H 103 8.110 9.110 -1.000 1 1 943 . 14 1 1 A 103 103 LEU HA H 103 5.120 4.553 0.567 1 1 953 . 14 1 1 A 103 103 LEU C C 103 176.410 176.357 0.053 1 1 954 . 14 1 1 A 103 103 LEU CA C 103 53.380 54.073 -0.693 1 1 955 . 14 1 1 A 103 103 LEU CB C 103 43.680 41.148 2.532 1 1 959 . 14 1 1 A 103 103 LEU N N 103 125.560 130.062 -4.502 1 1 960 . 14 1 1 A 104 104 VAL H H 104 9.580 9.031 0.549 1 1 961 . 14 1 1 A 104 104 VAL HA H 104 5.260 5.288 -0.028 1 1 969 . 14 1 1 A 104 104 VAL C C 104 176.030 175.005 1.025 1 1 970 . 14 1 1 A 104 104 VAL CA C 104 60.220 59.979 0.241 1 1 971 . 14 1 1 A 104 104 VAL CB C 104 34.310 34.270 0.040 1 1 974 . 14 1 1 A 104 104 VAL N N 104 125.790 121.059 4.731 1 1 975 . 14 1 1 A 105 105 SER H H 105 9.340 9.330 0.010 1 1 976 . 14 1 1 A 105 105 SER HA H 105 5.300 5.108 0.192 1 1 979 . 14 1 1 A 105 105 SER C C 105 173.600 173.064 0.536 1 1 980 . 14 1 1 A 105 105 SER CA C 105 57.450 57.459 -0.009 1 1 981 . 14 1 1 A 105 105 SER CB C 105 65.600 66.768 -1.168 1 1 982 . 14 1 1 A 105 105 SER N N 105 119.220 117.335 1.885 1 1 983 . 14 1 1 A 106 106 SER H H 106 8.350 9.110 -0.760 1 1 984 . 14 1 1 A 106 106 SER HA H 106 4.720 4.503 0.217 1 1 987 . 14 1 1 A 106 106 SER C C 106 176.930 174.075 2.855 1 1 988 . 14 1 1 A 106 106 SER CA C 106 58.170 58.776 -0.606 1 1 989 . 14 1 1 A 106 106 SER CB C 106 64.170 62.963 1.207 1 1 990 . 14 1 1 A 106 106 SER N N 106 114.800 119.932 -5.132 1 1 991 . 14 1 1 A 107 107 LEU H H 107 8.770 8.802 -0.032 1 1 992 . 14 1 1 A 107 107 LEU HA H 107 4.710 4.228 0.482 1 1 1001 . 14 1 1 A 107 107 LEU C C 107 178.280 179.117 -0.837 1 1 1002 . 14 1 1 A 107 107 LEU CA C 107 55.280 57.030 -1.750 1 1 1003 . 14 1 1 A 107 107 LEU CB C 107 43.410 41.549 1.861 1 1 1007 . 14 1 1 A 107 107 LEU N N 107 127.210 127.410 -0.200 1 1 1008 . 14 1 1 A 108 108 THR H H 108 8.210 7.775 0.435 1 1 1009 . 14 1 1 A 108 108 THR HA H 108 4.400 4.261 0.139 1 1 1015 . 14 1 1 A 108 108 THR C C 108 176.130 175.702 0.428 1 1 1016 . 14 1 1 A 108 108 THR CA C 108 62.050 63.182 -1.132 1 1 1017 . 14 1 1 A 108 108 THR CB C 108 70.910 70.355 0.555 1 1 1019 . 14 1 1 A 108 108 THR N N 108 108.810 111.206 -2.396 1 1 1020 . 14 1 1 A 109 109 GLY H H 109 8.250 7.640 0.610 1 1 1021 . 14 1 1 A 109 109 GLY HA2 H 109 3.780 3.995 -0.215 1 1 1022 . 14 1 1 A 109 109 GLY HA3 H 109 4.290 3.995 0.295 1 1 1023 . 14 1 1 A 109 109 GLY C C 109 173.180 174.138 -0.958 1 1 1024 . 14 1 1 A 109 109 GLY CA C 109 45.340 45.044 0.296 1 1 1025 . 14 1 1 A 109 109 GLY N N 109 110.160 110.845 -0.685 1 1 1026 . 14 1 1 A 110 110 GLU H H 110 7.960 7.499 0.461 1 1 1027 . 14 1 1 A 110 110 GLU HA H 110 4.760 4.554 0.206 1 1 1032 . 14 1 1 A 110 110 GLU CA C 110 53.450 53.460 -0.010 1 1 1033 . 14 1 1 A 110 110 GLU CB C 110 30.020 29.880 0.140 1 1 1035 . 14 1 1 A 110 110 GLU N N 110 119.720 120.790 -1.070 1 1 1036 . 14 1 1 A 111 111 PRO HA H 111 3.250 3.760 -0.510 1 1 1043 . 14 1 1 A 111 111 PRO C C 111 176.710 176.325 0.385 1 1 1044 . 14 1 1 A 111 111 PRO CA C 111 62.240 61.912 0.328 1 1 1045 . 14 1 1 A 111 111 PRO CB C 111 31.990 32.193 -0.203 1 1 1048 . 14 1 1 A 112 112 LEU H H 112 8.840 8.343 0.497 1 1 1049 . 14 1 1 A 112 112 LEU HA H 112 4.290 4.342 -0.052 1 1 1059 . 14 1 1 A 112 112 LEU CA C 112 52.220 53.374 -1.154 1 1 1060 . 14 1 1 A 112 112 LEU CB C 112 41.090 43.249 -2.159 1 1 1063 . 14 1 1 A 112 112 LEU N N 112 122.420 123.463 -1.043 1 1 1064 . 14 1 1 A 113 113 PRO HA H 113 4.380 4.295 0.085 1 1 1071 . 14 1 1 A 113 113 PRO C C 113 176.100 177.533 -1.433 1 1 1072 . 14 1 1 A 113 113 PRO CA C 113 61.930 65.173 -3.243 1 1 1073 . 14 1 1 A 113 113 PRO CB C 113 32.470 31.742 0.728 1 1 1076 . 14 1 1 A 114 114 ALA H H 114 8.070 7.856 0.214 1 1 1077 . 14 1 1 A 114 114 ALA HA H 114 4.550 4.009 0.541 1 1 1081 . 14 1 1 A 114 114 ALA C C 114 177.490 177.349 0.141 1 1 1082 . 14 1 1 A 114 114 ALA CA C 114 51.340 53.795 -2.455 1 1 1083 . 14 1 1 A 114 114 ALA CB C 114 19.940 18.155 1.785 1 1 1084 . 14 1 1 A 114 114 ALA N N 114 121.460 121.030 0.430 1 1 1085 . 14 1 1 A 115 115 LYS H H 115 9.000 8.640 0.360 1 1 1086 . 14 1 1 A 115 115 LYS HA H 115 3.930 3.870 0.060 1 1 1095 . 14 1 1 A 115 115 LYS C C 115 175.740 175.039 0.701 1 1 1096 . 14 1 1 A 115 115 LYS CA C 115 57.580 57.675 -0.095 1 1 1097 . 14 1 1 A 115 115 LYS CB C 115 29.510 30.603 -1.093 1 1 1101 . 14 1 1 A 115 115 LYS N N 115 112.560 116.562 -4.002 1 1 1102 . 14 1 1 A 116 116 GLU H H 116 7.620 7.657 -0.037 1 1 1103 . 14 1 1 A 116 116 GLU HA H 116 4.550 4.544 0.006 1 1 1108 . 14 1 1 A 116 116 GLU C C 116 176.110 174.405 1.705 1 1 1109 . 14 1 1 A 116 116 GLU CA C 116 54.570 55.537 -0.967 1 1 1110 . 14 1 1 A 116 116 GLU CB C 116 33.680 33.366 0.314 1 1 1112 . 14 1 1 A 116 116 GLU N N 116 115.710 117.702 -1.992 1 1 1113 . 14 1 1 A 117 117 VAL H H 117 8.770 8.773 -0.003 1 1 1114 . 14 1 1 A 117 117 VAL HA H 117 3.200 3.982 -0.782 1 1 1122 . 14 1 1 A 117 117 VAL C C 117 175.740 175.950 -0.210 1 1 1123 . 14 1 1 A 117 117 VAL CA C 117 65.340 63.619 1.721 1 1 1124 . 14 1 1 A 117 117 VAL CB C 117 31.290 31.039 0.251 1 1 1127 . 14 1 1 A 117 117 VAL N N 117 124.450 126.035 -1.585 1 1 1128 . 14 1 1 A 118 118 LEU H H 118 8.550 9.143 -0.593 1 1 1129 . 14 1 1 A 118 118 LEU HA H 118 4.540 4.564 -0.024 1 1 1139 . 14 1 1 A 118 118 LEU C C 118 176.210 176.433 -0.223 1 1 1140 . 14 1 1 A 118 118 LEU CA C 118 55.510 55.845 -0.335 1 1 1141 . 14 1 1 A 118 118 LEU CB C 118 44.600 43.329 1.271 1 1 1145 . 14 1 1 A 118 118 LEU N N 118 128.440 128.971 -0.531 1 1 1146 . 14 1 1 A 119 119 ALA H H 119 7.970 7.652 0.318 1 1 1147 . 14 1 1 A 119 119 ALA HA H 119 4.740 4.822 -0.082 1 1 1151 . 14 1 1 A 119 119 ALA C C 119 174.570 175.179 -0.609 1 1 1152 . 14 1 1 A 119 119 ALA CA C 119 50.770 51.715 -0.945 1 1 1153 . 14 1 1 A 119 119 ALA CB C 119 22.450 22.439 0.011 1 1 1154 . 14 1 1 A 119 119 ALA N N 119 118.100 118.248 -0.148 1 1 1155 . 14 1 1 A 120 120 LYS H H 120 8.760 8.528 0.232 1 1 1156 . 14 1 1 A 120 120 LYS HA H 120 5.240 5.371 -0.131 1 1 1165 . 14 1 1 A 120 120 LYS C C 120 175.340 174.848 0.492 1 1 1166 . 14 1 1 A 120 120 LYS CA C 120 54.220 54.802 -0.582 1 1 1167 . 14 1 1 A 120 120 LYS CB C 120 34.340 34.687 -0.347 1 1 1171 . 14 1 1 A 120 120 LYS N N 120 120.010 121.689 -1.679 1 1 1172 . 14 1 1 A 121 121 VAL H H 121 9.410 8.856 0.554 1 1 1173 . 14 1 1 A 121 121 VAL HA H 121 4.230 4.637 -0.407 1 1 1181 . 14 1 1 A 121 121 VAL C C 121 173.980 174.416 -0.436 1 1 1182 . 14 1 1 A 121 121 VAL CA C 121 62.370 61.623 0.747 1 1 1183 . 14 1 1 A 121 121 VAL CB C 121 32.410 32.543 -0.133 1 1 1186 . 14 1 1 A 121 121 VAL N N 121 124.960 126.099 -1.139 1 1 1187 . 14 1 1 A 122 122 VAL H H 122 9.280 8.407 0.873 1 1 1188 . 14 1 1 A 122 122 VAL HA H 122 4.360 4.590 -0.230 1 1 1196 . 14 1 1 A 122 122 VAL C C 122 174.190 175.401 -1.211 1 1 1197 . 14 1 1 A 122 122 VAL CA C 122 62.760 62.846 -0.086 1 1 1198 . 14 1 1 A 122 122 VAL CB C 122 32.020 31.085 0.935 1 1 1201 . 14 1 1 A 122 122 VAL N N 122 128.990 130.606 -1.616 1 1 1202 . 14 1 1 A 123 123 LEU H H 123 8.610 9.085 -0.475 1 1 1203 . 14 1 1 A 123 123 LEU HA H 123 4.900 4.928 -0.028 1 1 1213 . 14 1 1 A 123 123 LEU C C 123 174.950 175.576 -0.626 1 1 1214 . 14 1 1 A 123 123 LEU CA C 123 52.050 53.678 -1.628 1 1 1215 . 14 1 1 A 123 123 LEU CB C 123 45.210 42.149 3.061 1 1 1219 . 14 1 1 A 123 123 LEU N N 123 127.200 128.743 -1.543 1 1 1220 . 14 1 1 A 124 124 ARG H H 124 9.540 8.871 0.669 1 1 1221 . 14 1 1 A 124 124 ARG HA H 124 4.900 4.569 0.331 1 1 1229 . 14 1 1 A 124 124 ARG C C 124 176.320 175.850 0.470 1 1 1230 . 14 1 1 A 124 124 ARG CA C 124 55.320 56.697 -1.377 1 1 1231 . 14 1 1 A 124 124 ARG CB C 124 31.750 30.655 1.095 1 1 1234 . 14 1 1 A 124 124 ARG N N 124 124.290 126.345 -2.055 1 1 1236 . 14 1 1 A 125 125 ALA H H 125 8.880 8.690 0.190 1 1 1237 . 14 1 1 A 125 125 ALA HA H 125 4.380 4.226 0.154 1 1 1241 . 14 1 1 A 125 125 ALA C C 125 177.290 177.387 -0.097 1 1 1242 . 14 1 1 A 125 125 ALA CA C 125 52.530 51.462 1.068 1 1 1243 . 14 1 1 A 125 125 ALA CB C 125 19.870 17.760 2.110 1 1 1244 . 14 1 1 A 125 125 ALA N N 125 130.790 128.971 1.819 1 1 1245 . 14 1 1 A 126 126 GLU H H 126 9.260 8.791 0.469 1 1 1246 . 14 1 1 A 126 126 GLU HA H 126 4.460 4.351 0.109 1 1 1251 . 14 1 1 A 126 126 GLU C C 126 176.120 176.304 -0.184 1 1 1252 . 14 1 1 A 126 126 GLU CA C 126 56.940 57.655 -0.715 1 1 1253 . 14 1 1 A 126 126 GLU CB C 126 32.450 30.512 1.938 1 1 1255 . 14 1 1 A 126 126 GLU N N 126 125.740 123.820 1.920 1 1 1256 . 14 1 1 A 127 127 ALA H H 127 7.460 7.049 0.411 1 1 1257 . 14 1 1 A 127 127 ALA HA H 127 4.360 4.604 -0.244 1 1 1261 . 14 1 1 A 127 127 ALA C C 127 173.400 175.821 -2.421 1 1 1262 . 14 1 1 A 127 127 ALA CA C 127 51.360 51.621 -0.261 1 1 1263 . 14 1 1 A 127 127 ALA CB C 127 22.180 22.088 0.092 1 1 1264 . 14 1 1 A 127 127 ALA N N 127 120.910 119.394 1.516 1 1 1265 . 14 1 1 A 128 128 LYS H H 128 7.940 8.677 -0.737 1 1 1266 . 14 1 1 A 128 128 LYS HA H 128 3.580 4.113 -0.533 1 1 1275 . 14 1 1 A 128 128 LYS C C 128 176.080 175.810 0.270 1 1 1276 . 14 1 1 A 128 128 LYS CA C 128 56.860 56.938 -0.078 1 1 1277 . 14 1 1 A 128 128 LYS CB C 128 33.170 33.130 0.040 1 1 1281 . 14 1 1 A 128 128 LYS N N 128 116.520 124.623 -8.103 1 1 1282 . 14 1 1 A 129 129 ALA H H 129 8.590 8.589 0.001 1 1 1283 . 14 1 1 A 129 129 ALA HA H 129 4.390 4.641 -0.251 1 1 1287 . 14 1 1 A 129 129 ALA C C 129 174.970 176.542 -1.572 1 1 1288 . 14 1 1 A 129 129 ALA CA C 129 52.970 51.367 1.603 1 1 1289 . 14 1 1 A 129 129 ALA CB C 129 21.500 18.923 2.577 1 1 1290 . 14 1 1 A 129 129 ALA N N 129 124.710 127.352 -2.642 1 1 1291 . 14 1 1 A 130 130 GLU H H 130 8.660 7.816 0.844 1 1 1292 . 14 1 1 A 130 130 GLU HA H 130 4.660 4.046 0.614 1 1 1297 . 14 1 1 A 130 130 GLU C C 130 177.390 177.163 0.227 1 1 1298 . 14 1 1 A 130 130 GLU CA C 130 55.070 58.493 -3.423 1 1 1299 . 14 1 1 A 130 130 GLU CB C 130 30.860 29.299 1.561 1 1 1301 . 14 1 1 A 130 130 GLU N N 130 123.180 120.003 3.177 1 1 1302 . 14 1 1 A 131 131 GLY H H 131 9.170 8.708 0.462 1 1 1303 . 14 1 1 A 131 131 GLY HA2 H 131 3.560 4.018 -0.458 1 1 1304 . 14 1 1 A 131 131 GLY HA3 H 131 3.750 4.028 -0.278 1 1 1305 . 14 1 1 A 131 131 GLY C C 131 174.550 174.554 -0.004 1 1 1306 . 14 1 1 A 131 131 GLY CA C 131 47.660 45.384 2.276 1 1 1307 . 14 1 1 A 131 131 GLY N N 131 115.530 113.570 1.960 1 1 1308 . 14 1 1 A 132 132 SER H H 132 8.430 8.152 0.278 1 1 1309 . 14 1 1 A 132 132 SER HA H 132 4.170 4.537 -0.367 1 1 1312 . 14 1 1 A 132 132 SER C C 132 175.350 173.578 1.772 1 1 1313 . 14 1 1 A 132 132 SER CA C 132 59.050 57.238 1.812 1 1 1314 . 14 1 1 A 132 132 SER CB C 132 64.880 61.694 3.186 1 1 1315 . 14 1 1 A 132 132 SER N N 132 115.930 116.797 -0.867 1 1 1316 . 14 1 1 A 133 133 ASN H H 133 8.850 8.932 -0.082 1 1 1317 . 14 1 1 A 133 133 ASN HA H 133 4.910 4.716 0.194 1 1 1322 . 14 1 1 A 133 133 ASN C C 133 175.450 174.629 0.821 1 1 1323 . 14 1 1 A 133 133 ASN CA C 133 54.920 53.885 1.035 1 1 1324 . 14 1 1 A 133 133 ASN CB C 133 41.060 38.721 2.339 1 1 1325 . 14 1 1 A 133 133 ASN N N 133 125.590 125.478 0.112 1 1 1327 . 14 1 1 A 134 134 LEU H H 134 9.070 9.826 -0.756 1 1 1328 . 14 1 1 A 134 134 LEU HA H 134 5.230 5.301 -0.071 1 1 1338 . 14 1 1 A 134 134 LEU C C 134 175.240 176.032 -0.792 1 1 1339 . 14 1 1 A 134 134 LEU CA C 134 53.470 53.287 0.183 1 1 1340 . 14 1 1 A 134 134 LEU CB C 134 45.090 45.158 -0.068 1 1 1344 . 14 1 1 A 134 134 LEU N N 134 129.210 128.538 0.672 1 1 1345 . 14 1 1 A 135 135 SER H H 135 8.690 8.801 -0.111 1 1 1346 . 14 1 1 A 135 135 SER HA H 135 5.280 5.107 0.173 1 1 1349 . 14 1 1 A 135 135 SER C C 135 173.590 172.805 0.785 1 1 1350 . 14 1 1 A 135 135 SER CA C 135 56.220 57.294 -1.074 1 1 1351 . 14 1 1 A 135 135 SER CB C 135 66.510 65.898 0.612 1 1 1352 . 14 1 1 A 135 135 SER N N 135 113.020 115.835 -2.815 1 1 1353 . 14 1 1 A 136 136 VAL H H 136 8.940 8.874 0.066 1 1 1354 . 14 1 1 A 136 136 VAL HA H 136 5.500 4.457 1.043 1 1 1362 . 14 1 1 A 136 136 VAL C C 136 175.730 175.608 0.122 1 1 1363 . 14 1 1 A 136 136 VAL CA C 136 60.960 62.248 -1.288 1 1 1364 . 14 1 1 A 136 136 VAL CB C 136 33.630 30.893 2.737 1 1 1367 . 14 1 1 A 136 136 VAL N N 136 124.340 127.942 -3.602 1 1 1368 . 14 1 1 A 137 137 THR H H 137 9.240 8.590 0.650 1 1 1369 . 14 1 1 A 137 137 THR HA H 137 4.920 4.805 0.115 1 1 1374 . 14 1 1 A 137 137 THR C C 137 173.500 174.582 -1.082 1 1 1375 . 14 1 1 A 137 137 THR CA C 137 59.120 60.313 -1.193 1 1 1376 . 14 1 1 A 137 137 THR CB C 137 72.500 70.755 1.745 1 1 1378 . 14 1 1 A 137 137 THR N N 137 117.010 119.031 -2.021 1 1 1379 . 14 1 1 A 138 138 ASN H H 138 9.190 8.969 0.221 1 1 1380 . 14 1 1 A 138 138 ASN HA H 138 4.420 4.448 -0.028 1 1 1385 . 14 1 1 A 138 138 ASN C C 138 175.550 175.092 0.458 1 1 1386 . 14 1 1 A 138 138 ASN CA C 138 54.350 54.086 0.264 1 1 1387 . 14 1 1 A 138 138 ASN CB C 138 37.380 36.352 1.028 1 1 1388 . 14 1 1 A 138 138 ASN N N 138 115.270 120.793 -5.523 1 1 1390 . 14 1 1 A 139 139 SER H H 139 8.560 7.865 0.695 1 1 1391 . 14 1 1 A 139 139 SER HA H 139 5.800 4.505 1.295 1 1 1394 . 14 1 1 A 139 139 SER C C 139 175.750 174.371 1.379 1 1 1395 . 14 1 1 A 139 139 SER CA C 139 56.020 58.422 -2.402 1 1 1396 . 14 1 1 A 139 139 SER CB C 139 65.320 62.586 2.734 1 1 1397 . 14 1 1 A 139 139 SER N N 139 112.360 116.794 -4.434 1 1 1398 . 14 1 1 A 140 140 SER H H 140 9.900 8.492 1.408 1 1 1399 . 14 1 1 A 140 140 SER HA H 140 5.360 5.186 0.174 1 1 1402 . 14 1 1 A 140 140 SER C C 140 172.620 173.675 -1.055 1 1 1403 . 14 1 1 A 140 140 SER CA C 140 57.400 57.436 -0.036 1 1 1404 . 14 1 1 A 140 140 SER CB C 140 66.550 65.474 1.076 1 1 1405 . 14 1 1 A 140 140 SER N N 140 119.130 122.243 -3.113 1 1 1406 . 14 1 1 A 141 141 VAL H H 141 9.030 8.663 0.367 1 1 1407 . 14 1 1 A 141 141 VAL HA H 141 5.520 4.959 0.561 1 1 1415 . 14 1 1 A 141 141 VAL C C 141 174.750 174.473 0.277 1 1 1416 . 14 1 1 A 141 141 VAL CA C 141 58.310 59.907 -1.597 1 1 1417 . 14 1 1 A 141 141 VAL CB C 141 35.030 35.659 -0.629 1 1 1420 . 14 1 1 A 141 141 VAL N N 141 111.410 116.335 -4.925 1 1 1421 . 14 1 1 A 142 142 GLY H H 142 8.790 9.175 -0.385 1 1 1422 . 14 1 1 A 142 142 GLY HA2 H 142 3.600 3.887 -0.287 1 1 1423 . 14 1 1 A 142 142 GLY HA3 H 142 5.310 3.940 1.370 1 1 1424 . 14 1 1 A 142 142 GLY C C 142 174.180 173.371 0.809 1 1 1425 . 14 1 1 A 142 142 GLY CA C 142 44.110 46.998 -2.888 1 1 1426 . 14 1 1 A 142 142 GLY N N 142 109.330 111.491 -2.161 1 1 1427 . 14 1 1 A 143 143 ASP H H 143 8.840 8.436 0.404 1 1 1428 . 14 1 1 A 143 143 ASP HA H 143 5.790 5.051 0.739 1 1 1431 . 14 1 1 A 143 143 ASP C C 143 178.860 177.773 1.087 1 1 1432 . 14 1 1 A 143 143 ASP CA C 143 53.040 54.864 -1.824 1 1 1433 . 14 1 1 A 143 143 ASP CB C 143 43.660 42.556 1.104 1 1 1434 . 14 1 1 A 143 143 ASP N N 143 125.390 125.022 0.368 1 1 1435 . 14 1 1 A 144 144 GLY H H 144 9.150 8.423 0.727 1 1 1436 . 14 1 1 A 144 144 GLY HA2 H 144 3.450 3.308 0.142 1 1 1437 . 14 1 1 A 144 144 GLY HA3 H 144 3.720 3.489 0.231 1 1 1438 . 14 1 1 A 144 144 GLY C C 144 174.770 175.688 -0.918 1 1 1439 . 14 1 1 A 144 144 GLY CA C 144 46.930 46.725 0.205 1 1 1440 . 14 1 1 A 144 144 GLY N N 144 106.470 109.869 -3.399 1 1 1441 . 14 1 1 A 145 145 GLU H H 145 8.470 7.735 0.735 1 1 1442 . 14 1 1 A 145 145 GLU HA H 145 4.460 4.050 0.410 1 1 1447 . 14 1 1 A 145 145 GLU C C 145 176.520 176.255 0.265 1 1 1448 . 14 1 1 A 145 145 GLU CA C 145 55.330 58.524 -3.194 1 1 1449 . 14 1 1 A 145 145 GLU CB C 145 30.620 30.102 0.518 1 1 1451 . 14 1 1 A 145 145 GLU N N 145 119.170 120.320 -1.150 1 1 1452 . 14 1 1 A 146 146 GLY H H 146 7.950 7.820 0.130 1 1 1453 . 14 1 1 A 146 146 GLY HA2 H 146 3.630 3.950 -0.320 1 1 1454 . 14 1 1 A 146 146 GLY HA3 H 146 4.130 3.973 0.157 1 1 1455 . 14 1 1 A 146 146 GLY C C 146 174.350 173.923 0.427 1 1 1456 . 14 1 1 A 146 146 GLY CA C 146 45.330 45.057 0.273 1 1 1457 . 14 1 1 A 146 146 GLY N N 146 108.130 106.794 1.336 1 1 1458 . 14 1 1 A 147 147 LEU H H 147 8.440 7.576 0.864 1 1 1459 . 14 1 1 A 147 147 LEU HA H 147 4.340 4.847 -0.507 1 1 1469 . 14 1 1 A 147 147 LEU C C 147 175.950 175.407 0.543 1 1 1470 . 14 1 1 A 147 147 LEU CA C 147 54.860 52.812 2.048 1 1 1471 . 14 1 1 A 147 147 LEU CB C 147 41.590 44.481 -2.891 1 1 1475 . 14 1 1 A 147 147 LEU N N 147 124.000 116.601 7.399 1 1 1476 . 14 1 1 A 148 148 VAL H H 148 7.780 8.638 -0.858 1 1 1477 . 14 1 1 A 148 148 VAL HA H 148 4.830 4.678 0.152 1 1 1485 . 14 1 1 A 148 148 VAL C C 148 175.740 174.349 1.391 1 1 1486 . 14 1 1 A 148 148 VAL CA C 148 61.140 62.074 -0.934 1 1 1487 . 14 1 1 A 148 148 VAL CB C 148 33.640 32.089 1.551 1 1 1490 . 14 1 1 A 148 148 VAL N N 148 120.440 123.433 -2.993 1 1 1491 . 14 1 1 A 149 149 HIS H H 149 9.170 8.594 0.576 1 1 1492 . 14 1 1 A 149 149 HIS HA H 149 4.950 4.866 0.084 1 1 1496 . 14 1 1 A 149 149 HIS C C 149 174.780 174.777 0.003 1 1 1497 . 14 1 1 A 149 149 HIS CA C 149 53.900 55.242 -1.342 1 1 1498 . 14 1 1 A 149 149 HIS CB C 149 32.200 28.544 3.656 1 1 1499 . 14 1 1 A 149 149 HIS N N 149 124.700 128.957 -4.257 1 1 1500 . 14 1 1 A 150 150 GLU H H 150 9.060 8.516 0.544 1 1 1501 . 14 1 1 A 150 150 GLU HA H 150 4.420 4.253 0.167 1 1 1506 . 14 1 1 A 150 150 GLU C C 150 176.520 176.808 -0.288 1 1 1507 . 14 1 1 A 150 150 GLU CA C 150 57.630 57.167 0.463 1 1 1508 . 14 1 1 A 150 150 GLU CB C 150 30.370 29.879 0.491 1 1 1510 . 14 1 1 A 150 150 GLU N N 150 125.540 123.996 1.544 1 1 1511 . 14 1 1 A 151 151 ILE H H 151 8.150 8.160 -0.010 1 1 1512 . 14 1 1 A 151 151 ILE HA H 151 4.780 4.434 0.346 1 1 1522 . 14 1 1 A 151 151 ILE C C 151 174.570 176.219 -1.649 1 1 1523 . 14 1 1 A 151 151 ILE CA C 151 59.390 59.712 -0.322 1 1 1524 . 14 1 1 A 151 151 ILE CB C 151 42.040 39.976 2.064 1 1 1528 . 14 1 1 A 151 151 ILE N N 151 115.880 122.359 -6.479 1 1 1529 . 14 1 1 A 152 152 ALA H H 152 8.010 8.933 -0.923 1 1 1530 . 14 1 1 A 152 152 ALA HA H 152 4.310 4.333 -0.023 1 1 1534 . 14 1 1 A 152 152 ALA C C 152 177.500 176.881 0.619 1 1 1535 . 14 1 1 A 152 152 ALA CA C 152 53.680 51.818 1.862 1 1 1536 . 14 1 1 A 152 152 ALA CB C 152 20.050 19.706 0.344 1 1 1537 . 14 1 1 A 152 152 ALA N N 152 126.640 124.730 1.910 1 1 1538 . 14 1 1 A 153 153 GLY H H 153 8.340 8.298 0.042 1 1 1539 . 14 1 1 A 153 153 GLY HA2 H 153 4.050 4.353 -0.303 1 1 1540 . 14 1 1 A 153 153 GLY HA3 H 153 4.140 4.358 -0.218 1 1 1541 . 14 1 1 A 153 153 GLY C C 153 173.140 171.696 1.444 1 1 1542 . 14 1 1 A 153 153 GLY CA C 153 44.130 46.229 -2.099 1 1 1543 . 14 1 1 A 153 153 GLY N N 153 107.490 105.193 2.297 1 1 1544 . 14 1 1 A 154 154 THR H H 154 7.380 8.294 -0.914 1 1 1545 . 14 1 1 A 154 154 THR HA H 154 4.700 4.811 -0.111 1 1 1550 . 14 1 1 A 154 154 THR C C 154 171.120 171.724 -0.604 1 1 1551 . 14 1 1 A 154 154 THR CA C 154 60.830 60.482 0.348 1 1 1552 . 14 1 1 A 154 154 THR CB C 154 68.850 69.928 -1.078 1 1 1554 . 14 1 1 A 154 154 THR N N 154 109.340 111.869 -2.529 1 1 1555 . 14 1 1 A 155 155 GLU H H 155 8.020 8.499 -0.479 1 1 1556 . 14 1 1 A 155 155 GLU HA H 155 5.370 5.139 0.231 1 1 1561 . 14 1 1 A 155 155 GLU C C 155 174.240 174.613 -0.373 1 1 1562 . 14 1 1 A 155 155 GLU CA C 155 54.830 55.126 -0.296 1 1 1563 . 14 1 1 A 155 155 GLU CB C 155 33.620 33.629 -0.009 1 1 1565 . 14 1 1 A 155 155 GLU N N 155 118.690 125.139 -6.449 1 1 1566 . 14 1 1 A 156 156 LYS H H 156 9.230 8.759 0.471 1 1 1567 . 14 1 1 A 156 156 LYS HA H 156 4.650 4.828 -0.178 1 1 1576 . 14 1 1 A 156 156 LYS C C 156 174.000 174.474 -0.474 1 1 1577 . 14 1 1 A 156 156 LYS CA C 156 55.840 55.628 0.212 1 1 1578 . 14 1 1 A 156 156 LYS CB C 156 37.550 36.838 0.712 1 1 1582 . 14 1 1 A 156 156 LYS N N 156 121.940 125.624 -3.684 1 1 1583 . 14 1 1 A 157 157 THR H H 157 8.160 8.782 -0.622 1 1 1584 . 14 1 1 A 157 157 THR HA H 157 5.440 5.219 0.221 1 1 1589 . 14 1 1 A 157 157 THR C C 157 174.360 173.485 0.875 1 1 1590 . 14 1 1 A 157 157 THR CA C 157 60.410 59.985 0.425 1 1 1591 . 14 1 1 A 157 157 THR CB C 157 71.500 71.639 -0.139 1 1 1593 . 14 1 1 A 157 157 THR N N 157 113.240 112.733 0.507 1 1 1594 . 14 1 1 A 158 158 VAL H H 158 9.120 9.151 -0.031 1 1 1595 . 14 1 1 A 158 158 VAL HA H 158 4.580 4.794 -0.214 1 1 1603 . 14 1 1 A 158 158 VAL C C 158 172.800 174.618 -1.818 1 1 1604 . 14 1 1 A 158 158 VAL CA C 158 59.980 60.725 -0.745 1 1 1605 . 14 1 1 A 158 158 VAL CB C 158 36.290 34.646 1.644 1 1 1608 . 14 1 1 A 158 158 VAL N N 158 121.710 123.442 -1.732 1 1 1609 . 14 1 1 A 159 159 ASN H H 159 8.240 8.771 -0.531 1 1 1610 . 14 1 1 A 159 159 ASN HA H 159 5.420 5.265 0.155 1 1 1615 . 14 1 1 A 159 159 ASN C C 159 173.800 174.217 -0.417 1 1 1616 . 14 1 1 A 159 159 ASN CA C 159 51.740 52.260 -0.520 1 1 1617 . 14 1 1 A 159 159 ASN CB C 159 40.380 40.162 0.218 1 1 1618 . 14 1 1 A 159 159 ASN N N 159 122.730 124.480 -1.750 1 1 1620 . 14 1 1 A 160 160 ILE H H 160 9.160 8.848 0.312 1 1 1621 . 14 1 1 A 160 160 ILE HA H 160 5.130 5.478 -0.348 1 1 1631 . 14 1 1 A 160 160 ILE C C 160 177.320 175.651 1.669 1 1 1632 . 14 1 1 A 160 160 ILE CA C 160 60.640 60.604 0.036 1 1 1633 . 14 1 1 A 160 160 ILE CB C 160 38.520 38.055 0.465 1 1 1637 . 14 1 1 A 160 160 ILE N N 160 123.690 125.700 -2.010 1 1 1638 . 14 1 1 A 161 161 ILE H H 161 8.780 9.788 -1.008 1 1 1639 . 14 1 1 A 161 161 ILE HA H 161 4.590 4.602 -0.012 1 1 1649 . 14 1 1 A 161 161 ILE C C 161 174.960 175.734 -0.774 1 1 1650 . 14 1 1 A 161 161 ILE CA C 161 59.320 60.239 -0.919 1 1 1651 . 14 1 1 A 161 161 ILE CB C 161 41.030 40.363 0.667 1 1 1655 . 14 1 1 A 161 161 ILE N N 161 122.490 129.135 -6.645 1 1 1656 . 14 1 1 A 162 162 GLU H H 162 8.620 8.524 0.096 1 1 1657 . 14 1 1 A 162 162 GLU HA H 162 4.290 4.331 -0.041 1 1 1662 . 14 1 1 A 162 162 GLU C C 162 176.660 176.783 -0.123 1 1 1663 . 14 1 1 A 162 162 GLU CA C 162 56.470 57.261 -0.791 1 1 1664 . 14 1 1 A 162 162 GLU CB C 162 31.150 30.108 1.042 1 1 1666 . 14 1 1 A 162 162 GLU N N 162 120.520 126.840 -6.320 1 1 1667 . 14 1 1 A 163 163 GLY H H 163 8.480 8.552 -0.072 1 1 1668 . 14 1 1 A 163 163 GLY HA2 H 163 3.910 4.399 -0.489 1 1 1669 . 14 1 1 A 163 163 GLY HA3 H 163 4.150 4.399 -0.249 1 1 1670 . 14 1 1 A 163 163 GLY C C 163 174.000 172.932 1.068 1 1 1671 . 14 1 1 A 163 163 GLY CA C 163 45.270 44.274 0.996 1 1 1672 . 14 1 1 A 163 163 GLY N N 163 110.210 108.860 1.350 1 1 1673 . 14 1 1 A 164 164 THR H H 164 8.170 8.998 -0.828 1 1 1674 . 14 1 1 A 164 164 THR HA H 164 4.410 4.795 -0.385 1 1 1679 . 14 1 1 A 164 164 THR C C 164 174.100 174.914 -0.814 1 1 1680 . 14 1 1 A 164 164 THR CA C 164 61.620 61.250 0.370 1 1 1681 . 14 1 1 A 164 164 THR CB C 164 70.060 70.535 -0.475 1 1 1683 . 14 1 1 A 164 164 THR N N 164 113.480 115.722 -2.242 1 1 1 . 15 1 1 A 13 13 GLY H H 13 8.350 8.603 -0.253 1 1 2 . 15 1 1 A 13 13 GLY HA2 H 13 3.920 3.889 0.031 1 1 3 . 15 1 1 A 13 13 GLY HA3 H 13 3.920 3.891 0.029 1 1 4 . 15 1 1 A 13 13 GLY CA C 13 45.290 47.056 -1.766 1 1 5 . 15 1 1 A 13 13 GLY N N 13 110.450 113.686 -3.236 1 1 6 . 15 1 1 A 14 14 LEU H H 14 8.050 8.209 -0.159 1 1 7 . 15 1 1 A 14 14 LEU N N 14 121.500 122.984 -1.484 1 1 8 . 15 1 1 A 15 15 VAL H H 15 8.070 8.471 -0.401 1 1 9 . 15 1 1 A 15 15 VAL N N 15 122.390 120.125 2.265 1 1 10 . 15 1 1 A 16 16 PRO HA H 16 4.360 4.448 -0.088 1 1 17 . 15 1 1 A 16 16 PRO CA C 16 62.770 63.354 -0.584 1 1 18 . 15 1 1 A 16 16 PRO CB C 16 32.020 32.220 -0.200 1 1 21 . 15 1 1 A 21 21 MET H H 21 8.180 8.110 0.070 1 1 22 . 15 1 1 A 21 21 MET N N 21 121.310 116.372 4.938 1 1 23 . 15 1 1 A 22 22 ALA H H 22 8.290 8.769 -0.479 1 1 24 . 15 1 1 A 22 22 ALA N N 22 124.800 121.989 2.811 1 1 25 . 15 1 1 A 23 23 SER H H 23 8.210 8.687 -0.477 1 1 26 . 15 1 1 A 23 23 SER N N 23 114.830 116.429 -1.599 1 1 27 . 15 1 1 A 24 24 LYS H H 24 8.250 8.049 0.201 1 1 28 . 15 1 1 A 24 24 LYS N N 24 122.980 117.751 5.229 1 1 29 . 15 1 1 A 25 25 LEU H H 25 8.140 7.905 0.235 1 1 30 . 15 1 1 A 25 25 LEU HA H 25 4.290 4.595 -0.305 1 1 40 . 15 1 1 A 25 25 LEU C C 25 177.410 176.247 1.163 1 1 41 . 15 1 1 A 25 25 LEU CA C 25 55.430 56.508 -1.078 1 1 42 . 15 1 1 A 25 25 LEU CB C 25 42.350 44.141 -1.791 1 1 46 . 15 1 1 A 25 25 LEU N N 25 122.580 118.952 3.628 1 1 47 . 15 1 1 A 26 26 LYS H H 26 8.200 8.080 0.120 1 1 48 . 15 1 1 A 26 26 LYS HA H 26 4.260 4.418 -0.158 1 1 57 . 15 1 1 A 26 26 LYS C C 26 176.520 174.871 1.649 1 1 58 . 15 1 1 A 26 26 LYS CA C 26 56.700 56.739 -0.039 1 1 59 . 15 1 1 A 26 26 LYS CB C 26 33.060 31.967 1.093 1 1 63 . 15 1 1 A 26 26 LYS N N 26 121.800 118.996 2.804 1 1 64 . 15 1 1 A 27 27 GLU H H 27 8.380 8.833 -0.453 1 1 65 . 15 1 1 A 27 27 GLU HA H 27 4.240 4.797 -0.557 1 1 70 . 15 1 1 A 27 27 GLU C C 27 176.130 176.417 -0.287 1 1 71 . 15 1 1 A 27 27 GLU CA C 27 56.700 54.737 1.963 1 1 72 . 15 1 1 A 27 27 GLU CB C 27 30.370 31.002 -0.632 1 1 74 . 15 1 1 A 27 27 GLU N N 27 121.700 123.281 -1.581 1 1 75 . 15 1 1 A 28 28 ALA H H 28 8.230 8.564 -0.334 1 1 76 . 15 1 1 A 28 28 ALA HA H 28 4.280 4.324 -0.044 1 1 80 . 15 1 1 A 28 28 ALA C C 28 177.090 177.324 -0.234 1 1 81 . 15 1 1 A 28 28 ALA CA C 28 52.530 51.762 0.768 1 1 82 . 15 1 1 A 28 28 ALA CB C 28 19.360 19.887 -0.527 1 1 83 . 15 1 1 A 28 28 ALA N N 28 124.640 124.317 0.323 1 1 84 . 15 1 1 A 29 29 ALA H H 29 8.150 8.523 -0.373 1 1 85 . 15 1 1 A 29 29 ALA HA H 29 4.320 3.876 0.444 1 1 89 . 15 1 1 A 29 29 ALA C C 29 177.120 176.922 0.198 1 1 90 . 15 1 1 A 29 29 ALA CA C 29 52.040 52.865 -0.825 1 1 91 . 15 1 1 A 29 29 ALA CB C 29 19.430 17.594 1.836 1 1 92 . 15 1 1 A 29 29 ALA N N 29 123.430 119.435 3.995 1 1 93 . 15 1 1 A 30 30 GLU H H 30 8.310 8.171 0.139 1 1 94 . 15 1 1 A 30 30 GLU HA H 30 4.220 4.476 -0.256 1 1 99 . 15 1 1 A 30 30 GLU C C 30 176.310 176.208 0.102 1 1 100 . 15 1 1 A 30 30 GLU CA C 30 56.630 56.500 0.130 1 1 101 . 15 1 1 A 30 30 GLU CB C 30 30.320 30.066 0.254 1 1 103 . 15 1 1 A 30 30 GLU N N 30 120.630 116.666 3.964 1 1 104 . 15 1 1 A 31 31 VAL H H 31 8.630 8.936 -0.306 1 1 105 . 15 1 1 A 31 31 VAL HA H 31 4.430 5.097 -0.667 1 1 113 . 15 1 1 A 31 31 VAL C C 31 176.510 177.176 -0.666 1 1 114 . 15 1 1 A 31 31 VAL CA C 31 62.360 60.819 1.541 1 1 115 . 15 1 1 A 31 31 VAL CB C 31 32.370 33.234 -0.864 1 1 118 . 15 1 1 A 31 31 VAL N N 31 127.110 123.733 3.377 1 1 119 . 15 1 1 A 32 32 THR H H 32 7.640 8.909 -1.269 1 1 120 . 15 1 1 A 32 32 THR HA H 32 4.870 3.888 0.982 1 1 125 . 15 1 1 A 32 32 THR C C 32 172.220 174.736 -2.516 1 1 126 . 15 1 1 A 32 32 THR CA C 32 59.510 65.123 -5.613 1 1 127 . 15 1 1 A 32 32 THR CB C 32 71.630 69.613 2.017 1 1 129 . 15 1 1 A 32 32 THR N N 32 118.860 121.538 -2.678 1 1 130 . 15 1 1 A 33 33 GLY H H 33 8.350 7.973 0.377 1 1 131 . 15 1 1 A 33 33 GLY HA2 H 33 4.160 3.969 0.191 1 1 132 . 15 1 1 A 33 33 GLY HA3 H 33 4.250 3.980 0.270 1 1 133 . 15 1 1 A 33 33 GLY C C 33 172.820 173.349 -0.529 1 1 134 . 15 1 1 A 33 33 GLY CA C 33 46.680 45.975 0.705 1 1 135 . 15 1 1 A 33 33 GLY N N 33 106.720 108.948 -2.228 1 1 136 . 15 1 1 A 34 34 SER H H 34 8.810 8.111 0.699 1 1 137 . 15 1 1 A 34 34 SER HA H 34 5.390 4.887 0.503 1 1 140 . 15 1 1 A 34 34 SER C C 34 173.780 172.910 0.870 1 1 141 . 15 1 1 A 34 34 SER CA C 34 57.380 57.504 -0.124 1 1 142 . 15 1 1 A 34 34 SER CB C 34 65.730 65.738 -0.008 1 1 143 . 15 1 1 A 34 34 SER N N 34 112.690 119.097 -6.407 1 1 144 . 15 1 1 A 35 35 VAL H H 35 8.470 8.756 -0.286 1 1 145 . 15 1 1 A 35 35 VAL HA H 35 4.120 4.953 -0.833 1 1 153 . 15 1 1 A 35 35 VAL C C 35 174.750 174.885 -0.135 1 1 154 . 15 1 1 A 35 35 VAL CA C 35 62.310 60.528 1.782 1 1 155 . 15 1 1 A 35 35 VAL CB C 35 34.550 33.199 1.351 1 1 158 . 15 1 1 A 35 35 VAL N N 35 123.150 121.954 1.196 1 1 159 . 15 1 1 A 36 36 SER H H 36 8.240 8.920 -0.680 1 1 160 . 15 1 1 A 36 36 SER HA H 36 4.690 5.226 -0.536 1 1 163 . 15 1 1 A 36 36 SER C C 36 171.860 173.075 -1.215 1 1 164 . 15 1 1 A 36 36 SER CA C 36 56.020 56.561 -0.541 1 1 165 . 15 1 1 A 36 36 SER CB C 36 66.050 64.317 1.733 1 1 166 . 15 1 1 A 36 36 SER N N 36 118.760 119.310 -0.550 1 1 167 . 15 1 1 A 37 37 LEU H H 37 8.310 8.944 -0.634 1 1 168 . 15 1 1 A 37 37 LEU HA H 37 4.870 4.860 0.010 1 1 178 . 15 1 1 A 37 37 LEU C C 37 174.190 175.807 -1.617 1 1 179 . 15 1 1 A 37 37 LEU CA C 37 53.870 53.757 0.113 1 1 180 . 15 1 1 A 37 37 LEU CB C 37 47.000 42.739 4.261 1 1 184 . 15 1 1 A 37 37 LEU N N 37 124.790 127.055 -2.265 1 1 185 . 15 1 1 A 38 38 GLU H H 38 9.270 8.735 0.535 1 1 186 . 15 1 1 A 38 38 GLU HA H 38 4.650 4.997 -0.347 1 1 191 . 15 1 1 A 38 38 GLU C C 38 173.970 174.753 -0.783 1 1 192 . 15 1 1 A 38 38 GLU CA C 38 54.410 55.192 -0.782 1 1 193 . 15 1 1 A 38 38 GLU CB C 38 32.460 31.430 1.030 1 1 195 . 15 1 1 A 38 38 GLU N N 38 126.550 124.036 2.514 1 1 196 . 15 1 1 A 39 39 ALA H H 39 8.120 8.519 -0.399 1 1 197 . 15 1 1 A 39 39 ALA HA H 39 4.600 4.763 -0.163 1 1 201 . 15 1 1 A 39 39 ALA C C 39 175.930 177.495 -1.565 1 1 202 . 15 1 1 A 39 39 ALA CA C 39 51.570 51.164 0.406 1 1 203 . 15 1 1 A 39 39 ALA CB C 39 21.780 22.916 -1.136 1 1 204 . 15 1 1 A 39 39 ALA N N 39 124.410 127.550 -3.140 1 1 205 . 15 1 1 A 40 40 LEU H H 40 7.860 8.948 -1.088 1 1 206 . 15 1 1 A 40 40 LEU HA H 40 4.230 4.049 0.181 1 1 216 . 15 1 1 A 40 40 LEU C C 40 175.940 176.595 -0.655 1 1 217 . 15 1 1 A 40 40 LEU CA C 40 55.360 57.759 -2.399 1 1 218 . 15 1 1 A 40 40 LEU CB C 40 42.990 42.690 0.300 1 1 222 . 15 1 1 A 40 40 LEU N N 40 120.640 122.542 -1.902 1 1 223 . 15 1 1 A 41 41 GLU H H 41 8.210 7.883 0.327 1 1 224 . 15 1 1 A 41 41 GLU HA H 41 4.240 4.018 0.222 1 1 229 . 15 1 1 A 41 41 GLU C C 41 176.920 175.092 1.828 1 1 230 . 15 1 1 A 41 41 GLU CA C 41 58.090 57.806 0.284 1 1 231 . 15 1 1 A 41 41 GLU CB C 41 30.530 27.211 3.319 1 1 233 . 15 1 1 A 41 41 GLU N N 41 114.680 117.841 -3.161 1 1 234 . 15 1 1 A 42 42 GLU H H 42 7.490 7.769 -0.279 1 1 235 . 15 1 1 A 42 42 GLU HA H 42 5.680 4.771 0.909 1 1 240 . 15 1 1 A 42 42 GLU C C 42 173.790 174.178 -0.388 1 1 241 . 15 1 1 A 42 42 GLU CA C 42 54.360 56.242 -1.882 1 1 242 . 15 1 1 A 42 42 GLU CB C 42 33.850 33.248 0.602 1 1 244 . 15 1 1 A 42 42 GLU N N 42 116.670 118.027 -1.357 1 1 245 . 15 1 1 A 43 43 VAL H H 43 8.550 8.881 -0.331 1 1 246 . 15 1 1 A 43 43 VAL HA H 43 4.550 4.649 -0.099 1 1 254 . 15 1 1 A 43 43 VAL C C 43 172.220 174.127 -1.907 1 1 255 . 15 1 1 A 43 43 VAL CA C 43 59.470 60.539 -1.069 1 1 256 . 15 1 1 A 43 43 VAL CB C 43 35.470 34.477 0.993 1 1 259 . 15 1 1 A 43 43 VAL N N 43 120.030 125.110 -5.080 1 1 260 . 15 1 1 A 44 44 GLN H H 44 8.470 8.672 -0.202 1 1 261 . 15 1 1 A 44 44 GLN HA H 44 4.890 4.401 0.489 1 1 268 . 15 1 1 A 44 44 GLN C C 44 176.130 175.974 0.156 1 1 269 . 15 1 1 A 44 44 GLN CA C 44 54.360 55.735 -1.375 1 1 270 . 15 1 1 A 44 44 GLN CB C 44 30.610 28.955 1.655 1 1 272 . 15 1 1 A 44 44 GLN N N 44 124.690 130.347 -5.657 1 1 274 . 15 1 1 A 45 45 VAL H H 45 8.130 8.551 -0.421 1 1 275 . 15 1 1 A 45 45 VAL HA H 45 3.030 3.939 -0.909 1 1 283 . 15 1 1 A 45 45 VAL C C 45 176.710 177.201 -0.491 1 1 284 . 15 1 1 A 45 45 VAL CA C 45 65.810 64.693 1.117 1 1 285 . 15 1 1 A 45 45 VAL CB C 45 31.960 31.427 0.533 1 1 288 . 15 1 1 A 45 45 VAL N N 45 120.450 126.672 -6.222 1 1 289 . 15 1 1 A 46 46 GLY H H 46 8.950 9.946 -0.996 1 1 290 . 15 1 1 A 46 46 GLY HA2 H 46 3.590 4.022 -0.432 1 1 291 . 15 1 1 A 46 46 GLY HA3 H 46 4.410 4.024 0.386 1 1 292 . 15 1 1 A 46 46 GLY C C 46 174.390 173.880 0.510 1 1 293 . 15 1 1 A 46 46 GLY CA C 46 44.730 44.989 -0.259 1 1 294 . 15 1 1 A 46 46 GLY N N 46 116.490 115.277 1.213 1 1 295 . 15 1 1 A 47 47 GLU H H 47 8.260 7.806 0.454 1 1 296 . 15 1 1 A 47 47 GLU HA H 47 4.460 4.707 -0.247 1 1 301 . 15 1 1 A 47 47 GLU C C 47 174.780 175.843 -1.063 1 1 302 . 15 1 1 A 47 47 GLU CA C 47 54.830 55.120 -0.290 1 1 303 . 15 1 1 A 47 47 GLU CB C 47 31.140 32.131 -0.991 1 1 305 . 15 1 1 A 47 47 GLU N N 47 120.520 121.541 -1.021 1 1 306 . 15 1 1 A 48 48 ASN H H 48 8.440 8.671 -0.231 1 1 307 . 15 1 1 A 48 48 ASN HA H 48 5.380 5.469 -0.089 1 1 312 . 15 1 1 A 48 48 ASN C C 48 174.770 173.930 0.840 1 1 313 . 15 1 1 A 48 48 ASN CA C 48 51.570 51.918 -0.348 1 1 314 . 15 1 1 A 48 48 ASN CB C 48 39.010 40.458 -1.448 1 1 315 . 15 1 1 A 48 48 ASN N N 48 117.180 119.651 -2.471 1 1 317 . 15 1 1 A 49 49 LEU H H 49 9.810 8.471 1.339 1 1 318 . 15 1 1 A 49 49 LEU HA H 49 4.510 4.894 -0.384 1 1 328 . 15 1 1 A 49 49 LEU C C 49 174.560 174.697 -0.137 1 1 329 . 15 1 1 A 49 49 LEU CA C 49 53.460 54.052 -0.592 1 1 330 . 15 1 1 A 49 49 LEU CB C 49 45.520 44.015 1.505 1 1 333 . 15 1 1 A 49 49 LEU N N 49 125.620 124.542 1.078 1 1 334 . 15 1 1 A 50 50 GLU H H 50 8.750 8.742 0.008 1 1 335 . 15 1 1 A 50 50 GLU HA H 50 4.360 4.875 -0.515 1 1 340 . 15 1 1 A 50 50 GLU C C 50 175.340 175.302 0.038 1 1 341 . 15 1 1 A 50 50 GLU CA C 50 55.550 55.357 0.193 1 1 342 . 15 1 1 A 50 50 GLU CB C 50 29.890 30.973 -1.083 1 1 344 . 15 1 1 A 50 50 GLU N N 50 125.420 124.446 0.974 1 1 345 . 15 1 1 A 51 51 VAL H H 51 9.230 8.787 0.443 1 1 346 . 15 1 1 A 51 51 VAL HA H 51 4.190 4.359 -0.169 1 1 354 . 15 1 1 A 51 51 VAL C C 51 175.310 175.438 -0.128 1 1 355 . 15 1 1 A 51 51 VAL CA C 51 62.520 61.270 1.250 1 1 356 . 15 1 1 A 51 51 VAL CB C 51 31.470 31.441 0.029 1 1 359 . 15 1 1 A 51 51 VAL N N 51 129.810 125.797 4.013 1 1 360 . 15 1 1 A 52 52 GLY H H 52 9.410 8.845 0.565 1 1 361 . 15 1 1 A 52 52 GLY HA2 H 52 3.460 3.873 -0.413 1 1 362 . 15 1 1 A 52 52 GLY HA3 H 52 4.680 3.909 0.771 1 1 363 . 15 1 1 A 52 52 GLY C C 52 173.000 173.158 -0.158 1 1 364 . 15 1 1 A 52 52 GLY CA C 52 46.470 47.267 -0.797 1 1 365 . 15 1 1 A 52 52 GLY N N 52 116.600 114.474 2.126 1 1 366 . 15 1 1 A 53 53 VAL H H 53 9.130 8.247 0.883 1 1 367 . 15 1 1 A 53 53 VAL HA H 53 4.840 4.844 -0.004 1 1 375 . 15 1 1 A 53 53 VAL C C 53 175.470 175.378 0.092 1 1 376 . 15 1 1 A 53 53 VAL CA C 53 61.350 61.609 -0.259 1 1 377 . 15 1 1 A 53 53 VAL CB C 53 34.300 31.624 2.676 1 1 380 . 15 1 1 A 53 53 VAL N N 53 129.050 121.758 7.292 1 1 381 . 15 1 1 A 54 54 GLY H H 54 8.420 8.544 -0.124 1 1 382 . 15 1 1 A 54 54 GLY HA2 H 54 3.850 3.734 0.116 1 1 383 . 15 1 1 A 54 54 GLY HA3 H 54 3.850 3.905 -0.055 1 1 384 . 15 1 1 A 54 54 GLY C C 54 173.310 172.745 0.565 1 1 385 . 15 1 1 A 54 54 GLY CA C 54 45.180 44.505 0.675 1 1 386 . 15 1 1 A 54 54 GLY N N 54 116.890 115.270 1.620 1 1 387 . 15 1 1 A 55 55 ILE H H 55 10.190 8.193 1.997 1 1 388 . 15 1 1 A 55 55 ILE HA H 55 4.010 4.765 -0.755 1 1 398 . 15 1 1 A 55 55 ILE C C 55 174.380 175.213 -0.833 1 1 399 . 15 1 1 A 55 55 ILE CA C 55 61.350 59.797 1.553 1 1 400 . 15 1 1 A 55 55 ILE CB C 55 40.840 40.529 0.311 1 1 404 . 15 1 1 A 55 55 ILE N N 55 129.330 121.887 7.443 1 1 405 . 15 1 1 A 56 56 ASP H H 56 8.810 9.732 -0.922 1 1 406 . 15 1 1 A 56 56 ASP HA H 56 4.440 4.698 -0.258 1 1 409 . 15 1 1 A 56 56 ASP C C 56 175.530 175.253 0.277 1 1 410 . 15 1 1 A 56 56 ASP CA C 56 56.460 55.316 1.144 1 1 411 . 15 1 1 A 56 56 ASP CB C 56 42.720 42.820 -0.100 1 1 412 . 15 1 1 A 56 56 ASP N N 56 128.310 127.537 0.773 1 1 413 . 15 1 1 A 57 57 GLU H H 57 7.270 7.720 -0.450 1 1 414 . 15 1 1 A 57 57 GLU HA H 57 4.290 4.752 -0.462 1 1 419 . 15 1 1 A 57 57 GLU C C 57 173.370 174.329 -0.959 1 1 420 . 15 1 1 A 57 57 GLU CA C 57 54.840 55.361 -0.521 1 1 421 . 15 1 1 A 57 57 GLU CB C 57 33.190 33.434 -0.244 1 1 423 . 15 1 1 A 57 57 GLU N N 57 112.810 115.901 -3.091 1 1 424 . 15 1 1 A 58 58 LEU H H 58 8.370 8.689 -0.319 1 1 425 . 15 1 1 A 58 58 LEU HA H 58 4.830 4.697 0.133 1 1 434 . 15 1 1 A 58 58 LEU C C 58 174.180 174.673 -0.493 1 1 435 . 15 1 1 A 58 58 LEU CA C 58 55.320 54.492 0.828 1 1 436 . 15 1 1 A 58 58 LEU CB C 58 44.300 43.029 1.271 1 1 439 . 15 1 1 A 58 58 LEU N N 58 123.130 125.713 -2.583 1 1 440 . 15 1 1 A 59 59 VAL H H 59 9.120 8.570 0.550 1 1 441 . 15 1 1 A 59 59 VAL HA H 59 4.240 4.933 -0.693 1 1 449 . 15 1 1 A 59 59 VAL C C 59 174.960 175.672 -0.712 1 1 450 . 15 1 1 A 59 59 VAL CA C 59 61.760 60.584 1.176 1 1 451 . 15 1 1 A 59 59 VAL CB C 59 33.760 33.327 0.433 1 1 454 . 15 1 1 A 59 59 VAL N N 59 127.930 121.756 6.174 1 1 455 . 15 1 1 A 60 60 ASN H H 60 8.770 8.648 0.122 1 1 456 . 15 1 1 A 60 60 ASN HA H 60 4.250 4.347 -0.097 1 1 461 . 15 1 1 A 60 60 ASN C C 60 172.810 173.718 -0.908 1 1 462 . 15 1 1 A 60 60 ASN CA C 60 54.830 54.276 0.554 1 1 463 . 15 1 1 A 60 60 ASN CB C 60 36.030 36.742 -0.712 1 1 464 . 15 1 1 A 60 60 ASN N N 60 115.500 119.173 -3.673 1 1 466 . 15 1 1 A 61 61 ALA H H 61 7.330 7.268 0.062 1 1 467 . 15 1 1 A 61 61 ALA HA H 61 4.520 4.459 0.061 1 1 471 . 15 1 1 A 61 61 ALA C C 61 174.580 175.885 -1.305 1 1 472 . 15 1 1 A 61 61 ALA CA C 61 51.560 51.580 -0.020 1 1 473 . 15 1 1 A 61 61 ALA CB C 61 22.870 22.661 0.209 1 1 474 . 15 1 1 A 61 61 ALA N N 61 115.640 117.444 -1.804 1 1 475 . 15 1 1 A 62 62 GLU H H 62 7.900 8.665 -0.765 1 1 476 . 15 1 1 A 62 62 GLU HA H 62 4.310 4.464 -0.154 1 1 481 . 15 1 1 A 62 62 GLU C C 62 173.790 175.327 -1.537 1 1 482 . 15 1 1 A 62 62 GLU CA C 62 55.080 55.294 -0.214 1 1 483 . 15 1 1 A 62 62 GLU CB C 62 32.610 28.780 3.830 1 1 485 . 15 1 1 A 62 62 GLU N N 62 117.400 122.773 -5.373 1 1 486 . 15 1 1 A 63 63 ALA H H 63 8.910 8.088 0.822 1 1 487 . 15 1 1 A 63 63 ALA HA H 63 4.690 4.488 0.202 1 1 491 . 15 1 1 A 63 63 ALA C C 63 175.720 176.422 -0.702 1 1 492 . 15 1 1 A 63 63 ALA CA C 63 50.600 53.109 -2.509 1 1 493 . 15 1 1 A 63 63 ALA CB C 63 20.660 19.120 1.540 1 1 494 . 15 1 1 A 63 63 ALA N N 63 122.480 127.942 -5.462 1 1 495 . 15 1 1 A 64 64 PHE H H 64 9.220 9.640 -0.420 1 1 496 . 15 1 1 A 64 64 PHE HA H 64 4.320 4.696 -0.376 1 1 501 . 15 1 1 A 64 64 PHE C C 64 174.380 176.267 -1.887 1 1 502 . 15 1 1 A 64 64 PHE CA C 64 59.770 58.788 0.982 1 1 503 . 15 1 1 A 64 64 PHE CB C 64 40.830 41.008 -0.178 1 1 504 . 15 1 1 A 64 64 PHE N N 64 120.870 123.576 -2.706 1 1 505 . 15 1 1 A 65 65 ALA H H 65 8.150 7.922 0.228 1 1 506 . 15 1 1 A 65 65 ALA HA H 65 5.280 4.911 0.369 1 1 510 . 15 1 1 A 65 65 ALA C C 65 175.950 174.841 1.109 1 1 511 . 15 1 1 A 65 65 ALA CA C 65 51.120 51.048 0.072 1 1 512 . 15 1 1 A 65 65 ALA CB C 65 22.850 21.388 1.462 1 1 513 . 15 1 1 A 65 65 ALA N N 65 122.350 120.348 2.002 1 1 514 . 15 1 1 A 66 66 TYR H H 66 9.260 9.231 0.029 1 1 515 . 15 1 1 A 66 66 TYR HA H 66 5.710 5.382 0.328 1 1 520 . 15 1 1 A 66 66 TYR C C 66 175.690 173.760 1.930 1 1 521 . 15 1 1 A 66 66 TYR CA C 66 54.390 56.311 -1.921 1 1 522 . 15 1 1 A 66 66 TYR CB C 66 41.560 40.285 1.275 1 1 523 . 15 1 1 A 66 66 TYR N N 66 124.350 126.578 -2.228 1 1 524 . 15 1 1 A 67 67 ASP H H 67 9.070 8.851 0.219 1 1 525 . 15 1 1 A 67 67 ASP HA H 67 5.630 5.388 0.242 1 1 528 . 15 1 1 A 67 67 ASP C C 67 174.300 174.972 -0.672 1 1 529 . 15 1 1 A 67 67 ASP CA C 67 51.590 52.191 -0.601 1 1 530 . 15 1 1 A 67 67 ASP CB C 67 44.380 43.786 0.594 1 1 531 . 15 1 1 A 67 67 ASP N N 67 130.490 125.499 4.991 1 1 532 . 15 1 1 A 68 68 PHE H H 68 8.670 8.278 0.392 1 1 533 . 15 1 1 A 68 68 PHE HA H 68 4.890 5.255 -0.365 1 1 538 . 15 1 1 A 68 68 PHE C C 68 172.220 172.762 -0.542 1 1 539 . 15 1 1 A 68 68 PHE CA C 68 57.360 55.784 1.576 1 1 540 . 15 1 1 A 68 68 PHE CB C 68 40.360 41.870 -1.510 1 1 541 . 15 1 1 A 68 68 PHE N N 68 118.200 116.970 1.230 1 1 542 . 15 1 1 A 69 69 THR H H 69 8.390 9.102 -0.712 1 1 543 . 15 1 1 A 69 69 THR HA H 69 5.170 4.985 0.185 1 1 548 . 15 1 1 A 69 69 THR C C 69 172.620 173.825 -1.205 1 1 549 . 15 1 1 A 69 69 THR CA C 69 61.370 61.251 0.119 1 1 550 . 15 1 1 A 69 69 THR CB C 69 64.880 70.226 -5.346 1 1 552 . 15 1 1 A 69 69 THR N N 69 115.810 113.626 2.184 1 1 553 . 15 1 1 A 70 70 LEU H H 70 9.560 8.326 1.234 1 1 554 . 15 1 1 A 70 70 LEU HA H 70 5.270 4.762 0.508 1 1 564 . 15 1 1 A 70 70 LEU C C 70 173.800 176.004 -2.204 1 1 565 . 15 1 1 A 70 70 LEU CA C 70 53.460 54.258 -0.798 1 1 566 . 15 1 1 A 70 70 LEU CB C 70 45.040 43.205 1.835 1 1 570 . 15 1 1 A 70 70 LEU N N 70 129.220 125.711 3.509 1 1 571 . 15 1 1 A 71 71 ASN H H 71 9.590 8.278 1.312 1 1 572 . 15 1 1 A 71 71 ASN HA H 71 5.880 5.698 0.182 1 1 577 . 15 1 1 A 71 71 ASN C C 71 177.970 174.107 3.863 1 1 578 . 15 1 1 A 71 71 ASN CA C 71 52.060 52.026 0.034 1 1 579 . 15 1 1 A 71 71 ASN CB C 71 41.020 41.018 0.002 1 1 580 . 15 1 1 A 71 71 ASN N N 71 125.970 118.195 7.775 1 1 582 . 15 1 1 A 72 72 TYR H H 72 8.740 9.324 -0.584 1 1 583 . 15 1 1 A 72 72 TYR HA H 72 5.110 5.208 -0.098 1 1 588 . 15 1 1 A 72 72 TYR C C 72 177.720 172.832 4.888 1 1 589 . 15 1 1 A 72 72 TYR CA C 72 55.310 55.357 -0.047 1 1 590 . 15 1 1 A 72 72 TYR CB C 72 41.510 41.401 0.109 1 1 591 . 15 1 1 A 72 72 TYR N N 72 119.640 120.516 -0.876 1 1 592 . 15 1 1 A 73 73 ASP H H 73 9.780 8.895 0.885 1 1 593 . 15 1 1 A 73 73 ASP HA H 73 4.680 5.213 -0.533 1 1 596 . 15 1 1 A 73 73 ASP C C 73 177.290 176.308 0.982 1 1 597 . 15 1 1 A 73 73 ASP CA C 73 53.650 52.725 0.925 1 1 598 . 15 1 1 A 73 73 ASP CB C 73 40.900 42.528 -1.628 1 1 599 . 15 1 1 A 73 73 ASP N N 73 119.290 119.080 0.210 1 1 600 . 15 1 1 A 74 74 GLU H H 74 9.430 9.014 0.416 1 1 601 . 15 1 1 A 74 74 GLU HA H 74 4.740 4.454 0.286 1 1 606 . 15 1 1 A 74 74 GLU C C 74 176.320 178.398 -2.078 1 1 607 . 15 1 1 A 74 74 GLU CA C 74 57.410 58.852 -1.442 1 1 608 . 15 1 1 A 74 74 GLU CB C 74 29.490 29.501 -0.011 1 1 610 . 15 1 1 A 74 74 GLU N N 74 130.930 123.136 7.794 1 1 611 . 15 1 1 A 75 75 ASN H H 75 8.680 8.319 0.361 1 1 612 . 15 1 1 A 75 75 ASN HA H 75 4.600 4.463 0.137 1 1 617 . 15 1 1 A 75 75 ASN C C 75 175.340 177.210 -1.870 1 1 618 . 15 1 1 A 75 75 ASN CA C 75 54.620 56.173 -1.553 1 1 619 . 15 1 1 A 75 75 ASN CB C 75 38.770 38.047 0.723 1 1 620 . 15 1 1 A 75 75 ASN N N 75 115.040 118.259 -3.219 1 1 622 . 15 1 1 A 76 76 ALA H H 76 7.740 7.607 0.133 1 1 623 . 15 1 1 A 76 76 ALA HA H 76 4.310 4.402 -0.092 1 1 627 . 15 1 1 A 76 76 ALA C C 76 175.550 176.971 -1.421 1 1 628 . 15 1 1 A 76 76 ALA CA C 76 53.260 53.717 -0.457 1 1 629 . 15 1 1 A 76 76 ALA CB C 76 21.450 20.365 1.085 1 1 630 . 15 1 1 A 76 76 ALA N N 76 122.200 118.897 3.303 1 1 631 . 15 1 1 A 77 77 PHE H H 77 8.070 8.238 -0.168 1 1 632 . 15 1 1 A 77 77 PHE HA H 77 5.650 4.949 0.701 1 1 637 . 15 1 1 A 77 77 PHE C C 77 174.570 175.384 -0.814 1 1 638 . 15 1 1 A 77 77 PHE CA C 77 56.360 57.411 -1.051 1 1 639 . 15 1 1 A 77 77 PHE CB C 77 46.080 41.101 4.979 1 1 640 . 15 1 1 A 77 77 PHE N N 77 114.160 113.929 0.231 1 1 641 . 15 1 1 A 78 78 GLU H H 78 8.800 8.965 -0.165 1 1 642 . 15 1 1 A 78 78 GLU HA H 78 4.900 5.121 -0.221 1 1 647 . 15 1 1 A 78 78 GLU C C 78 175.950 174.707 1.243 1 1 648 . 15 1 1 A 78 78 GLU CA C 78 53.670 56.027 -2.357 1 1 649 . 15 1 1 A 78 78 GLU CB C 78 33.600 32.721 0.879 1 1 651 . 15 1 1 A 78 78 GLU N N 78 117.590 120.422 -2.832 1 1 652 . 15 1 1 A 79 79 TYR H H 79 8.770 9.159 -0.389 1 1 653 . 15 1 1 A 79 79 TYR HA H 79 4.250 4.285 -0.035 1 1 658 . 15 1 1 A 79 79 TYR C C 79 174.580 174.942 -0.362 1 1 659 . 15 1 1 A 79 79 TYR CA C 79 59.250 59.552 -0.302 1 1 660 . 15 1 1 A 79 79 TYR CB C 79 38.310 39.228 -0.918 1 1 661 . 15 1 1 A 79 79 TYR N N 79 126.560 129.391 -2.831 1 1 662 . 15 1 1 A 80 80 VAL H H 80 8.220 8.220 0.000 1 1 663 . 15 1 1 A 80 80 VAL HA H 80 3.690 3.899 -0.209 1 1 671 . 15 1 1 A 80 80 VAL C C 80 174.780 175.462 -0.682 1 1 672 . 15 1 1 A 80 80 VAL CA C 80 64.400 62.812 1.588 1 1 673 . 15 1 1 A 80 80 VAL CB C 80 33.510 32.880 0.630 1 1 676 . 15 1 1 A 80 80 VAL N N 80 129.460 124.685 4.775 1 1 677 . 15 1 1 A 81 81 GLU H H 81 6.920 7.540 -0.620 1 1 678 . 15 1 1 A 81 81 GLU HA H 81 4.260 4.704 -0.444 1 1 683 . 15 1 1 A 81 81 GLU C C 81 171.840 174.748 -2.908 1 1 684 . 15 1 1 A 81 81 GLU CA C 81 55.310 55.264 0.046 1 1 685 . 15 1 1 A 81 81 GLU CB C 81 30.520 33.020 -2.500 1 1 687 . 15 1 1 A 81 81 GLU N N 81 112.430 114.704 -2.274 1 1 688 . 15 1 1 A 82 82 ALA H H 82 8.310 8.599 -0.289 1 1 689 . 15 1 1 A 82 82 ALA HA H 82 5.650 5.082 0.568 1 1 693 . 15 1 1 A 82 82 ALA C C 82 176.110 176.933 -0.823 1 1 694 . 15 1 1 A 82 82 ALA CA C 82 50.620 51.659 -1.039 1 1 695 . 15 1 1 A 82 82 ALA CB C 82 21.770 19.941 1.829 1 1 696 . 15 1 1 A 82 82 ALA N N 82 121.240 124.686 -3.446 1 1 697 . 15 1 1 A 83 83 ILE H H 83 9.150 9.037 0.113 1 1 698 . 15 1 1 A 83 83 ILE HA H 83 4.600 4.887 -0.287 1 1 708 . 15 1 1 A 83 83 ILE C C 83 174.810 175.183 -0.373 1 1 709 . 15 1 1 A 83 83 ILE CA C 83 60.060 59.221 0.839 1 1 710 . 15 1 1 A 83 83 ILE CB C 83 42.440 41.960 0.480 1 1 714 . 15 1 1 A 83 83 ILE N N 83 119.720 119.650 0.070 1 1 715 . 15 1 1 A 84 84 SER H H 84 8.350 8.853 -0.503 1 1 716 . 15 1 1 A 84 84 SER HA H 84 4.660 4.852 -0.192 1 1 719 . 15 1 1 A 84 84 SER C C 84 177.550 172.724 4.826 1 1 720 . 15 1 1 A 84 84 SER CA C 84 57.330 55.794 1.536 1 1 721 . 15 1 1 A 84 84 SER CB C 84 66.490 65.570 0.920 1 1 722 . 15 1 1 A 84 84 SER N N 84 116.740 120.262 -3.522 1 1 723 . 15 1 1 A 85 85 ASP H H 85 8.740 8.700 0.040 1 1 724 . 15 1 1 A 85 85 ASP HA H 85 4.820 4.776 0.044 1 1 727 . 15 1 1 A 85 85 ASP C C 85 176.090 176.640 -0.550 1 1 728 . 15 1 1 A 85 85 ASP CA C 85 53.480 52.264 1.216 1 1 729 . 15 1 1 A 85 85 ASP CB C 85 42.480 43.155 -0.675 1 1 730 . 15 1 1 A 85 85 ASP N N 85 120.960 122.069 -1.109 1 1 731 . 15 1 1 A 86 86 ASP H H 86 8.380 8.748 -0.368 1 1 732 . 15 1 1 A 86 86 ASP HA H 86 4.450 4.896 -0.446 1 1 735 . 15 1 1 A 86 86 ASP C C 86 177.100 176.123 0.977 1 1 736 . 15 1 1 A 86 86 ASP CA C 86 56.240 52.973 3.267 1 1 737 . 15 1 1 A 86 86 ASP CB C 86 41.100 40.423 0.677 1 1 738 . 15 1 1 A 86 86 ASP N N 86 117.710 119.808 -2.098 1 1 739 . 15 1 1 A 87 87 GLY H H 87 8.690 7.604 1.086 1 1 740 . 15 1 1 A 87 87 GLY HA2 H 87 3.870 4.098 -0.228 1 1 741 . 15 1 1 A 87 87 GLY HA3 H 87 4.090 4.104 -0.014 1 1 742 . 15 1 1 A 87 87 GLY C C 87 173.800 174.277 -0.477 1 1 743 . 15 1 1 A 87 87 GLY CA C 87 45.770 45.696 0.074 1 1 744 . 15 1 1 A 87 87 GLY N N 87 108.540 107.996 0.544 1 1 745 . 15 1 1 A 88 88 VAL H H 88 7.910 7.585 0.325 1 1 746 . 15 1 1 A 88 88 VAL HA H 88 4.780 4.208 0.572 1 1 754 . 15 1 1 A 88 88 VAL C C 88 173.970 175.320 -1.350 1 1 755 . 15 1 1 A 88 88 VAL CA C 88 60.900 62.271 -1.371 1 1 756 . 15 1 1 A 88 88 VAL CB C 88 35.460 32.764 2.696 1 1 759 . 15 1 1 A 88 88 VAL N N 88 119.790 120.615 -0.825 1 1 760 . 15 1 1 A 89 89 PHE H H 89 9.210 9.621 -0.411 1 1 761 . 15 1 1 A 89 89 PHE HA H 89 4.930 5.339 -0.409 1 1 766 . 15 1 1 A 89 89 PHE C C 89 173.970 173.820 0.150 1 1 767 . 15 1 1 A 89 89 PHE CA C 89 56.450 55.316 1.134 1 1 768 . 15 1 1 A 89 89 PHE CB C 89 41.120 41.091 0.029 1 1 769 . 15 1 1 A 89 89 PHE N N 89 126.780 127.126 -0.346 1 1 770 . 15 1 1 A 90 90 VAL H H 90 7.880 8.891 -1.011 1 1 771 . 15 1 1 A 90 90 VAL HA H 90 4.860 5.221 -0.361 1 1 779 . 15 1 1 A 90 90 VAL C C 90 173.190 175.040 -1.850 1 1 780 . 15 1 1 A 90 90 VAL CA C 90 59.750 61.336 -1.586 1 1 781 . 15 1 1 A 90 90 VAL CB C 90 34.770 33.583 1.187 1 1 784 . 15 1 1 A 90 90 VAL N N 90 124.990 127.996 -3.006 1 1 785 . 15 1 1 A 91 91 ASN H H 91 8.670 9.027 -0.357 1 1 786 . 15 1 1 A 91 91 ASN HA H 91 4.730 5.183 -0.453 1 1 791 . 15 1 1 A 91 91 ASN C C 91 173.200 174.156 -0.956 1 1 792 . 15 1 1 A 91 91 ASN CA C 91 51.970 53.212 -1.242 1 1 793 . 15 1 1 A 91 91 ASN CB C 91 41.340 41.957 -0.617 1 1 794 . 15 1 1 A 91 91 ASN N N 91 124.860 124.906 -0.046 1 1 796 . 15 1 1 A 92 92 ALA H H 92 8.840 9.022 -0.182 1 1 797 . 15 1 1 A 92 92 ALA HA H 92 5.290 4.680 0.610 1 1 801 . 15 1 1 A 92 92 ALA C C 92 176.330 176.484 -0.154 1 1 802 . 15 1 1 A 92 92 ALA CA C 92 50.170 51.230 -1.060 1 1 803 . 15 1 1 A 92 92 ALA CB C 92 23.610 21.254 2.356 1 1 804 . 15 1 1 A 92 92 ALA N N 92 128.510 128.550 -0.040 1 1 805 . 15 1 1 A 93 93 LYS H H 93 8.670 8.879 -0.209 1 1 806 . 15 1 1 A 93 93 LYS HA H 93 4.460 4.742 -0.282 1 1 815 . 15 1 1 A 93 93 LYS C C 93 174.170 174.830 -0.660 1 1 816 . 15 1 1 A 93 93 LYS CA C 93 55.010 55.454 -0.444 1 1 817 . 15 1 1 A 93 93 LYS CB C 93 36.430 35.662 0.768 1 1 821 . 15 1 1 A 93 93 LYS N N 93 121.300 118.082 3.218 1 1 822 . 15 1 1 A 94 94 LYS H H 94 8.960 8.738 0.222 1 1 823 . 15 1 1 A 94 94 LYS HA H 94 4.460 4.151 0.309 1 1 832 . 15 1 1 A 94 94 LYS C C 94 176.330 176.741 -0.411 1 1 833 . 15 1 1 A 94 94 LYS CA C 94 56.720 56.684 0.036 1 1 834 . 15 1 1 A 94 94 LYS CB C 94 31.930 32.727 -0.797 1 1 837 . 15 1 1 A 94 94 LYS N N 94 127.060 127.385 -0.325 1 1 838 . 15 1 1 A 95 95 ILE H H 95 8.290 8.609 -0.319 1 1 839 . 15 1 1 A 95 95 ILE HA H 95 4.120 4.070 0.050 1 1 849 . 15 1 1 A 95 95 ILE C C 95 175.740 175.331 0.409 1 1 850 . 15 1 1 A 95 95 ILE CA C 95 62.760 62.671 0.089 1 1 851 . 15 1 1 A 95 95 ILE CB C 95 38.890 39.243 -0.353 1 1 855 . 15 1 1 A 95 95 ILE N N 95 126.530 127.999 -1.469 1 1 856 . 15 1 1 A 96 96 GLU H H 96 8.030 7.298 0.732 1 1 857 . 15 1 1 A 96 96 GLU HA H 96 4.450 4.575 -0.125 1 1 862 . 15 1 1 A 96 96 GLU C C 96 174.380 174.024 0.356 1 1 863 . 15 1 1 A 96 96 GLU CA C 96 54.320 55.562 -1.242 1 1 864 . 15 1 1 A 96 96 GLU CB C 96 32.770 32.526 0.244 1 1 866 . 15 1 1 A 96 96 GLU N N 96 117.080 120.153 -3.073 1 1 867 . 15 1 1 A 97 97 ASP H H 97 8.730 8.764 -0.034 1 1 868 . 15 1 1 A 97 97 ASP HA H 97 4.360 4.685 -0.325 1 1 871 . 15 1 1 A 97 97 ASP C C 97 177.100 177.129 -0.029 1 1 872 . 15 1 1 A 97 97 ASP CA C 97 57.160 55.172 1.988 1 1 873 . 15 1 1 A 97 97 ASP CB C 97 39.920 41.154 -1.234 1 1 874 . 15 1 1 A 97 97 ASP N N 97 120.570 120.941 -0.371 1 1 875 . 15 1 1 A 98 98 GLY H H 98 8.760 8.592 0.168 1 1 876 . 15 1 1 A 98 98 GLY HA2 H 98 2.120 1.797 0.323 1 1 877 . 15 1 1 A 98 98 GLY HA3 H 98 3.910 3.377 0.533 1 1 878 . 15 1 1 A 98 98 GLY C C 98 174.000 172.802 1.198 1 1 879 . 15 1 1 A 98 98 GLY CA C 98 45.720 45.209 0.511 1 1 880 . 15 1 1 A 98 98 GLY N N 98 112.090 111.267 0.823 1 1 881 . 15 1 1 A 99 99 LYS H H 99 7.890 7.154 0.736 1 1 882 . 15 1 1 A 99 99 LYS HA H 99 5.330 5.072 0.258 1 1 891 . 15 1 1 A 99 99 LYS C C 99 174.750 174.373 0.377 1 1 892 . 15 1 1 A 99 99 LYS CA C 99 55.990 54.832 1.158 1 1 893 . 15 1 1 A 99 99 LYS CB C 99 37.840 35.509 2.331 1 1 897 . 15 1 1 A 99 99 LYS N N 99 118.050 114.788 3.262 1 1 898 . 15 1 1 A 100 100 VAL H H 100 8.980 8.357 0.623 1 1 899 . 15 1 1 A 100 100 VAL HA H 100 4.510 4.751 -0.241 1 1 907 . 15 1 1 A 100 100 VAL C C 100 174.760 173.720 1.040 1 1 908 . 15 1 1 A 100 100 VAL CA C 100 60.130 59.047 1.083 1 1 909 . 15 1 1 A 100 100 VAL CB C 100 35.240 35.790 -0.550 1 1 912 . 15 1 1 A 100 100 VAL N N 100 123.850 119.762 4.088 1 1 913 . 15 1 1 A 101 101 ARG H H 101 8.810 8.103 0.707 1 1 914 . 15 1 1 A 101 101 ARG HA H 101 4.850 4.709 0.141 1 1 921 . 15 1 1 A 101 101 ARG C C 101 174.770 174.387 0.383 1 1 922 . 15 1 1 A 101 101 ARG CA C 101 54.580 54.886 -0.306 1 1 923 . 15 1 1 A 101 101 ARG CB C 101 32.400 31.286 1.114 1 1 926 . 15 1 1 A 101 101 ARG N N 101 129.210 123.404 5.806 1 1 927 . 15 1 1 A 102 102 VAL H H 102 9.100 8.247 0.853 1 1 928 . 15 1 1 A 102 102 VAL HA H 102 4.120 4.785 -0.665 1 1 936 . 15 1 1 A 102 102 VAL C C 102 171.640 173.513 -1.873 1 1 937 . 15 1 1 A 102 102 VAL CA C 102 61.350 59.649 1.701 1 1 938 . 15 1 1 A 102 102 VAL CB C 102 32.530 33.930 -1.400 1 1 941 . 15 1 1 A 102 102 VAL N N 102 130.470 123.506 6.964 1 1 942 . 15 1 1 A 103 103 LEU H H 103 8.110 9.454 -1.344 1 1 943 . 15 1 1 A 103 103 LEU HA H 103 5.120 5.009 0.111 1 1 953 . 15 1 1 A 103 103 LEU C C 103 176.410 175.569 0.841 1 1 954 . 15 1 1 A 103 103 LEU CA C 103 53.380 53.638 -0.258 1 1 955 . 15 1 1 A 103 103 LEU CB C 103 43.680 42.279 1.401 1 1 959 . 15 1 1 A 103 103 LEU N N 103 125.560 129.734 -4.174 1 1 960 . 15 1 1 A 104 104 VAL H H 104 9.580 8.951 0.629 1 1 961 . 15 1 1 A 104 104 VAL HA H 104 5.260 4.916 0.344 1 1 969 . 15 1 1 A 104 104 VAL C C 104 176.030 175.016 1.014 1 1 970 . 15 1 1 A 104 104 VAL CA C 104 60.220 61.315 -1.095 1 1 971 . 15 1 1 A 104 104 VAL CB C 104 34.310 33.603 0.707 1 1 974 . 15 1 1 A 104 104 VAL N N 104 125.790 126.933 -1.143 1 1 975 . 15 1 1 A 105 105 SER H H 105 9.340 8.984 0.356 1 1 976 . 15 1 1 A 105 105 SER HA H 105 5.300 5.116 0.184 1 1 979 . 15 1 1 A 105 105 SER C C 105 173.600 172.822 0.778 1 1 980 . 15 1 1 A 105 105 SER CA C 105 57.450 57.428 0.022 1 1 981 . 15 1 1 A 105 105 SER CB C 105 65.600 66.793 -1.193 1 1 982 . 15 1 1 A 105 105 SER N N 105 119.220 120.129 -0.909 1 1 983 . 15 1 1 A 106 106 SER H H 106 8.350 8.542 -0.192 1 1 984 . 15 1 1 A 106 106 SER HA H 106 4.720 5.077 -0.357 1 1 987 . 15 1 1 A 106 106 SER C C 106 176.930 174.079 2.851 1 1 988 . 15 1 1 A 106 106 SER CA C 106 58.170 57.310 0.860 1 1 989 . 15 1 1 A 106 106 SER CB C 106 64.170 64.037 0.133 1 1 990 . 15 1 1 A 106 106 SER N N 106 114.800 117.120 -2.320 1 1 991 . 15 1 1 A 107 107 LEU H H 107 8.770 8.520 0.250 1 1 992 . 15 1 1 A 107 107 LEU HA H 107 4.710 4.622 0.088 1 1 1001 . 15 1 1 A 107 107 LEU C C 107 178.280 177.390 0.890 1 1 1002 . 15 1 1 A 107 107 LEU CA C 107 55.280 54.031 1.249 1 1 1003 . 15 1 1 A 107 107 LEU CB C 107 43.410 42.473 0.937 1 1 1007 . 15 1 1 A 107 107 LEU N N 107 127.210 128.355 -1.145 1 1 1008 . 15 1 1 A 108 108 THR H H 108 8.210 7.831 0.379 1 1 1009 . 15 1 1 A 108 108 THR HA H 108 4.400 4.672 -0.272 1 1 1015 . 15 1 1 A 108 108 THR C C 108 176.130 175.866 0.264 1 1 1016 . 15 1 1 A 108 108 THR CA C 108 62.050 62.258 -0.208 1 1 1017 . 15 1 1 A 108 108 THR CB C 108 70.910 71.181 -0.271 1 1 1019 . 15 1 1 A 108 108 THR N N 108 108.810 111.614 -2.804 1 1 1020 . 15 1 1 A 109 109 GLY H H 109 8.250 8.261 -0.011 1 1 1021 . 15 1 1 A 109 109 GLY HA2 H 109 3.780 4.056 -0.276 1 1 1022 . 15 1 1 A 109 109 GLY HA3 H 109 4.290 4.069 0.221 1 1 1023 . 15 1 1 A 109 109 GLY C C 109 173.180 174.038 -0.858 1 1 1024 . 15 1 1 A 109 109 GLY CA C 109 45.340 45.192 0.148 1 1 1025 . 15 1 1 A 109 109 GLY N N 109 110.160 111.159 -0.999 1 1 1026 . 15 1 1 A 110 110 GLU H H 110 7.960 7.670 0.290 1 1 1027 . 15 1 1 A 110 110 GLU HA H 110 4.760 4.856 -0.096 1 1 1032 . 15 1 1 A 110 110 GLU CA C 110 53.450 53.320 0.130 1 1 1033 . 15 1 1 A 110 110 GLU CB C 110 30.020 30.346 -0.326 1 1 1035 . 15 1 1 A 110 110 GLU N N 110 119.720 120.889 -1.169 1 1 1036 . 15 1 1 A 111 111 PRO HA H 111 3.250 4.202 -0.952 1 1 1043 . 15 1 1 A 111 111 PRO C C 111 176.710 176.162 0.548 1 1 1044 . 15 1 1 A 111 111 PRO CA C 111 62.240 62.196 0.044 1 1 1045 . 15 1 1 A 111 111 PRO CB C 111 31.990 32.187 -0.197 1 1 1048 . 15 1 1 A 112 112 LEU H H 112 8.840 8.081 0.759 1 1 1049 . 15 1 1 A 112 112 LEU HA H 112 4.290 4.243 0.047 1 1 1059 . 15 1 1 A 112 112 LEU CA C 112 52.220 53.870 -1.650 1 1 1060 . 15 1 1 A 112 112 LEU CB C 112 41.090 42.025 -0.935 1 1 1063 . 15 1 1 A 112 112 LEU N N 112 122.420 121.878 0.542 1 1 1064 . 15 1 1 A 113 113 PRO HA H 113 4.380 4.223 0.157 1 1 1071 . 15 1 1 A 113 113 PRO C C 113 176.100 177.492 -1.392 1 1 1072 . 15 1 1 A 113 113 PRO CA C 113 61.930 65.151 -3.221 1 1 1073 . 15 1 1 A 113 113 PRO CB C 113 32.470 31.764 0.706 1 1 1076 . 15 1 1 A 114 114 ALA H H 114 8.070 7.827 0.243 1 1 1077 . 15 1 1 A 114 114 ALA HA H 114 4.550 3.979 0.571 1 1 1081 . 15 1 1 A 114 114 ALA C C 114 177.490 177.386 0.104 1 1 1082 . 15 1 1 A 114 114 ALA CA C 114 51.340 53.751 -2.411 1 1 1083 . 15 1 1 A 114 114 ALA CB C 114 19.940 18.189 1.751 1 1 1084 . 15 1 1 A 114 114 ALA N N 114 121.460 120.616 0.844 1 1 1085 . 15 1 1 A 115 115 LYS H H 115 9.000 8.652 0.348 1 1 1086 . 15 1 1 A 115 115 LYS HA H 115 3.930 3.949 -0.019 1 1 1095 . 15 1 1 A 115 115 LYS C C 115 175.740 175.186 0.554 1 1 1096 . 15 1 1 A 115 115 LYS CA C 115 57.580 57.761 -0.181 1 1 1097 . 15 1 1 A 115 115 LYS CB C 115 29.510 30.575 -1.065 1 1 1101 . 15 1 1 A 115 115 LYS N N 115 112.560 115.801 -3.241 1 1 1102 . 15 1 1 A 116 116 GLU H H 116 7.620 7.678 -0.058 1 1 1103 . 15 1 1 A 116 116 GLU HA H 116 4.550 4.945 -0.395 1 1 1108 . 15 1 1 A 116 116 GLU C C 116 176.110 175.186 0.924 1 1 1109 . 15 1 1 A 116 116 GLU CA C 116 54.570 54.312 0.258 1 1 1110 . 15 1 1 A 116 116 GLU CB C 116 33.680 33.620 0.060 1 1 1112 . 15 1 1 A 116 116 GLU N N 116 115.710 117.550 -1.840 1 1 1113 . 15 1 1 A 117 117 VAL H H 117 8.770 8.802 -0.032 1 1 1114 . 15 1 1 A 117 117 VAL HA H 117 3.200 4.047 -0.847 1 1 1122 . 15 1 1 A 117 117 VAL C C 117 175.740 175.850 -0.110 1 1 1123 . 15 1 1 A 117 117 VAL CA C 117 65.340 63.255 2.085 1 1 1124 . 15 1 1 A 117 117 VAL CB C 117 31.290 31.069 0.221 1 1 1127 . 15 1 1 A 117 117 VAL N N 117 124.450 120.287 4.163 1 1 1128 . 15 1 1 A 118 118 LEU H H 118 8.550 9.026 -0.476 1 1 1129 . 15 1 1 A 118 118 LEU HA H 118 4.540 4.464 0.076 1 1 1139 . 15 1 1 A 118 118 LEU C C 118 176.210 177.165 -0.955 1 1 1140 . 15 1 1 A 118 118 LEU CA C 118 55.510 55.783 -0.273 1 1 1141 . 15 1 1 A 118 118 LEU CB C 118 44.600 42.744 1.856 1 1 1145 . 15 1 1 A 118 118 LEU N N 118 128.440 128.710 -0.270 1 1 1146 . 15 1 1 A 119 119 ALA H H 119 7.970 7.755 0.215 1 1 1147 . 15 1 1 A 119 119 ALA HA H 119 4.740 4.861 -0.121 1 1 1151 . 15 1 1 A 119 119 ALA C C 119 174.570 175.526 -0.956 1 1 1152 . 15 1 1 A 119 119 ALA CA C 119 50.770 51.379 -0.609 1 1 1153 . 15 1 1 A 119 119 ALA CB C 119 22.450 22.577 -0.127 1 1 1154 . 15 1 1 A 119 119 ALA N N 119 118.100 118.038 0.062 1 1 1155 . 15 1 1 A 120 120 LYS H H 120 8.760 8.594 0.166 1 1 1156 . 15 1 1 A 120 120 LYS HA H 120 5.240 5.278 -0.038 1 1 1165 . 15 1 1 A 120 120 LYS C C 120 175.340 174.675 0.665 1 1 1166 . 15 1 1 A 120 120 LYS CA C 120 54.220 55.016 -0.796 1 1 1167 . 15 1 1 A 120 120 LYS CB C 120 34.340 34.083 0.257 1 1 1171 . 15 1 1 A 120 120 LYS N N 120 120.010 122.199 -2.189 1 1 1172 . 15 1 1 A 121 121 VAL H H 121 9.410 9.009 0.401 1 1 1173 . 15 1 1 A 121 121 VAL HA H 121 4.230 4.618 -0.388 1 1 1181 . 15 1 1 A 121 121 VAL C C 121 173.980 174.892 -0.912 1 1 1182 . 15 1 1 A 121 121 VAL CA C 121 62.370 61.485 0.885 1 1 1183 . 15 1 1 A 121 121 VAL CB C 121 32.410 33.044 -0.634 1 1 1186 . 15 1 1 A 121 121 VAL N N 121 124.960 125.766 -0.806 1 1 1187 . 15 1 1 A 122 122 VAL H H 122 9.280 8.353 0.927 1 1 1188 . 15 1 1 A 122 122 VAL HA H 122 4.360 4.681 -0.321 1 1 1196 . 15 1 1 A 122 122 VAL C C 122 174.190 175.179 -0.989 1 1 1197 . 15 1 1 A 122 122 VAL CA C 122 62.760 61.494 1.266 1 1 1198 . 15 1 1 A 122 122 VAL CB C 122 32.020 31.447 0.573 1 1 1201 . 15 1 1 A 122 122 VAL N N 122 128.990 126.370 2.620 1 1 1202 . 15 1 1 A 123 123 LEU H H 123 8.610 8.141 0.469 1 1 1203 . 15 1 1 A 123 123 LEU HA H 123 4.900 4.414 0.486 1 1 1213 . 15 1 1 A 123 123 LEU C C 123 174.950 176.514 -1.564 1 1 1214 . 15 1 1 A 123 123 LEU CA C 123 52.050 54.003 -1.953 1 1 1215 . 15 1 1 A 123 123 LEU CB C 123 45.210 40.901 4.309 1 1 1219 . 15 1 1 A 123 123 LEU N N 123 127.200 128.863 -1.663 1 1 1220 . 15 1 1 A 124 124 ARG H H 124 9.540 8.870 0.670 1 1 1221 . 15 1 1 A 124 124 ARG HA H 124 4.900 4.386 0.514 1 1 1229 . 15 1 1 A 124 124 ARG C C 124 176.320 175.791 0.529 1 1 1230 . 15 1 1 A 124 124 ARG CA C 124 55.320 57.086 -1.766 1 1 1231 . 15 1 1 A 124 124 ARG CB C 124 31.750 30.640 1.110 1 1 1234 . 15 1 1 A 124 124 ARG N N 124 124.290 125.951 -1.661 1 1 1236 . 15 1 1 A 125 125 ALA H H 125 8.880 8.564 0.316 1 1 1237 . 15 1 1 A 125 125 ALA HA H 125 4.380 4.139 0.241 1 1 1241 . 15 1 1 A 125 125 ALA C C 125 177.290 177.787 -0.497 1 1 1242 . 15 1 1 A 125 125 ALA CA C 125 52.530 51.423 1.107 1 1 1243 . 15 1 1 A 125 125 ALA CB C 125 19.870 17.211 2.659 1 1 1244 . 15 1 1 A 125 125 ALA N N 125 130.790 129.972 0.818 1 1 1245 . 15 1 1 A 126 126 GLU H H 126 9.260 8.852 0.408 1 1 1246 . 15 1 1 A 126 126 GLU HA H 126 4.460 4.500 -0.040 1 1 1251 . 15 1 1 A 126 126 GLU C C 126 176.120 176.006 0.114 1 1 1252 . 15 1 1 A 126 126 GLU CA C 126 56.940 57.611 -0.671 1 1 1253 . 15 1 1 A 126 126 GLU CB C 126 32.450 30.405 2.045 1 1 1255 . 15 1 1 A 126 126 GLU N N 126 125.740 122.665 3.075 1 1 1256 . 15 1 1 A 127 127 ALA H H 127 7.460 7.491 -0.031 1 1 1257 . 15 1 1 A 127 127 ALA HA H 127 4.360 4.604 -0.244 1 1 1261 . 15 1 1 A 127 127 ALA C C 127 173.400 175.790 -2.390 1 1 1262 . 15 1 1 A 127 127 ALA CA C 127 51.360 51.633 -0.273 1 1 1263 . 15 1 1 A 127 127 ALA CB C 127 22.180 22.137 0.043 1 1 1264 . 15 1 1 A 127 127 ALA N N 127 120.910 120.423 0.487 1 1 1265 . 15 1 1 A 128 128 LYS H H 128 7.940 8.657 -0.717 1 1 1266 . 15 1 1 A 128 128 LYS HA H 128 3.580 4.132 -0.552 1 1 1275 . 15 1 1 A 128 128 LYS C C 128 176.080 175.689 0.391 1 1 1276 . 15 1 1 A 128 128 LYS CA C 128 56.860 56.934 -0.074 1 1 1277 . 15 1 1 A 128 128 LYS CB C 128 33.170 33.169 0.001 1 1 1281 . 15 1 1 A 128 128 LYS N N 128 116.520 124.329 -7.809 1 1 1282 . 15 1 1 A 129 129 ALA H H 129 8.590 8.675 -0.085 1 1 1283 . 15 1 1 A 129 129 ALA HA H 129 4.390 4.652 -0.262 1 1 1287 . 15 1 1 A 129 129 ALA C C 129 174.970 176.449 -1.479 1 1 1288 . 15 1 1 A 129 129 ALA CA C 129 52.970 51.339 1.631 1 1 1289 . 15 1 1 A 129 129 ALA CB C 129 21.500 18.784 2.716 1 1 1290 . 15 1 1 A 129 129 ALA N N 129 124.710 127.758 -3.048 1 1 1291 . 15 1 1 A 130 130 GLU H H 130 8.660 8.220 0.440 1 1 1292 . 15 1 1 A 130 130 GLU HA H 130 4.660 3.946 0.714 1 1 1297 . 15 1 1 A 130 130 GLU C C 130 177.390 177.519 -0.129 1 1 1298 . 15 1 1 A 130 130 GLU CA C 130 55.070 58.455 -3.385 1 1 1299 . 15 1 1 A 130 130 GLU CB C 130 30.860 29.247 1.613 1 1 1301 . 15 1 1 A 130 130 GLU N N 130 123.180 122.751 0.429 1 1 1302 . 15 1 1 A 131 131 GLY H H 131 9.170 9.128 0.042 1 1 1303 . 15 1 1 A 131 131 GLY HA2 H 131 3.560 3.993 -0.433 1 1 1304 . 15 1 1 A 131 131 GLY HA3 H 131 3.750 4.001 -0.251 1 1 1305 . 15 1 1 A 131 131 GLY C C 131 174.550 174.597 -0.047 1 1 1306 . 15 1 1 A 131 131 GLY CA C 131 47.660 45.510 2.150 1 1 1307 . 15 1 1 A 131 131 GLY N N 131 115.530 115.912 -0.382 1 1 1308 . 15 1 1 A 132 132 SER H H 132 8.430 8.212 0.218 1 1 1309 . 15 1 1 A 132 132 SER HA H 132 4.170 4.640 -0.470 1 1 1312 . 15 1 1 A 132 132 SER C C 132 175.350 174.363 0.987 1 1 1313 . 15 1 1 A 132 132 SER CA C 132 59.050 57.581 1.469 1 1 1314 . 15 1 1 A 132 132 SER CB C 132 64.880 61.914 2.966 1 1 1315 . 15 1 1 A 132 132 SER N N 132 115.930 118.941 -3.011 1 1 1316 . 15 1 1 A 133 133 ASN H H 133 8.850 9.071 -0.221 1 1 1317 . 15 1 1 A 133 133 ASN HA H 133 4.910 5.175 -0.265 1 1 1322 . 15 1 1 A 133 133 ASN C C 133 175.450 174.651 0.799 1 1 1323 . 15 1 1 A 133 133 ASN CA C 133 54.920 54.104 0.816 1 1 1324 . 15 1 1 A 133 133 ASN CB C 133 41.060 39.076 1.984 1 1 1325 . 15 1 1 A 133 133 ASN N N 133 125.590 121.972 3.618 1 1 1327 . 15 1 1 A 134 134 LEU H H 134 9.070 9.516 -0.446 1 1 1328 . 15 1 1 A 134 134 LEU HA H 134 5.230 5.240 -0.010 1 1 1338 . 15 1 1 A 134 134 LEU C C 134 175.240 175.528 -0.288 1 1 1339 . 15 1 1 A 134 134 LEU CA C 134 53.470 53.587 -0.117 1 1 1340 . 15 1 1 A 134 134 LEU CB C 134 45.090 45.022 0.068 1 1 1344 . 15 1 1 A 134 134 LEU N N 134 129.210 124.888 4.322 1 1 1345 . 15 1 1 A 135 135 SER H H 135 8.690 9.045 -0.355 1 1 1346 . 15 1 1 A 135 135 SER HA H 135 5.280 5.432 -0.152 1 1 1349 . 15 1 1 A 135 135 SER C C 135 173.590 173.417 0.173 1 1 1350 . 15 1 1 A 135 135 SER CA C 135 56.220 56.620 -0.400 1 1 1351 . 15 1 1 A 135 135 SER CB C 135 66.510 65.323 1.187 1 1 1352 . 15 1 1 A 135 135 SER N N 135 113.020 119.238 -6.218 1 1 1353 . 15 1 1 A 136 136 VAL H H 136 8.940 8.683 0.257 1 1 1354 . 15 1 1 A 136 136 VAL HA H 136 5.500 4.485 1.015 1 1 1362 . 15 1 1 A 136 136 VAL C C 136 175.730 175.642 0.088 1 1 1363 . 15 1 1 A 136 136 VAL CA C 136 60.960 61.606 -0.646 1 1 1364 . 15 1 1 A 136 136 VAL CB C 136 33.630 31.500 2.130 1 1 1367 . 15 1 1 A 136 136 VAL N N 136 124.340 126.204 -1.864 1 1 1368 . 15 1 1 A 137 137 THR H H 137 9.240 8.502 0.738 1 1 1369 . 15 1 1 A 137 137 THR HA H 137 4.920 4.777 0.143 1 1 1374 . 15 1 1 A 137 137 THR C C 137 173.500 174.081 -0.581 1 1 1375 . 15 1 1 A 137 137 THR CA C 137 59.120 60.276 -1.156 1 1 1376 . 15 1 1 A 137 137 THR CB C 137 72.500 70.624 1.876 1 1 1378 . 15 1 1 A 137 137 THR N N 137 117.010 118.897 -1.887 1 1 1379 . 15 1 1 A 138 138 ASN H H 138 9.190 8.831 0.359 1 1 1380 . 15 1 1 A 138 138 ASN HA H 138 4.420 4.271 0.149 1 1 1385 . 15 1 1 A 138 138 ASN C C 138 175.550 174.339 1.211 1 1 1386 . 15 1 1 A 138 138 ASN CA C 138 54.350 54.263 0.087 1 1 1387 . 15 1 1 A 138 138 ASN CB C 138 37.380 36.810 0.570 1 1 1388 . 15 1 1 A 138 138 ASN N N 138 115.270 118.781 -3.511 1 1 1390 . 15 1 1 A 139 139 SER H H 139 8.560 7.945 0.615 1 1 1391 . 15 1 1 A 139 139 SER HA H 139 5.800 4.395 1.405 1 1 1394 . 15 1 1 A 139 139 SER C C 139 175.750 174.307 1.443 1 1 1395 . 15 1 1 A 139 139 SER CA C 139 56.020 60.382 -4.362 1 1 1396 . 15 1 1 A 139 139 SER CB C 139 65.320 63.802 1.518 1 1 1397 . 15 1 1 A 139 139 SER N N 139 112.360 114.969 -2.609 1 1 1398 . 15 1 1 A 140 140 SER H H 140 9.900 8.467 1.433 1 1 1399 . 15 1 1 A 140 140 SER HA H 140 5.360 5.399 -0.039 1 1 1402 . 15 1 1 A 140 140 SER C C 140 172.620 172.878 -0.258 1 1 1403 . 15 1 1 A 140 140 SER CA C 140 57.400 56.999 0.401 1 1 1404 . 15 1 1 A 140 140 SER CB C 140 66.550 65.914 0.636 1 1 1405 . 15 1 1 A 140 140 SER N N 140 119.130 122.823 -3.693 1 1 1406 . 15 1 1 A 141 141 VAL H H 141 9.030 8.849 0.181 1 1 1407 . 15 1 1 A 141 141 VAL HA H 141 5.520 5.043 0.477 1 1 1415 . 15 1 1 A 141 141 VAL C C 141 174.750 174.640 0.110 1 1 1416 . 15 1 1 A 141 141 VAL CA C 141 58.310 60.027 -1.717 1 1 1417 . 15 1 1 A 141 141 VAL CB C 141 35.030 35.535 -0.505 1 1 1420 . 15 1 1 A 141 141 VAL N N 141 111.410 117.483 -6.073 1 1 1421 . 15 1 1 A 142 142 GLY H H 142 8.790 9.180 -0.390 1 1 1422 . 15 1 1 A 142 142 GLY HA2 H 142 3.600 4.096 -0.496 1 1 1423 . 15 1 1 A 142 142 GLY HA3 H 142 5.310 4.118 1.192 1 1 1424 . 15 1 1 A 142 142 GLY C C 142 174.180 174.119 0.061 1 1 1425 . 15 1 1 A 142 142 GLY CA C 142 44.110 45.603 -1.493 1 1 1426 . 15 1 1 A 142 142 GLY N N 142 109.330 111.399 -2.069 1 1 1427 . 15 1 1 A 143 143 ASP H H 143 8.840 8.784 0.056 1 1 1428 . 15 1 1 A 143 143 ASP HA H 143 5.790 4.871 0.919 1 1 1431 . 15 1 1 A 143 143 ASP C C 143 178.860 178.052 0.808 1 1 1432 . 15 1 1 A 143 143 ASP CA C 143 53.040 53.011 0.029 1 1 1433 . 15 1 1 A 143 143 ASP CB C 143 43.660 41.701 1.959 1 1 1434 . 15 1 1 A 143 143 ASP N N 143 125.390 126.481 -1.091 1 1 1435 . 15 1 1 A 144 144 GLY H H 144 9.150 8.658 0.492 1 1 1436 . 15 1 1 A 144 144 GLY HA2 H 144 3.450 4.103 -0.653 1 1 1437 . 15 1 1 A 144 144 GLY HA3 H 144 3.720 4.210 -0.490 1 1 1438 . 15 1 1 A 144 144 GLY C C 144 174.770 174.877 -0.107 1 1 1439 . 15 1 1 A 144 144 GLY CA C 144 46.930 45.699 1.231 1 1 1440 . 15 1 1 A 144 144 GLY N N 144 106.470 108.009 -1.539 1 1 1441 . 15 1 1 A 145 145 GLU H H 145 8.470 7.825 0.645 1 1 1442 . 15 1 1 A 145 145 GLU HA H 145 4.460 4.489 -0.029 1 1 1447 . 15 1 1 A 145 145 GLU C C 145 176.520 176.925 -0.405 1 1 1448 . 15 1 1 A 145 145 GLU CA C 145 55.330 55.821 -0.491 1 1 1449 . 15 1 1 A 145 145 GLU CB C 145 30.620 31.958 -1.338 1 1 1451 . 15 1 1 A 145 145 GLU N N 145 119.170 117.307 1.863 1 1 1452 . 15 1 1 A 146 146 GLY H H 146 7.950 8.195 -0.245 1 1 1453 . 15 1 1 A 146 146 GLY HA2 H 146 3.630 4.021 -0.391 1 1 1454 . 15 1 1 A 146 146 GLY HA3 H 146 4.130 4.022 0.108 1 1 1455 . 15 1 1 A 146 146 GLY C C 146 174.350 174.568 -0.218 1 1 1456 . 15 1 1 A 146 146 GLY CA C 146 45.330 45.213 0.117 1 1 1457 . 15 1 1 A 146 146 GLY N N 146 108.130 108.825 -0.695 1 1 1458 . 15 1 1 A 147 147 LEU H H 147 8.440 7.785 0.655 1 1 1459 . 15 1 1 A 147 147 LEU HA H 147 4.340 4.637 -0.297 1 1 1469 . 15 1 1 A 147 147 LEU C C 147 175.950 175.674 0.276 1 1 1470 . 15 1 1 A 147 147 LEU CA C 147 54.860 54.035 0.825 1 1 1471 . 15 1 1 A 147 147 LEU CB C 147 41.590 42.480 -0.890 1 1 1475 . 15 1 1 A 147 147 LEU N N 147 124.000 121.991 2.009 1 1 1476 . 15 1 1 A 148 148 VAL H H 148 7.780 8.572 -0.792 1 1 1477 . 15 1 1 A 148 148 VAL HA H 148 4.830 5.441 -0.611 1 1 1485 . 15 1 1 A 148 148 VAL C C 148 175.740 173.581 2.159 1 1 1486 . 15 1 1 A 148 148 VAL CA C 148 61.140 59.813 1.327 1 1 1487 . 15 1 1 A 148 148 VAL CB C 148 33.640 34.414 -0.774 1 1 1490 . 15 1 1 A 148 148 VAL N N 148 120.440 120.367 0.073 1 1 1491 . 15 1 1 A 149 149 HIS H H 149 9.170 8.990 0.180 1 1 1492 . 15 1 1 A 149 149 HIS HA H 149 4.950 4.894 0.056 1 1 1496 . 15 1 1 A 149 149 HIS C C 149 174.780 174.967 -0.187 1 1 1497 . 15 1 1 A 149 149 HIS CA C 149 53.900 55.090 -1.190 1 1 1498 . 15 1 1 A 149 149 HIS CB C 149 32.200 28.827 3.373 1 1 1499 . 15 1 1 A 149 149 HIS N N 149 124.700 128.256 -3.556 1 1 1500 . 15 1 1 A 150 150 GLU H H 150 9.060 8.547 0.513 1 1 1501 . 15 1 1 A 150 150 GLU HA H 150 4.420 4.234 0.186 1 1 1506 . 15 1 1 A 150 150 GLU C C 150 176.520 176.793 -0.273 1 1 1507 . 15 1 1 A 150 150 GLU CA C 150 57.630 57.078 0.552 1 1 1508 . 15 1 1 A 150 150 GLU CB C 150 30.370 29.910 0.460 1 1 1510 . 15 1 1 A 150 150 GLU N N 150 125.540 123.849 1.691 1 1 1511 . 15 1 1 A 151 151 ILE H H 151 8.150 8.346 -0.196 1 1 1512 . 15 1 1 A 151 151 ILE HA H 151 4.780 4.528 0.252 1 1 1522 . 15 1 1 A 151 151 ILE C C 151 174.570 176.357 -1.787 1 1 1523 . 15 1 1 A 151 151 ILE CA C 151 59.390 59.575 -0.185 1 1 1524 . 15 1 1 A 151 151 ILE CB C 151 42.040 39.185 2.855 1 1 1528 . 15 1 1 A 151 151 ILE N N 151 115.880 123.246 -7.366 1 1 1529 . 15 1 1 A 152 152 ALA H H 152 8.010 8.446 -0.436 1 1 1530 . 15 1 1 A 152 152 ALA HA H 152 4.310 4.431 -0.121 1 1 1534 . 15 1 1 A 152 152 ALA C C 152 177.500 176.757 0.743 1 1 1535 . 15 1 1 A 152 152 ALA CA C 152 53.680 51.541 2.139 1 1 1536 . 15 1 1 A 152 152 ALA CB C 152 20.050 19.710 0.340 1 1 1537 . 15 1 1 A 152 152 ALA N N 152 126.640 124.312 2.328 1 1 1538 . 15 1 1 A 153 153 GLY H H 153 8.340 8.359 -0.019 1 1 1539 . 15 1 1 A 153 153 GLY HA2 H 153 4.050 4.319 -0.269 1 1 1540 . 15 1 1 A 153 153 GLY HA3 H 153 4.140 4.319 -0.179 1 1 1541 . 15 1 1 A 153 153 GLY C C 153 173.140 171.488 1.652 1 1 1542 . 15 1 1 A 153 153 GLY CA C 153 44.130 46.199 -2.069 1 1 1543 . 15 1 1 A 153 153 GLY N N 153 107.490 105.430 2.060 1 1 1544 . 15 1 1 A 154 154 THR H H 154 7.380 8.312 -0.932 1 1 1545 . 15 1 1 A 154 154 THR HA H 154 4.700 5.110 -0.410 1 1 1550 . 15 1 1 A 154 154 THR C C 154 171.120 172.902 -1.782 1 1 1551 . 15 1 1 A 154 154 THR CA C 154 60.830 60.959 -0.129 1 1 1552 . 15 1 1 A 154 154 THR CB C 154 68.850 72.240 -3.390 1 1 1554 . 15 1 1 A 154 154 THR N N 154 109.340 113.881 -4.541 1 1 1555 . 15 1 1 A 155 155 GLU H H 155 8.020 8.865 -0.845 1 1 1556 . 15 1 1 A 155 155 GLU HA H 155 5.370 5.572 -0.202 1 1 1561 . 15 1 1 A 155 155 GLU C C 155 174.240 174.718 -0.478 1 1 1562 . 15 1 1 A 155 155 GLU CA C 155 54.830 54.627 0.203 1 1 1563 . 15 1 1 A 155 155 GLU CB C 155 33.620 33.053 0.567 1 1 1565 . 15 1 1 A 155 155 GLU N N 155 118.690 125.469 -6.779 1 1 1566 . 15 1 1 A 156 156 LYS H H 156 9.230 9.378 -0.148 1 1 1567 . 15 1 1 A 156 156 LYS HA H 156 4.650 5.111 -0.461 1 1 1576 . 15 1 1 A 156 156 LYS C C 156 174.000 174.505 -0.505 1 1 1577 . 15 1 1 A 156 156 LYS CA C 156 55.840 55.201 0.639 1 1 1578 . 15 1 1 A 156 156 LYS CB C 156 37.550 36.584 0.966 1 1 1582 . 15 1 1 A 156 156 LYS N N 156 121.940 124.093 -2.153 1 1 1583 . 15 1 1 A 157 157 THR H H 157 8.160 8.702 -0.542 1 1 1584 . 15 1 1 A 157 157 THR HA H 157 5.440 5.150 0.290 1 1 1589 . 15 1 1 A 157 157 THR C C 157 174.360 173.446 0.914 1 1 1590 . 15 1 1 A 157 157 THR CA C 157 60.410 60.725 -0.315 1 1 1591 . 15 1 1 A 157 157 THR CB C 157 71.500 71.215 0.285 1 1 1593 . 15 1 1 A 157 157 THR N N 157 113.240 112.935 0.305 1 1 1594 . 15 1 1 A 158 158 VAL H H 158 9.120 9.095 0.025 1 1 1595 . 15 1 1 A 158 158 VAL HA H 158 4.580 5.368 -0.788 1 1 1603 . 15 1 1 A 158 158 VAL C C 158 172.800 174.644 -1.844 1 1 1604 . 15 1 1 A 158 158 VAL CA C 158 59.980 60.418 -0.438 1 1 1605 . 15 1 1 A 158 158 VAL CB C 158 36.290 34.217 2.073 1 1 1608 . 15 1 1 A 158 158 VAL N N 158 121.710 122.284 -0.574 1 1 1609 . 15 1 1 A 159 159 ASN H H 159 8.240 8.646 -0.406 1 1 1610 . 15 1 1 A 159 159 ASN HA H 159 5.420 5.048 0.372 1 1 1615 . 15 1 1 A 159 159 ASN C C 159 173.800 174.279 -0.479 1 1 1616 . 15 1 1 A 159 159 ASN CA C 159 51.740 52.504 -0.764 1 1 1617 . 15 1 1 A 159 159 ASN CB C 159 40.380 39.405 0.975 1 1 1618 . 15 1 1 A 159 159 ASN N N 159 122.730 124.996 -2.266 1 1 1620 . 15 1 1 A 160 160 ILE H H 160 9.160 8.638 0.522 1 1 1621 . 15 1 1 A 160 160 ILE HA H 160 5.130 4.878 0.252 1 1 1631 . 15 1 1 A 160 160 ILE C C 160 177.320 175.678 1.642 1 1 1632 . 15 1 1 A 160 160 ILE CA C 160 60.640 60.770 -0.130 1 1 1633 . 15 1 1 A 160 160 ILE CB C 160 38.520 37.510 1.010 1 1 1637 . 15 1 1 A 160 160 ILE N N 160 123.690 125.817 -2.127 1 1 1638 . 15 1 1 A 161 161 ILE H H 161 8.780 8.861 -0.081 1 1 1639 . 15 1 1 A 161 161 ILE HA H 161 4.590 4.486 0.104 1 1 1649 . 15 1 1 A 161 161 ILE C C 161 174.960 175.852 -0.892 1 1 1650 . 15 1 1 A 161 161 ILE CA C 161 59.320 60.575 -1.255 1 1 1651 . 15 1 1 A 161 161 ILE CB C 161 41.030 38.888 2.142 1 1 1655 . 15 1 1 A 161 161 ILE N N 161 122.490 128.662 -6.172 1 1 1656 . 15 1 1 A 162 162 GLU H H 162 8.620 8.531 0.089 1 1 1657 . 15 1 1 A 162 162 GLU HA H 162 4.290 4.319 -0.029 1 1 1662 . 15 1 1 A 162 162 GLU C C 162 176.660 176.230 0.430 1 1 1663 . 15 1 1 A 162 162 GLU CA C 162 56.470 57.619 -1.149 1 1 1664 . 15 1 1 A 162 162 GLU CB C 162 31.150 30.194 0.956 1 1 1666 . 15 1 1 A 162 162 GLU N N 162 120.520 127.429 -6.909 1 1 1667 . 15 1 1 A 163 163 GLY H H 163 8.480 8.515 -0.035 1 1 1668 . 15 1 1 A 163 163 GLY HA2 H 163 3.910 4.173 -0.263 1 1 1669 . 15 1 1 A 163 163 GLY HA3 H 163 4.150 4.174 -0.024 1 1 1670 . 15 1 1 A 163 163 GLY C C 163 174.000 171.783 2.217 1 1 1671 . 15 1 1 A 163 163 GLY CA C 163 45.270 45.008 0.262 1 1 1672 . 15 1 1 A 163 163 GLY N N 163 110.210 109.183 1.027 1 1 1673 . 15 1 1 A 164 164 THR H H 164 8.170 9.018 -0.848 1 1 1674 . 15 1 1 A 164 164 THR HA H 164 4.410 4.797 -0.387 1 1 1679 . 15 1 1 A 164 164 THR C C 164 174.100 174.338 -0.238 1 1 1680 . 15 1 1 A 164 164 THR CA C 164 61.620 61.392 0.228 1 1 1681 . 15 1 1 A 164 164 THR CB C 164 70.060 70.692 -0.632 1 1 1683 . 15 1 1 A 164 164 THR N N 164 113.480 121.022 -7.542 1 1 1 . 16 1 1 A 13 13 GLY H H 13 8.350 8.283 0.067 1 1 2 . 16 1 1 A 13 13 GLY HA2 H 13 3.920 4.200 -0.280 1 1 3 . 16 1 1 A 13 13 GLY HA3 H 13 3.920 4.201 -0.281 1 1 4 . 16 1 1 A 13 13 GLY CA C 13 45.290 45.052 0.238 1 1 5 . 16 1 1 A 13 13 GLY N N 13 110.450 109.477 0.973 1 1 6 . 16 1 1 A 14 14 LEU H H 14 8.050 8.451 -0.401 1 1 7 . 16 1 1 A 14 14 LEU N N 14 121.500 121.905 -0.405 1 1 8 . 16 1 1 A 15 15 VAL H H 15 8.070 8.713 -0.643 1 1 9 . 16 1 1 A 15 15 VAL N N 15 122.390 120.388 2.002 1 1 10 . 16 1 1 A 16 16 PRO HA H 16 4.360 4.444 -0.084 1 1 17 . 16 1 1 A 16 16 PRO CA C 16 62.770 63.206 -0.436 1 1 18 . 16 1 1 A 16 16 PRO CB C 16 32.020 32.026 -0.006 1 1 21 . 16 1 1 A 21 21 MET H H 21 8.180 8.807 -0.627 1 1 22 . 16 1 1 A 21 21 MET N N 21 121.310 124.173 -2.863 1 1 23 . 16 1 1 A 22 22 ALA H H 22 8.290 7.673 0.617 1 1 24 . 16 1 1 A 22 22 ALA N N 22 124.800 119.491 5.309 1 1 25 . 16 1 1 A 23 23 SER H H 23 8.210 8.799 -0.589 1 1 26 . 16 1 1 A 23 23 SER N N 23 114.830 116.520 -1.690 1 1 27 . 16 1 1 A 24 24 LYS H H 24 8.250 8.084 0.166 1 1 28 . 16 1 1 A 24 24 LYS N N 24 122.980 119.675 3.305 1 1 29 . 16 1 1 A 25 25 LEU H H 25 8.140 8.727 -0.587 1 1 30 . 16 1 1 A 25 25 LEU HA H 25 4.290 4.135 0.155 1 1 40 . 16 1 1 A 25 25 LEU C C 25 177.410 175.889 1.521 1 1 41 . 16 1 1 A 25 25 LEU CA C 25 55.430 57.075 -1.645 1 1 42 . 16 1 1 A 25 25 LEU CB C 25 42.350 40.845 1.505 1 1 46 . 16 1 1 A 25 25 LEU N N 25 122.580 119.012 3.568 1 1 47 . 16 1 1 A 26 26 LYS H H 26 8.200 8.458 -0.258 1 1 48 . 16 1 1 A 26 26 LYS HA H 26 4.260 4.462 -0.202 1 1 57 . 16 1 1 A 26 26 LYS C C 26 176.520 175.685 0.835 1 1 58 . 16 1 1 A 26 26 LYS CA C 26 56.700 54.993 1.707 1 1 59 . 16 1 1 A 26 26 LYS CB C 26 33.060 32.380 0.680 1 1 63 . 16 1 1 A 26 26 LYS N N 26 121.800 122.282 -0.482 1 1 64 . 16 1 1 A 27 27 GLU H H 27 8.380 8.460 -0.080 1 1 65 . 16 1 1 A 27 27 GLU HA H 27 4.240 4.466 -0.226 1 1 70 . 16 1 1 A 27 27 GLU C C 27 176.130 175.827 0.303 1 1 71 . 16 1 1 A 27 27 GLU CA C 27 56.700 56.748 -0.048 1 1 72 . 16 1 1 A 27 27 GLU CB C 27 30.370 30.964 -0.594 1 1 74 . 16 1 1 A 27 27 GLU N N 27 121.700 125.887 -4.187 1 1 75 . 16 1 1 A 28 28 ALA H H 28 8.230 8.518 -0.288 1 1 76 . 16 1 1 A 28 28 ALA HA H 28 4.280 4.789 -0.509 1 1 80 . 16 1 1 A 28 28 ALA C C 28 177.090 175.463 1.627 1 1 81 . 16 1 1 A 28 28 ALA CA C 28 52.530 51.568 0.962 1 1 82 . 16 1 1 A 28 28 ALA CB C 28 19.360 22.352 -2.992 1 1 83 . 16 1 1 A 28 28 ALA N N 28 124.640 121.990 2.650 1 1 84 . 16 1 1 A 29 29 ALA H H 29 8.150 8.382 -0.232 1 1 85 . 16 1 1 A 29 29 ALA HA H 29 4.320 4.794 -0.474 1 1 89 . 16 1 1 A 29 29 ALA C C 29 177.120 175.705 1.415 1 1 90 . 16 1 1 A 29 29 ALA CA C 29 52.040 52.002 0.038 1 1 91 . 16 1 1 A 29 29 ALA CB C 29 19.430 19.133 0.297 1 1 92 . 16 1 1 A 29 29 ALA N N 29 123.430 119.498 3.932 1 1 93 . 16 1 1 A 30 30 GLU H H 30 8.310 8.746 -0.436 1 1 94 . 16 1 1 A 30 30 GLU HA H 30 4.220 4.601 -0.381 1 1 99 . 16 1 1 A 30 30 GLU C C 30 176.310 176.774 -0.464 1 1 100 . 16 1 1 A 30 30 GLU CA C 30 56.630 56.344 0.286 1 1 101 . 16 1 1 A 30 30 GLU CB C 30 30.320 30.364 -0.044 1 1 103 . 16 1 1 A 30 30 GLU N N 30 120.630 121.943 -1.313 1 1 104 . 16 1 1 A 31 31 VAL H H 31 8.630 8.749 -0.119 1 1 105 . 16 1 1 A 31 31 VAL HA H 31 4.430 4.730 -0.300 1 1 113 . 16 1 1 A 31 31 VAL C C 31 176.510 176.267 0.243 1 1 114 . 16 1 1 A 31 31 VAL CA C 31 62.360 63.283 -0.923 1 1 115 . 16 1 1 A 31 31 VAL CB C 31 32.370 31.686 0.684 1 1 118 . 16 1 1 A 31 31 VAL N N 31 127.110 124.433 2.677 1 1 119 . 16 1 1 A 32 32 THR H H 32 7.640 8.567 -0.927 1 1 120 . 16 1 1 A 32 32 THR HA H 32 4.870 3.993 0.877 1 1 125 . 16 1 1 A 32 32 THR C C 32 172.220 174.766 -2.546 1 1 126 . 16 1 1 A 32 32 THR CA C 32 59.510 64.772 -5.262 1 1 127 . 16 1 1 A 32 32 THR CB C 32 71.630 69.943 1.687 1 1 129 . 16 1 1 A 32 32 THR N N 32 118.860 121.064 -2.204 1 1 130 . 16 1 1 A 33 33 GLY H H 33 8.350 7.977 0.373 1 1 131 . 16 1 1 A 33 33 GLY HA2 H 33 4.160 4.061 0.099 1 1 132 . 16 1 1 A 33 33 GLY HA3 H 33 4.250 4.063 0.187 1 1 133 . 16 1 1 A 33 33 GLY C C 33 172.820 172.967 -0.147 1 1 134 . 16 1 1 A 33 33 GLY CA C 33 46.680 44.939 1.741 1 1 135 . 16 1 1 A 33 33 GLY N N 33 106.720 108.754 -2.034 1 1 136 . 16 1 1 A 34 34 SER H H 34 8.810 8.095 0.715 1 1 137 . 16 1 1 A 34 34 SER HA H 34 5.390 4.880 0.510 1 1 140 . 16 1 1 A 34 34 SER C C 34 173.780 172.840 0.940 1 1 141 . 16 1 1 A 34 34 SER CA C 34 57.380 57.533 -0.153 1 1 142 . 16 1 1 A 34 34 SER CB C 34 65.730 65.847 -0.117 1 1 143 . 16 1 1 A 34 34 SER N N 34 112.690 119.583 -6.893 1 1 144 . 16 1 1 A 35 35 VAL H H 35 8.470 8.733 -0.263 1 1 145 . 16 1 1 A 35 35 VAL HA H 35 4.120 4.729 -0.609 1 1 153 . 16 1 1 A 35 35 VAL C C 35 174.750 174.258 0.492 1 1 154 . 16 1 1 A 35 35 VAL CA C 35 62.310 60.943 1.367 1 1 155 . 16 1 1 A 35 35 VAL CB C 35 34.550 33.203 1.347 1 1 158 . 16 1 1 A 35 35 VAL N N 35 123.150 122.420 0.730 1 1 159 . 16 1 1 A 36 36 SER H H 36 8.240 8.986 -0.746 1 1 160 . 16 1 1 A 36 36 SER HA H 36 4.690 4.735 -0.045 1 1 163 . 16 1 1 A 36 36 SER C C 36 171.860 172.936 -1.076 1 1 164 . 16 1 1 A 36 36 SER CA C 36 56.020 56.568 -0.548 1 1 165 . 16 1 1 A 36 36 SER CB C 36 66.050 64.074 1.976 1 1 166 . 16 1 1 A 36 36 SER N N 36 118.760 121.363 -2.603 1 1 167 . 16 1 1 A 37 37 LEU H H 37 8.310 8.935 -0.625 1 1 168 . 16 1 1 A 37 37 LEU HA H 37 4.870 4.883 -0.013 1 1 178 . 16 1 1 A 37 37 LEU C C 37 174.190 175.643 -1.453 1 1 179 . 16 1 1 A 37 37 LEU CA C 37 53.870 53.692 0.178 1 1 180 . 16 1 1 A 37 37 LEU CB C 37 47.000 42.496 4.504 1 1 184 . 16 1 1 A 37 37 LEU N N 37 124.790 128.463 -3.673 1 1 185 . 16 1 1 A 38 38 GLU H H 38 9.270 8.841 0.429 1 1 186 . 16 1 1 A 38 38 GLU HA H 38 4.650 4.971 -0.321 1 1 191 . 16 1 1 A 38 38 GLU C C 38 173.970 175.212 -1.242 1 1 192 . 16 1 1 A 38 38 GLU CA C 38 54.410 55.841 -1.431 1 1 193 . 16 1 1 A 38 38 GLU CB C 38 32.460 32.091 0.369 1 1 195 . 16 1 1 A 38 38 GLU N N 38 126.550 127.105 -0.555 1 1 196 . 16 1 1 A 39 39 ALA H H 39 8.120 8.503 -0.383 1 1 197 . 16 1 1 A 39 39 ALA HA H 39 4.600 4.641 -0.041 1 1 201 . 16 1 1 A 39 39 ALA C C 39 175.930 177.417 -1.487 1 1 202 . 16 1 1 A 39 39 ALA CA C 39 51.570 50.626 0.944 1 1 203 . 16 1 1 A 39 39 ALA CB C 39 21.780 22.929 -1.149 1 1 204 . 16 1 1 A 39 39 ALA N N 39 124.410 128.857 -4.447 1 1 205 . 16 1 1 A 40 40 LEU H H 40 7.860 8.934 -1.074 1 1 206 . 16 1 1 A 40 40 LEU HA H 40 4.230 4.017 0.213 1 1 216 . 16 1 1 A 40 40 LEU C C 40 175.940 176.652 -0.712 1 1 217 . 16 1 1 A 40 40 LEU CA C 40 55.360 58.206 -2.846 1 1 218 . 16 1 1 A 40 40 LEU CB C 40 42.990 42.297 0.693 1 1 222 . 16 1 1 A 40 40 LEU N N 40 120.640 122.348 -1.708 1 1 223 . 16 1 1 A 41 41 GLU H H 41 8.210 7.874 0.336 1 1 224 . 16 1 1 A 41 41 GLU HA H 41 4.240 4.020 0.220 1 1 229 . 16 1 1 A 41 41 GLU C C 41 176.920 175.050 1.870 1 1 230 . 16 1 1 A 41 41 GLU CA C 41 58.090 57.680 0.410 1 1 231 . 16 1 1 A 41 41 GLU CB C 41 30.530 27.147 3.383 1 1 233 . 16 1 1 A 41 41 GLU N N 41 114.680 117.593 -2.913 1 1 234 . 16 1 1 A 42 42 GLU H H 42 7.490 7.772 -0.282 1 1 235 . 16 1 1 A 42 42 GLU HA H 42 5.680 4.804 0.876 1 1 240 . 16 1 1 A 42 42 GLU C C 42 173.790 174.180 -0.390 1 1 241 . 16 1 1 A 42 42 GLU CA C 42 54.360 56.271 -1.911 1 1 242 . 16 1 1 A 42 42 GLU CB C 42 33.850 33.056 0.794 1 1 244 . 16 1 1 A 42 42 GLU N N 42 116.670 118.030 -1.360 1 1 245 . 16 1 1 A 43 43 VAL H H 43 8.550 8.865 -0.315 1 1 246 . 16 1 1 A 43 43 VAL HA H 43 4.550 4.648 -0.098 1 1 254 . 16 1 1 A 43 43 VAL C C 43 172.220 173.991 -1.771 1 1 255 . 16 1 1 A 43 43 VAL CA C 43 59.470 60.531 -1.061 1 1 256 . 16 1 1 A 43 43 VAL CB C 43 35.470 34.593 0.877 1 1 259 . 16 1 1 A 43 43 VAL N N 43 120.030 125.476 -5.446 1 1 260 . 16 1 1 A 44 44 GLN H H 44 8.470 8.666 -0.196 1 1 261 . 16 1 1 A 44 44 GLN HA H 44 4.890 4.419 0.471 1 1 268 . 16 1 1 A 44 44 GLN C C 44 176.130 175.962 0.168 1 1 269 . 16 1 1 A 44 44 GLN CA C 44 54.360 55.712 -1.352 1 1 270 . 16 1 1 A 44 44 GLN CB C 44 30.610 28.896 1.714 1 1 272 . 16 1 1 A 44 44 GLN N N 44 124.690 130.313 -5.623 1 1 274 . 16 1 1 A 45 45 VAL H H 45 8.130 8.525 -0.395 1 1 275 . 16 1 1 A 45 45 VAL HA H 45 3.030 3.852 -0.822 1 1 283 . 16 1 1 A 45 45 VAL C C 45 176.710 177.208 -0.498 1 1 284 . 16 1 1 A 45 45 VAL CA C 45 65.810 64.683 1.127 1 1 285 . 16 1 1 A 45 45 VAL CB C 45 31.960 31.453 0.507 1 1 288 . 16 1 1 A 45 45 VAL N N 45 120.450 126.991 -6.541 1 1 289 . 16 1 1 A 46 46 GLY H H 46 8.950 9.998 -1.048 1 1 290 . 16 1 1 A 46 46 GLY HA2 H 46 3.590 3.994 -0.404 1 1 291 . 16 1 1 A 46 46 GLY HA3 H 46 4.410 3.996 0.414 1 1 292 . 16 1 1 A 46 46 GLY C C 46 174.390 173.955 0.435 1 1 293 . 16 1 1 A 46 46 GLY CA C 46 44.730 44.968 -0.238 1 1 294 . 16 1 1 A 46 46 GLY N N 46 116.490 115.232 1.258 1 1 295 . 16 1 1 A 47 47 GLU H H 47 8.260 7.949 0.311 1 1 296 . 16 1 1 A 47 47 GLU HA H 47 4.460 4.673 -0.213 1 1 301 . 16 1 1 A 47 47 GLU C C 47 174.780 175.586 -0.806 1 1 302 . 16 1 1 A 47 47 GLU CA C 47 54.830 55.233 -0.403 1 1 303 . 16 1 1 A 47 47 GLU CB C 47 31.140 31.648 -0.508 1 1 305 . 16 1 1 A 47 47 GLU N N 47 120.520 121.534 -1.014 1 1 306 . 16 1 1 A 48 48 ASN H H 48 8.440 8.863 -0.423 1 1 307 . 16 1 1 A 48 48 ASN HA H 48 5.380 5.672 -0.292 1 1 312 . 16 1 1 A 48 48 ASN C C 48 174.770 173.169 1.601 1 1 313 . 16 1 1 A 48 48 ASN CA C 48 51.570 51.591 -0.021 1 1 314 . 16 1 1 A 48 48 ASN CB C 48 39.010 41.963 -2.953 1 1 315 . 16 1 1 A 48 48 ASN N N 48 117.180 120.017 -2.837 1 1 317 . 16 1 1 A 49 49 LEU H H 49 9.810 8.604 1.206 1 1 318 . 16 1 1 A 49 49 LEU HA H 49 4.510 5.168 -0.658 1 1 328 . 16 1 1 A 49 49 LEU C C 49 174.560 174.401 0.159 1 1 329 . 16 1 1 A 49 49 LEU CA C 49 53.460 53.791 -0.331 1 1 330 . 16 1 1 A 49 49 LEU CB C 49 45.520 46.734 -1.214 1 1 333 . 16 1 1 A 49 49 LEU N N 49 125.620 122.757 2.863 1 1 334 . 16 1 1 A 50 50 GLU H H 50 8.750 9.178 -0.428 1 1 335 . 16 1 1 A 50 50 GLU HA H 50 4.360 5.033 -0.673 1 1 340 . 16 1 1 A 50 50 GLU C C 50 175.340 174.437 0.903 1 1 341 . 16 1 1 A 50 50 GLU CA C 50 55.550 54.699 0.851 1 1 342 . 16 1 1 A 50 50 GLU CB C 50 29.890 32.020 -2.130 1 1 344 . 16 1 1 A 50 50 GLU N N 50 125.420 125.177 0.243 1 1 345 . 16 1 1 A 51 51 VAL H H 51 9.230 8.915 0.315 1 1 346 . 16 1 1 A 51 51 VAL HA H 51 4.190 4.540 -0.350 1 1 354 . 16 1 1 A 51 51 VAL C C 51 175.310 174.943 0.367 1 1 355 . 16 1 1 A 51 51 VAL CA C 51 62.520 61.531 0.989 1 1 356 . 16 1 1 A 51 51 VAL CB C 51 31.470 32.765 -1.295 1 1 359 . 16 1 1 A 51 51 VAL N N 51 129.810 126.033 3.777 1 1 360 . 16 1 1 A 52 52 GLY H H 52 9.410 8.370 1.040 1 1 361 . 16 1 1 A 52 52 GLY HA2 H 52 3.460 3.890 -0.430 1 1 362 . 16 1 1 A 52 52 GLY HA3 H 52 4.680 3.917 0.763 1 1 363 . 16 1 1 A 52 52 GLY C C 52 173.000 173.310 -0.310 1 1 364 . 16 1 1 A 52 52 GLY CA C 52 46.470 47.418 -0.948 1 1 365 . 16 1 1 A 52 52 GLY N N 52 116.600 116.382 0.218 1 1 366 . 16 1 1 A 53 53 VAL H H 53 9.130 8.996 0.134 1 1 367 . 16 1 1 A 53 53 VAL HA H 53 4.840 4.765 0.075 1 1 375 . 16 1 1 A 53 53 VAL C C 53 175.470 175.295 0.175 1 1 376 . 16 1 1 A 53 53 VAL CA C 53 61.350 61.294 0.056 1 1 377 . 16 1 1 A 53 53 VAL CB C 53 34.300 31.446 2.854 1 1 380 . 16 1 1 A 53 53 VAL N N 53 129.050 123.402 5.648 1 1 381 . 16 1 1 A 54 54 GLY H H 54 8.420 8.843 -0.423 1 1 382 . 16 1 1 A 54 54 GLY HA2 H 54 3.850 3.889 -0.039 1 1 383 . 16 1 1 A 54 54 GLY HA3 H 54 3.850 3.933 -0.083 1 1 384 . 16 1 1 A 54 54 GLY C C 54 173.310 172.983 0.327 1 1 385 . 16 1 1 A 54 54 GLY CA C 54 45.180 44.266 0.914 1 1 386 . 16 1 1 A 54 54 GLY N N 54 116.890 115.537 1.353 1 1 387 . 16 1 1 A 55 55 ILE H H 55 10.190 8.112 2.078 1 1 388 . 16 1 1 A 55 55 ILE HA H 55 4.010 4.591 -0.581 1 1 398 . 16 1 1 A 55 55 ILE C C 55 174.380 175.271 -0.891 1 1 399 . 16 1 1 A 55 55 ILE CA C 55 61.350 60.130 1.220 1 1 400 . 16 1 1 A 55 55 ILE CB C 55 40.840 39.502 1.338 1 1 404 . 16 1 1 A 55 55 ILE N N 55 129.330 121.340 7.990 1 1 405 . 16 1 1 A 56 56 ASP H H 56 8.810 9.749 -0.939 1 1 406 . 16 1 1 A 56 56 ASP HA H 56 4.440 4.654 -0.214 1 1 409 . 16 1 1 A 56 56 ASP C C 56 175.530 175.405 0.125 1 1 410 . 16 1 1 A 56 56 ASP CA C 56 56.460 55.391 1.069 1 1 411 . 16 1 1 A 56 56 ASP CB C 56 42.720 42.779 -0.059 1 1 412 . 16 1 1 A 56 56 ASP N N 56 128.310 128.011 0.299 1 1 413 . 16 1 1 A 57 57 GLU H H 57 7.270 7.624 -0.354 1 1 414 . 16 1 1 A 57 57 GLU HA H 57 4.290 4.820 -0.530 1 1 419 . 16 1 1 A 57 57 GLU C C 57 173.370 174.586 -1.216 1 1 420 . 16 1 1 A 57 57 GLU CA C 57 54.840 55.464 -0.624 1 1 421 . 16 1 1 A 57 57 GLU CB C 57 33.190 33.597 -0.407 1 1 423 . 16 1 1 A 57 57 GLU N N 57 112.810 115.929 -3.119 1 1 424 . 16 1 1 A 58 58 LEU H H 58 8.370 8.458 -0.088 1 1 425 . 16 1 1 A 58 58 LEU HA H 58 4.830 4.656 0.174 1 1 434 . 16 1 1 A 58 58 LEU C C 58 174.180 174.647 -0.467 1 1 435 . 16 1 1 A 58 58 LEU CA C 58 55.320 54.897 0.423 1 1 436 . 16 1 1 A 58 58 LEU CB C 58 44.300 43.294 1.006 1 1 439 . 16 1 1 A 58 58 LEU N N 58 123.130 124.998 -1.868 1 1 440 . 16 1 1 A 59 59 VAL H H 59 9.120 8.861 0.259 1 1 441 . 16 1 1 A 59 59 VAL HA H 59 4.240 4.668 -0.428 1 1 449 . 16 1 1 A 59 59 VAL C C 59 174.960 175.449 -0.489 1 1 450 . 16 1 1 A 59 59 VAL CA C 59 61.760 59.811 1.949 1 1 451 . 16 1 1 A 59 59 VAL CB C 59 33.760 33.677 0.083 1 1 454 . 16 1 1 A 59 59 VAL N N 59 127.930 125.678 2.252 1 1 455 . 16 1 1 A 60 60 ASN H H 60 8.770 8.498 0.272 1 1 456 . 16 1 1 A 60 60 ASN HA H 60 4.250 4.724 -0.474 1 1 461 . 16 1 1 A 60 60 ASN C C 60 172.810 173.762 -0.952 1 1 462 . 16 1 1 A 60 60 ASN CA C 60 54.830 54.750 0.080 1 1 463 . 16 1 1 A 60 60 ASN CB C 60 36.030 36.766 -0.736 1 1 464 . 16 1 1 A 60 60 ASN N N 60 115.500 123.074 -7.574 1 1 466 . 16 1 1 A 61 61 ALA H H 61 7.330 7.363 -0.033 1 1 467 . 16 1 1 A 61 61 ALA HA H 61 4.520 4.694 -0.174 1 1 471 . 16 1 1 A 61 61 ALA C C 61 174.580 175.050 -0.470 1 1 472 . 16 1 1 A 61 61 ALA CA C 61 51.560 51.063 0.497 1 1 473 . 16 1 1 A 61 61 ALA CB C 61 22.870 22.997 -0.127 1 1 474 . 16 1 1 A 61 61 ALA N N 61 115.640 118.877 -3.237 1 1 475 . 16 1 1 A 62 62 GLU H H 62 7.900 9.051 -1.151 1 1 476 . 16 1 1 A 62 62 GLU HA H 62 4.310 4.822 -0.512 1 1 481 . 16 1 1 A 62 62 GLU C C 62 173.790 175.472 -1.682 1 1 482 . 16 1 1 A 62 62 GLU CA C 62 55.080 54.956 0.124 1 1 483 . 16 1 1 A 62 62 GLU CB C 62 32.610 30.710 1.900 1 1 485 . 16 1 1 A 62 62 GLU N N 62 117.400 118.260 -0.860 1 1 486 . 16 1 1 A 63 63 ALA H H 63 8.910 8.728 0.182 1 1 487 . 16 1 1 A 63 63 ALA HA H 63 4.690 4.576 0.114 1 1 491 . 16 1 1 A 63 63 ALA C C 63 175.720 176.618 -0.898 1 1 492 . 16 1 1 A 63 63 ALA CA C 63 50.600 53.147 -2.547 1 1 493 . 16 1 1 A 63 63 ALA CB C 63 20.660 18.849 1.811 1 1 494 . 16 1 1 A 63 63 ALA N N 63 122.480 129.749 -7.269 1 1 495 . 16 1 1 A 64 64 PHE H H 64 9.220 9.109 0.111 1 1 496 . 16 1 1 A 64 64 PHE HA H 64 4.320 4.734 -0.414 1 1 501 . 16 1 1 A 64 64 PHE C C 64 174.380 175.629 -1.249 1 1 502 . 16 1 1 A 64 64 PHE CA C 64 59.770 59.084 0.686 1 1 503 . 16 1 1 A 64 64 PHE CB C 64 40.830 41.134 -0.304 1 1 504 . 16 1 1 A 64 64 PHE N N 64 120.870 123.446 -2.576 1 1 505 . 16 1 1 A 65 65 ALA H H 65 8.150 8.088 0.062 1 1 506 . 16 1 1 A 65 65 ALA HA H 65 5.280 4.900 0.380 1 1 510 . 16 1 1 A 65 65 ALA C C 65 175.950 175.702 0.248 1 1 511 . 16 1 1 A 65 65 ALA CA C 65 51.120 50.736 0.384 1 1 512 . 16 1 1 A 65 65 ALA CB C 65 22.850 21.315 1.535 1 1 513 . 16 1 1 A 65 65 ALA N N 65 122.350 120.014 2.336 1 1 514 . 16 1 1 A 66 66 TYR H H 66 9.260 9.299 -0.039 1 1 515 . 16 1 1 A 66 66 TYR HA H 66 5.710 4.950 0.760 1 1 520 . 16 1 1 A 66 66 TYR C C 66 175.690 174.510 1.180 1 1 521 . 16 1 1 A 66 66 TYR CA C 66 54.390 58.598 -4.208 1 1 522 . 16 1 1 A 66 66 TYR CB C 66 41.560 39.955 1.605 1 1 523 . 16 1 1 A 66 66 TYR N N 66 124.350 126.908 -2.558 1 1 524 . 16 1 1 A 67 67 ASP H H 67 9.070 8.403 0.667 1 1 525 . 16 1 1 A 67 67 ASP HA H 67 5.630 5.288 0.342 1 1 528 . 16 1 1 A 67 67 ASP C C 67 174.300 174.295 0.005 1 1 529 . 16 1 1 A 67 67 ASP CA C 67 51.590 53.185 -1.595 1 1 530 . 16 1 1 A 67 67 ASP CB C 67 44.380 43.515 0.865 1 1 531 . 16 1 1 A 67 67 ASP N N 67 130.490 127.359 3.131 1 1 532 . 16 1 1 A 68 68 PHE H H 68 8.670 8.100 0.570 1 1 533 . 16 1 1 A 68 68 PHE HA H 68 4.890 5.359 -0.469 1 1 538 . 16 1 1 A 68 68 PHE C C 68 172.220 173.117 -0.897 1 1 539 . 16 1 1 A 68 68 PHE CA C 68 57.360 55.181 2.179 1 1 540 . 16 1 1 A 68 68 PHE CB C 68 40.360 41.673 -1.313 1 1 541 . 16 1 1 A 68 68 PHE N N 68 118.200 119.728 -1.528 1 1 542 . 16 1 1 A 69 69 THR H H 69 8.390 8.363 0.027 1 1 543 . 16 1 1 A 69 69 THR HA H 69 5.170 4.941 0.229 1 1 548 . 16 1 1 A 69 69 THR C C 69 172.620 174.650 -2.030 1 1 549 . 16 1 1 A 69 69 THR CA C 69 61.370 61.502 -0.132 1 1 550 . 16 1 1 A 69 69 THR CB C 69 64.880 70.530 -5.650 1 1 552 . 16 1 1 A 69 69 THR N N 69 115.810 114.707 1.103 1 1 553 . 16 1 1 A 70 70 LEU H H 70 9.560 8.754 0.806 1 1 554 . 16 1 1 A 70 70 LEU HA H 70 5.270 4.696 0.574 1 1 564 . 16 1 1 A 70 70 LEU C C 70 173.800 176.046 -2.246 1 1 565 . 16 1 1 A 70 70 LEU CA C 70 53.460 54.222 -0.762 1 1 566 . 16 1 1 A 70 70 LEU CB C 70 45.040 43.164 1.876 1 1 570 . 16 1 1 A 70 70 LEU N N 70 129.220 125.442 3.778 1 1 571 . 16 1 1 A 71 71 ASN H H 71 9.590 8.659 0.931 1 1 572 . 16 1 1 A 71 71 ASN HA H 71 5.880 5.781 0.099 1 1 577 . 16 1 1 A 71 71 ASN C C 71 177.970 174.152 3.818 1 1 578 . 16 1 1 A 71 71 ASN CA C 71 52.060 52.269 -0.209 1 1 579 . 16 1 1 A 71 71 ASN CB C 71 41.020 40.612 0.408 1 1 580 . 16 1 1 A 71 71 ASN N N 71 125.970 119.041 6.929 1 1 582 . 16 1 1 A 72 72 TYR H H 72 8.740 9.286 -0.546 1 1 583 . 16 1 1 A 72 72 TYR HA H 72 5.110 5.255 -0.145 1 1 588 . 16 1 1 A 72 72 TYR C C 72 177.720 172.065 5.655 1 1 589 . 16 1 1 A 72 72 TYR CA C 72 55.310 55.243 0.067 1 1 590 . 16 1 1 A 72 72 TYR CB C 72 41.510 41.359 0.151 1 1 591 . 16 1 1 A 72 72 TYR N N 72 119.640 120.545 -0.905 1 1 592 . 16 1 1 A 73 73 ASP H H 73 9.780 8.971 0.809 1 1 593 . 16 1 1 A 73 73 ASP HA H 73 4.680 4.890 -0.210 1 1 596 . 16 1 1 A 73 73 ASP C C 73 177.290 177.168 0.122 1 1 597 . 16 1 1 A 73 73 ASP CA C 73 53.650 53.118 0.532 1 1 598 . 16 1 1 A 73 73 ASP CB C 73 40.900 42.922 -2.022 1 1 599 . 16 1 1 A 73 73 ASP N N 73 119.290 121.226 -1.936 1 1 600 . 16 1 1 A 74 74 GLU H H 74 9.430 8.614 0.816 1 1 601 . 16 1 1 A 74 74 GLU HA H 74 4.740 4.320 0.420 1 1 606 . 16 1 1 A 74 74 GLU C C 74 176.320 178.436 -2.116 1 1 607 . 16 1 1 A 74 74 GLU CA C 74 57.410 58.139 -0.729 1 1 608 . 16 1 1 A 74 74 GLU CB C 74 29.490 30.616 -1.126 1 1 610 . 16 1 1 A 74 74 GLU N N 74 130.930 123.990 6.940 1 1 611 . 16 1 1 A 75 75 ASN H H 75 8.680 7.984 0.696 1 1 612 . 16 1 1 A 75 75 ASN HA H 75 4.600 4.577 0.023 1 1 617 . 16 1 1 A 75 75 ASN C C 75 175.340 176.264 -0.924 1 1 618 . 16 1 1 A 75 75 ASN CA C 75 54.620 55.782 -1.162 1 1 619 . 16 1 1 A 75 75 ASN CB C 75 38.770 38.802 -0.032 1 1 620 . 16 1 1 A 75 75 ASN N N 75 115.040 118.475 -3.435 1 1 622 . 16 1 1 A 76 76 ALA H H 76 7.740 7.771 -0.031 1 1 623 . 16 1 1 A 76 76 ALA HA H 76 4.310 4.443 -0.133 1 1 627 . 16 1 1 A 76 76 ALA C C 76 175.550 176.857 -1.307 1 1 628 . 16 1 1 A 76 76 ALA CA C 76 53.260 53.450 -0.190 1 1 629 . 16 1 1 A 76 76 ALA CB C 76 21.450 20.671 0.779 1 1 630 . 16 1 1 A 76 76 ALA N N 76 122.200 120.388 1.812 1 1 631 . 16 1 1 A 77 77 PHE H H 77 8.070 8.003 0.067 1 1 632 . 16 1 1 A 77 77 PHE HA H 77 5.650 5.149 0.501 1 1 637 . 16 1 1 A 77 77 PHE C C 77 174.570 175.357 -0.787 1 1 638 . 16 1 1 A 77 77 PHE CA C 77 56.360 57.484 -1.124 1 1 639 . 16 1 1 A 77 77 PHE CB C 77 46.080 40.813 5.267 1 1 640 . 16 1 1 A 77 77 PHE N N 77 114.160 114.004 0.156 1 1 641 . 16 1 1 A 78 78 GLU H H 78 8.800 8.940 -0.140 1 1 642 . 16 1 1 A 78 78 GLU HA H 78 4.900 4.980 -0.080 1 1 647 . 16 1 1 A 78 78 GLU C C 78 175.950 174.702 1.248 1 1 648 . 16 1 1 A 78 78 GLU CA C 78 53.670 56.445 -2.775 1 1 649 . 16 1 1 A 78 78 GLU CB C 78 33.600 32.117 1.483 1 1 651 . 16 1 1 A 78 78 GLU N N 78 117.590 120.666 -3.076 1 1 652 . 16 1 1 A 79 79 TYR H H 79 8.770 9.274 -0.504 1 1 653 . 16 1 1 A 79 79 TYR HA H 79 4.250 4.166 0.084 1 1 658 . 16 1 1 A 79 79 TYR C C 79 174.580 174.957 -0.377 1 1 659 . 16 1 1 A 79 79 TYR CA C 79 59.250 59.595 -0.345 1 1 660 . 16 1 1 A 79 79 TYR CB C 79 38.310 39.193 -0.883 1 1 661 . 16 1 1 A 79 79 TYR N N 79 126.560 129.804 -3.244 1 1 662 . 16 1 1 A 80 80 VAL H H 80 8.220 8.083 0.137 1 1 663 . 16 1 1 A 80 80 VAL HA H 80 3.690 3.912 -0.222 1 1 671 . 16 1 1 A 80 80 VAL C C 80 174.780 174.747 0.033 1 1 672 . 16 1 1 A 80 80 VAL CA C 80 64.400 62.858 1.542 1 1 673 . 16 1 1 A 80 80 VAL CB C 80 33.510 32.963 0.547 1 1 676 . 16 1 1 A 80 80 VAL N N 80 129.460 124.694 4.766 1 1 677 . 16 1 1 A 81 81 GLU H H 81 6.920 7.098 -0.178 1 1 678 . 16 1 1 A 81 81 GLU HA H 81 4.260 4.614 -0.354 1 1 683 . 16 1 1 A 81 81 GLU C C 81 171.840 174.535 -2.695 1 1 684 . 16 1 1 A 81 81 GLU CA C 81 55.310 54.950 0.360 1 1 685 . 16 1 1 A 81 81 GLU CB C 81 30.520 33.563 -3.043 1 1 687 . 16 1 1 A 81 81 GLU N N 81 112.430 116.916 -4.486 1 1 688 . 16 1 1 A 82 82 ALA H H 82 8.310 8.765 -0.455 1 1 689 . 16 1 1 A 82 82 ALA HA H 82 5.650 5.527 0.123 1 1 693 . 16 1 1 A 82 82 ALA C C 82 176.110 176.608 -0.498 1 1 694 . 16 1 1 A 82 82 ALA CA C 82 50.620 50.384 0.236 1 1 695 . 16 1 1 A 82 82 ALA CB C 82 21.770 21.952 -0.182 1 1 696 . 16 1 1 A 82 82 ALA N N 82 121.240 123.688 -2.448 1 1 697 . 16 1 1 A 83 83 ILE H H 83 9.150 8.870 0.280 1 1 698 . 16 1 1 A 83 83 ILE HA H 83 4.600 4.980 -0.380 1 1 708 . 16 1 1 A 83 83 ILE C C 83 174.810 174.648 0.162 1 1 709 . 16 1 1 A 83 83 ILE CA C 83 60.060 58.934 1.126 1 1 710 . 16 1 1 A 83 83 ILE CB C 83 42.440 42.712 -0.272 1 1 714 . 16 1 1 A 83 83 ILE N N 83 119.720 119.218 0.502 1 1 715 . 16 1 1 A 84 84 SER H H 84 8.350 8.659 -0.309 1 1 716 . 16 1 1 A 84 84 SER HA H 84 4.660 4.813 -0.153 1 1 719 . 16 1 1 A 84 84 SER C C 84 177.550 172.859 4.691 1 1 720 . 16 1 1 A 84 84 SER CA C 84 57.330 56.055 1.275 1 1 721 . 16 1 1 A 84 84 SER CB C 84 66.490 65.575 0.915 1 1 722 . 16 1 1 A 84 84 SER N N 84 116.740 116.796 -0.056 1 1 723 . 16 1 1 A 85 85 ASP H H 85 8.740 8.720 0.020 1 1 724 . 16 1 1 A 85 85 ASP HA H 85 4.820 4.670 0.150 1 1 727 . 16 1 1 A 85 85 ASP C C 85 176.090 176.499 -0.409 1 1 728 . 16 1 1 A 85 85 ASP CA C 85 53.480 53.152 0.328 1 1 729 . 16 1 1 A 85 85 ASP CB C 85 42.480 41.285 1.195 1 1 730 . 16 1 1 A 85 85 ASP N N 85 120.960 121.626 -0.666 1 1 731 . 16 1 1 A 86 86 ASP H H 86 8.380 8.877 -0.497 1 1 732 . 16 1 1 A 86 86 ASP HA H 86 4.450 4.884 -0.434 1 1 735 . 16 1 1 A 86 86 ASP C C 86 177.100 176.944 0.156 1 1 736 . 16 1 1 A 86 86 ASP CA C 86 56.240 54.144 2.096 1 1 737 . 16 1 1 A 86 86 ASP CB C 86 41.100 41.313 -0.213 1 1 738 . 16 1 1 A 86 86 ASP N N 86 117.710 117.564 0.146 1 1 739 . 16 1 1 A 87 87 GLY H H 87 8.690 7.629 1.061 1 1 740 . 16 1 1 A 87 87 GLY HA2 H 87 3.870 4.118 -0.248 1 1 741 . 16 1 1 A 87 87 GLY HA3 H 87 4.090 4.130 -0.040 1 1 742 . 16 1 1 A 87 87 GLY C C 87 173.800 174.136 -0.336 1 1 743 . 16 1 1 A 87 87 GLY CA C 87 45.770 45.672 0.098 1 1 744 . 16 1 1 A 87 87 GLY N N 87 108.540 107.609 0.931 1 1 745 . 16 1 1 A 88 88 VAL H H 88 7.910 8.207 -0.297 1 1 746 . 16 1 1 A 88 88 VAL HA H 88 4.780 4.166 0.614 1 1 754 . 16 1 1 A 88 88 VAL C C 88 173.970 175.306 -1.336 1 1 755 . 16 1 1 A 88 88 VAL CA C 88 60.900 62.341 -1.441 1 1 756 . 16 1 1 A 88 88 VAL CB C 88 35.460 32.642 2.818 1 1 759 . 16 1 1 A 88 88 VAL N N 88 119.790 120.221 -0.431 1 1 760 . 16 1 1 A 89 89 PHE H H 89 9.210 9.660 -0.450 1 1 761 . 16 1 1 A 89 89 PHE HA H 89 4.930 5.314 -0.384 1 1 766 . 16 1 1 A 89 89 PHE C C 89 173.970 173.853 0.117 1 1 767 . 16 1 1 A 89 89 PHE CA C 89 56.450 55.587 0.863 1 1 768 . 16 1 1 A 89 89 PHE CB C 89 41.120 41.042 0.078 1 1 769 . 16 1 1 A 89 89 PHE N N 89 126.780 127.493 -0.713 1 1 770 . 16 1 1 A 90 90 VAL H H 90 7.880 8.894 -1.014 1 1 771 . 16 1 1 A 90 90 VAL HA H 90 4.860 4.889 -0.029 1 1 779 . 16 1 1 A 90 90 VAL C C 90 173.190 174.760 -1.570 1 1 780 . 16 1 1 A 90 90 VAL CA C 90 59.750 61.269 -1.519 1 1 781 . 16 1 1 A 90 90 VAL CB C 90 34.770 33.011 1.759 1 1 784 . 16 1 1 A 90 90 VAL N N 90 124.990 128.089 -3.099 1 1 785 . 16 1 1 A 91 91 ASN H H 91 8.670 8.880 -0.210 1 1 786 . 16 1 1 A 91 91 ASN HA H 91 4.730 5.226 -0.496 1 1 791 . 16 1 1 A 91 91 ASN C C 91 173.200 174.495 -1.295 1 1 792 . 16 1 1 A 91 91 ASN CA C 91 51.970 52.653 -0.683 1 1 793 . 16 1 1 A 91 91 ASN CB C 91 41.340 41.407 -0.067 1 1 794 . 16 1 1 A 91 91 ASN N N 91 124.860 126.192 -1.332 1 1 796 . 16 1 1 A 92 92 ALA H H 92 8.840 9.082 -0.242 1 1 797 . 16 1 1 A 92 92 ALA HA H 92 5.290 4.678 0.612 1 1 801 . 16 1 1 A 92 92 ALA C C 92 176.330 176.508 -0.178 1 1 802 . 16 1 1 A 92 92 ALA CA C 92 50.170 51.288 -1.118 1 1 803 . 16 1 1 A 92 92 ALA CB C 92 23.610 21.231 2.379 1 1 804 . 16 1 1 A 92 92 ALA N N 92 128.510 129.531 -1.021 1 1 805 . 16 1 1 A 93 93 LYS H H 93 8.670 9.121 -0.451 1 1 806 . 16 1 1 A 93 93 LYS HA H 93 4.460 4.764 -0.304 1 1 815 . 16 1 1 A 93 93 LYS C C 93 174.170 174.997 -0.827 1 1 816 . 16 1 1 A 93 93 LYS CA C 93 55.010 55.634 -0.624 1 1 817 . 16 1 1 A 93 93 LYS CB C 93 36.430 36.061 0.369 1 1 821 . 16 1 1 A 93 93 LYS N N 93 121.300 118.499 2.801 1 1 822 . 16 1 1 A 94 94 LYS H H 94 8.960 9.038 -0.078 1 1 823 . 16 1 1 A 94 94 LYS HA H 94 4.460 4.313 0.147 1 1 832 . 16 1 1 A 94 94 LYS C C 94 176.330 176.634 -0.304 1 1 833 . 16 1 1 A 94 94 LYS CA C 94 56.720 57.077 -0.357 1 1 834 . 16 1 1 A 94 94 LYS CB C 94 31.930 32.754 -0.824 1 1 837 . 16 1 1 A 94 94 LYS N N 94 127.060 127.085 -0.025 1 1 838 . 16 1 1 A 95 95 ILE H H 95 8.290 8.948 -0.658 1 1 839 . 16 1 1 A 95 95 ILE HA H 95 4.120 4.317 -0.197 1 1 849 . 16 1 1 A 95 95 ILE C C 95 175.740 174.727 1.013 1 1 850 . 16 1 1 A 95 95 ILE CA C 95 62.760 61.854 0.906 1 1 851 . 16 1 1 A 95 95 ILE CB C 95 38.890 40.168 -1.278 1 1 855 . 16 1 1 A 95 95 ILE N N 95 126.530 129.213 -2.683 1 1 856 . 16 1 1 A 96 96 GLU H H 96 8.030 7.336 0.694 1 1 857 . 16 1 1 A 96 96 GLU HA H 96 4.450 4.787 -0.337 1 1 862 . 16 1 1 A 96 96 GLU C C 96 174.380 175.239 -0.859 1 1 863 . 16 1 1 A 96 96 GLU CA C 96 54.320 54.848 -0.528 1 1 864 . 16 1 1 A 96 96 GLU CB C 96 32.770 33.898 -1.128 1 1 866 . 16 1 1 A 96 96 GLU N N 96 117.080 119.155 -2.075 1 1 867 . 16 1 1 A 97 97 ASP H H 97 8.730 8.780 -0.050 1 1 868 . 16 1 1 A 97 97 ASP HA H 97 4.360 4.324 0.036 1 1 871 . 16 1 1 A 97 97 ASP C C 97 177.100 177.175 -0.075 1 1 872 . 16 1 1 A 97 97 ASP CA C 97 57.160 55.886 1.274 1 1 873 . 16 1 1 A 97 97 ASP CB C 97 39.920 40.248 -0.328 1 1 874 . 16 1 1 A 97 97 ASP N N 97 120.570 121.255 -0.685 1 1 875 . 16 1 1 A 98 98 GLY H H 98 8.760 8.519 0.241 1 1 876 . 16 1 1 A 98 98 GLY HA2 H 98 2.120 1.780 0.340 1 1 877 . 16 1 1 A 98 98 GLY HA3 H 98 3.910 3.385 0.525 1 1 878 . 16 1 1 A 98 98 GLY C C 98 174.000 172.819 1.181 1 1 879 . 16 1 1 A 98 98 GLY CA C 98 45.720 45.216 0.504 1 1 880 . 16 1 1 A 98 98 GLY N N 98 112.090 111.708 0.382 1 1 881 . 16 1 1 A 99 99 LYS H H 99 7.890 6.708 1.182 1 1 882 . 16 1 1 A 99 99 LYS HA H 99 5.330 5.156 0.174 1 1 891 . 16 1 1 A 99 99 LYS C C 99 174.750 174.354 0.396 1 1 892 . 16 1 1 A 99 99 LYS CA C 99 55.990 55.069 0.921 1 1 893 . 16 1 1 A 99 99 LYS CB C 99 37.840 35.553 2.287 1 1 897 . 16 1 1 A 99 99 LYS N N 99 118.050 114.817 3.233 1 1 898 . 16 1 1 A 100 100 VAL H H 100 8.980 8.781 0.199 1 1 899 . 16 1 1 A 100 100 VAL HA H 100 4.510 4.715 -0.205 1 1 907 . 16 1 1 A 100 100 VAL C C 100 174.760 173.810 0.950 1 1 908 . 16 1 1 A 100 100 VAL CA C 100 60.130 59.056 1.074 1 1 909 . 16 1 1 A 100 100 VAL CB C 100 35.240 35.730 -0.490 1 1 912 . 16 1 1 A 100 100 VAL N N 100 123.850 119.254 4.596 1 1 913 . 16 1 1 A 101 101 ARG H H 101 8.810 8.185 0.625 1 1 914 . 16 1 1 A 101 101 ARG HA H 101 4.850 4.499 0.351 1 1 921 . 16 1 1 A 101 101 ARG C C 101 174.770 174.593 0.177 1 1 922 . 16 1 1 A 101 101 ARG CA C 101 54.580 55.519 -0.939 1 1 923 . 16 1 1 A 101 101 ARG CB C 101 32.400 31.327 1.073 1 1 926 . 16 1 1 A 101 101 ARG N N 101 129.210 123.981 5.229 1 1 927 . 16 1 1 A 102 102 VAL H H 102 9.100 7.890 1.210 1 1 928 . 16 1 1 A 102 102 VAL HA H 102 4.120 4.773 -0.653 1 1 936 . 16 1 1 A 102 102 VAL C C 102 171.640 173.727 -2.087 1 1 937 . 16 1 1 A 102 102 VAL CA C 102 61.350 59.569 1.781 1 1 938 . 16 1 1 A 102 102 VAL CB C 102 32.530 34.311 -1.781 1 1 941 . 16 1 1 A 102 102 VAL N N 102 130.470 124.347 6.123 1 1 942 . 16 1 1 A 103 103 LEU H H 103 8.110 9.110 -1.000 1 1 943 . 16 1 1 A 103 103 LEU HA H 103 5.120 5.074 0.046 1 1 953 . 16 1 1 A 103 103 LEU C C 103 176.410 175.788 0.622 1 1 954 . 16 1 1 A 103 103 LEU CA C 103 53.380 53.289 0.091 1 1 955 . 16 1 1 A 103 103 LEU CB C 103 43.680 43.038 0.642 1 1 959 . 16 1 1 A 103 103 LEU N N 103 125.560 129.619 -4.059 1 1 960 . 16 1 1 A 104 104 VAL H H 104 9.580 9.225 0.355 1 1 961 . 16 1 1 A 104 104 VAL HA H 104 5.260 4.957 0.303 1 1 969 . 16 1 1 A 104 104 VAL C C 104 176.030 175.041 0.989 1 1 970 . 16 1 1 A 104 104 VAL CA C 104 60.220 61.196 -0.976 1 1 971 . 16 1 1 A 104 104 VAL CB C 104 34.310 33.806 0.504 1 1 974 . 16 1 1 A 104 104 VAL N N 104 125.790 127.034 -1.244 1 1 975 . 16 1 1 A 105 105 SER H H 105 9.340 9.053 0.287 1 1 976 . 16 1 1 A 105 105 SER HA H 105 5.300 5.083 0.217 1 1 979 . 16 1 1 A 105 105 SER C C 105 173.600 172.485 1.115 1 1 980 . 16 1 1 A 105 105 SER CA C 105 57.450 57.733 -0.283 1 1 981 . 16 1 1 A 105 105 SER CB C 105 65.600 67.024 -1.424 1 1 982 . 16 1 1 A 105 105 SER N N 105 119.220 122.542 -3.322 1 1 983 . 16 1 1 A 106 106 SER H H 106 8.350 8.880 -0.530 1 1 984 . 16 1 1 A 106 106 SER HA H 106 4.720 4.692 0.028 1 1 987 . 16 1 1 A 106 106 SER C C 106 176.930 175.225 1.705 1 1 988 . 16 1 1 A 106 106 SER CA C 106 58.170 56.862 1.308 1 1 989 . 16 1 1 A 106 106 SER CB C 106 64.170 62.931 1.239 1 1 990 . 16 1 1 A 106 106 SER N N 106 114.800 119.806 -5.006 1 1 991 . 16 1 1 A 107 107 LEU H H 107 8.770 8.894 -0.124 1 1 992 . 16 1 1 A 107 107 LEU HA H 107 4.710 4.208 0.502 1 1 1001 . 16 1 1 A 107 107 LEU C C 107 178.280 178.322 -0.042 1 1 1002 . 16 1 1 A 107 107 LEU CA C 107 55.280 57.397 -2.117 1 1 1003 . 16 1 1 A 107 107 LEU CB C 107 43.410 42.087 1.323 1 1 1007 . 16 1 1 A 107 107 LEU N N 107 127.210 130.200 -2.990 1 1 1008 . 16 1 1 A 108 108 THR H H 108 8.210 7.828 0.382 1 1 1009 . 16 1 1 A 108 108 THR HA H 108 4.400 4.292 0.108 1 1 1015 . 16 1 1 A 108 108 THR C C 108 176.130 175.729 0.401 1 1 1016 . 16 1 1 A 108 108 THR CA C 108 62.050 63.229 -1.179 1 1 1017 . 16 1 1 A 108 108 THR CB C 108 70.910 70.313 0.597 1 1 1019 . 16 1 1 A 108 108 THR N N 108 108.810 110.432 -1.622 1 1 1020 . 16 1 1 A 109 109 GLY H H 109 8.250 7.793 0.457 1 1 1021 . 16 1 1 A 109 109 GLY HA2 H 109 3.780 4.038 -0.258 1 1 1022 . 16 1 1 A 109 109 GLY HA3 H 109 4.290 4.065 0.225 1 1 1023 . 16 1 1 A 109 109 GLY C C 109 173.180 174.246 -1.066 1 1 1024 . 16 1 1 A 109 109 GLY CA C 109 45.340 45.071 0.269 1 1 1025 . 16 1 1 A 109 109 GLY N N 109 110.160 111.101 -0.941 1 1 1026 . 16 1 1 A 110 110 GLU H H 110 7.960 7.635 0.325 1 1 1027 . 16 1 1 A 110 110 GLU HA H 110 4.760 4.753 0.007 1 1 1032 . 16 1 1 A 110 110 GLU CA C 110 53.450 53.826 -0.376 1 1 1033 . 16 1 1 A 110 110 GLU CB C 110 30.020 29.556 0.464 1 1 1035 . 16 1 1 A 110 110 GLU N N 110 119.720 121.003 -1.283 1 1 1036 . 16 1 1 A 111 111 PRO HA H 111 3.250 3.666 -0.416 1 1 1043 . 16 1 1 A 111 111 PRO C C 111 176.710 175.972 0.738 1 1 1044 . 16 1 1 A 111 111 PRO CA C 111 62.240 62.052 0.188 1 1 1045 . 16 1 1 A 111 111 PRO CB C 111 31.990 31.744 0.246 1 1 1048 . 16 1 1 A 112 112 LEU H H 112 8.840 8.614 0.226 1 1 1049 . 16 1 1 A 112 112 LEU HA H 112 4.290 4.186 0.104 1 1 1059 . 16 1 1 A 112 112 LEU CA C 112 52.220 53.827 -1.607 1 1 1060 . 16 1 1 A 112 112 LEU CB C 112 41.090 41.990 -0.900 1 1 1063 . 16 1 1 A 112 112 LEU N N 112 122.420 121.988 0.432 1 1 1064 . 16 1 1 A 113 113 PRO HA H 113 4.380 4.236 0.144 1 1 1071 . 16 1 1 A 113 113 PRO C C 113 176.100 177.472 -1.372 1 1 1072 . 16 1 1 A 113 113 PRO CA C 113 61.930 64.755 -2.825 1 1 1073 . 16 1 1 A 113 113 PRO CB C 113 32.470 31.764 0.706 1 1 1076 . 16 1 1 A 114 114 ALA H H 114 8.070 7.799 0.271 1 1 1077 . 16 1 1 A 114 114 ALA HA H 114 4.550 3.965 0.585 1 1 1081 . 16 1 1 A 114 114 ALA C C 114 177.490 177.264 0.226 1 1 1082 . 16 1 1 A 114 114 ALA CA C 114 51.340 53.740 -2.400 1 1 1083 . 16 1 1 A 114 114 ALA CB C 114 19.940 18.186 1.754 1 1 1084 . 16 1 1 A 114 114 ALA N N 114 121.460 121.083 0.377 1 1 1085 . 16 1 1 A 115 115 LYS H H 115 9.000 8.577 0.423 1 1 1086 . 16 1 1 A 115 115 LYS HA H 115 3.930 3.888 0.042 1 1 1095 . 16 1 1 A 115 115 LYS C C 115 175.740 175.332 0.408 1 1 1096 . 16 1 1 A 115 115 LYS CA C 115 57.580 57.807 -0.227 1 1 1097 . 16 1 1 A 115 115 LYS CB C 115 29.510 30.530 -1.020 1 1 1101 . 16 1 1 A 115 115 LYS N N 115 112.560 116.015 -3.455 1 1 1102 . 16 1 1 A 116 116 GLU H H 116 7.620 7.673 -0.053 1 1 1103 . 16 1 1 A 116 116 GLU HA H 116 4.550 4.915 -0.365 1 1 1108 . 16 1 1 A 116 116 GLU C C 116 176.110 175.172 0.938 1 1 1109 . 16 1 1 A 116 116 GLU CA C 116 54.570 54.359 0.211 1 1 1110 . 16 1 1 A 116 116 GLU CB C 116 33.680 33.459 0.221 1 1 1112 . 16 1 1 A 116 116 GLU N N 116 115.710 117.669 -1.959 1 1 1113 . 16 1 1 A 117 117 VAL H H 117 8.770 8.809 -0.039 1 1 1114 . 16 1 1 A 117 117 VAL HA H 117 3.200 4.030 -0.830 1 1 1122 . 16 1 1 A 117 117 VAL C C 117 175.740 175.939 -0.199 1 1 1123 . 16 1 1 A 117 117 VAL CA C 117 65.340 63.090 2.250 1 1 1124 . 16 1 1 A 117 117 VAL CB C 117 31.290 30.942 0.348 1 1 1127 . 16 1 1 A 117 117 VAL N N 117 124.450 120.267 4.183 1 1 1128 . 16 1 1 A 118 118 LEU H H 118 8.550 8.983 -0.433 1 1 1129 . 16 1 1 A 118 118 LEU HA H 118 4.540 4.432 0.108 1 1 1139 . 16 1 1 A 118 118 LEU C C 118 176.210 176.474 -0.264 1 1 1140 . 16 1 1 A 118 118 LEU CA C 118 55.510 55.879 -0.369 1 1 1141 . 16 1 1 A 118 118 LEU CB C 118 44.600 42.990 1.610 1 1 1145 . 16 1 1 A 118 118 LEU N N 118 128.440 129.989 -1.549 1 1 1146 . 16 1 1 A 119 119 ALA H H 119 7.970 7.582 0.388 1 1 1147 . 16 1 1 A 119 119 ALA HA H 119 4.740 5.027 -0.287 1 1 1151 . 16 1 1 A 119 119 ALA C C 119 174.570 175.139 -0.569 1 1 1152 . 16 1 1 A 119 119 ALA CA C 119 50.770 51.807 -1.037 1 1 1153 . 16 1 1 A 119 119 ALA CB C 119 22.450 22.271 0.179 1 1 1154 . 16 1 1 A 119 119 ALA N N 119 118.100 118.962 -0.862 1 1 1155 . 16 1 1 A 120 120 LYS H H 120 8.760 9.165 -0.405 1 1 1156 . 16 1 1 A 120 120 LYS HA H 120 5.240 5.232 0.008 1 1 1165 . 16 1 1 A 120 120 LYS C C 120 175.340 175.066 0.274 1 1 1166 . 16 1 1 A 120 120 LYS CA C 120 54.220 54.959 -0.739 1 1 1167 . 16 1 1 A 120 120 LYS CB C 120 34.340 33.976 0.364 1 1 1171 . 16 1 1 A 120 120 LYS N N 120 120.010 121.768 -1.758 1 1 1172 . 16 1 1 A 121 121 VAL H H 121 9.410 8.871 0.539 1 1 1173 . 16 1 1 A 121 121 VAL HA H 121 4.230 4.503 -0.273 1 1 1181 . 16 1 1 A 121 121 VAL C C 121 173.980 174.640 -0.660 1 1 1182 . 16 1 1 A 121 121 VAL CA C 121 62.370 62.488 -0.118 1 1 1183 . 16 1 1 A 121 121 VAL CB C 121 32.410 32.409 0.001 1 1 1186 . 16 1 1 A 121 121 VAL N N 121 124.960 126.682 -1.722 1 1 1187 . 16 1 1 A 122 122 VAL H H 122 9.280 9.049 0.231 1 1 1188 . 16 1 1 A 122 122 VAL HA H 122 4.360 4.543 -0.183 1 1 1196 . 16 1 1 A 122 122 VAL C C 122 174.190 175.478 -1.288 1 1 1197 . 16 1 1 A 122 122 VAL CA C 122 62.760 62.868 -0.108 1 1 1198 . 16 1 1 A 122 122 VAL CB C 122 32.020 31.673 0.347 1 1 1201 . 16 1 1 A 122 122 VAL N N 122 128.990 130.532 -1.542 1 1 1202 . 16 1 1 A 123 123 LEU H H 123 8.610 9.054 -0.444 1 1 1203 . 16 1 1 A 123 123 LEU HA H 123 4.900 4.864 0.036 1 1 1213 . 16 1 1 A 123 123 LEU C C 123 174.950 175.637 -0.687 1 1 1214 . 16 1 1 A 123 123 LEU CA C 123 52.050 52.967 -0.917 1 1 1215 . 16 1 1 A 123 123 LEU CB C 123 45.210 43.792 1.418 1 1 1219 . 16 1 1 A 123 123 LEU N N 123 127.200 129.075 -1.875 1 1 1220 . 16 1 1 A 124 124 ARG H H 124 9.540 9.143 0.397 1 1 1221 . 16 1 1 A 124 124 ARG HA H 124 4.900 4.988 -0.088 1 1 1229 . 16 1 1 A 124 124 ARG C C 124 176.320 174.893 1.427 1 1 1230 . 16 1 1 A 124 124 ARG CA C 124 55.320 54.335 0.985 1 1 1231 . 16 1 1 A 124 124 ARG CB C 124 31.750 33.286 -1.536 1 1 1234 . 16 1 1 A 124 124 ARG N N 124 124.290 122.034 2.256 1 1 1236 . 16 1 1 A 125 125 ALA H H 125 8.880 8.427 0.453 1 1 1237 . 16 1 1 A 125 125 ALA HA H 125 4.380 4.012 0.368 1 1 1241 . 16 1 1 A 125 125 ALA C C 125 177.290 177.678 -0.388 1 1 1242 . 16 1 1 A 125 125 ALA CA C 125 52.530 51.116 1.414 1 1 1243 . 16 1 1 A 125 125 ALA CB C 125 19.870 17.477 2.393 1 1 1244 . 16 1 1 A 125 125 ALA N N 125 130.790 129.063 1.727 1 1 1245 . 16 1 1 A 126 126 GLU H H 126 9.260 8.261 0.999 1 1 1246 . 16 1 1 A 126 126 GLU HA H 126 4.460 4.318 0.142 1 1 1251 . 16 1 1 A 126 126 GLU C C 126 176.120 176.125 -0.005 1 1 1252 . 16 1 1 A 126 126 GLU CA C 126 56.940 57.030 -0.090 1 1 1253 . 16 1 1 A 126 126 GLU CB C 126 32.450 30.116 2.334 1 1 1255 . 16 1 1 A 126 126 GLU N N 126 125.740 123.387 2.353 1 1 1256 . 16 1 1 A 127 127 ALA H H 127 7.460 7.489 -0.029 1 1 1257 . 16 1 1 A 127 127 ALA HA H 127 4.360 4.601 -0.241 1 1 1261 . 16 1 1 A 127 127 ALA C C 127 173.400 175.832 -2.432 1 1 1262 . 16 1 1 A 127 127 ALA CA C 127 51.360 51.688 -0.328 1 1 1263 . 16 1 1 A 127 127 ALA CB C 127 22.180 21.875 0.305 1 1 1264 . 16 1 1 A 127 127 ALA N N 127 120.910 119.660 1.250 1 1 1265 . 16 1 1 A 128 128 LYS H H 128 7.940 8.726 -0.786 1 1 1266 . 16 1 1 A 128 128 LYS HA H 128 3.580 4.129 -0.549 1 1 1275 . 16 1 1 A 128 128 LYS C C 128 176.080 175.802 0.278 1 1 1276 . 16 1 1 A 128 128 LYS CA C 128 56.860 57.403 -0.543 1 1 1277 . 16 1 1 A 128 128 LYS CB C 128 33.170 33.027 0.143 1 1 1281 . 16 1 1 A 128 128 LYS N N 128 116.520 124.660 -8.140 1 1 1282 . 16 1 1 A 129 129 ALA H H 129 8.590 8.572 0.018 1 1 1283 . 16 1 1 A 129 129 ALA HA H 129 4.390 4.700 -0.310 1 1 1287 . 16 1 1 A 129 129 ALA C C 129 174.970 176.211 -1.241 1 1 1288 . 16 1 1 A 129 129 ALA CA C 129 52.970 50.886 2.084 1 1 1289 . 16 1 1 A 129 129 ALA CB C 129 21.500 19.268 2.232 1 1 1290 . 16 1 1 A 129 129 ALA N N 129 124.710 128.951 -4.241 1 1 1291 . 16 1 1 A 130 130 GLU H H 130 8.660 8.256 0.404 1 1 1292 . 16 1 1 A 130 130 GLU HA H 130 4.660 3.962 0.698 1 1 1297 . 16 1 1 A 130 130 GLU C C 130 177.390 177.694 -0.304 1 1 1298 . 16 1 1 A 130 130 GLU CA C 130 55.070 58.520 -3.450 1 1 1299 . 16 1 1 A 130 130 GLU CB C 130 30.860 29.255 1.605 1 1 1301 . 16 1 1 A 130 130 GLU N N 130 123.180 122.969 0.211 1 1 1302 . 16 1 1 A 131 131 GLY H H 131 9.170 8.653 0.517 1 1 1303 . 16 1 1 A 131 131 GLY HA2 H 131 3.560 3.991 -0.431 1 1 1304 . 16 1 1 A 131 131 GLY HA3 H 131 3.750 3.998 -0.248 1 1 1305 . 16 1 1 A 131 131 GLY C C 131 174.550 174.617 -0.067 1 1 1306 . 16 1 1 A 131 131 GLY CA C 131 47.660 45.851 1.809 1 1 1307 . 16 1 1 A 131 131 GLY N N 131 115.530 116.094 -0.564 1 1 1308 . 16 1 1 A 132 132 SER H H 132 8.430 8.117 0.313 1 1 1309 . 16 1 1 A 132 132 SER HA H 132 4.170 4.650 -0.480 1 1 1312 . 16 1 1 A 132 132 SER C C 132 175.350 174.303 1.047 1 1 1313 . 16 1 1 A 132 132 SER CA C 132 59.050 57.549 1.501 1 1 1314 . 16 1 1 A 132 132 SER CB C 132 64.880 62.020 2.860 1 1 1315 . 16 1 1 A 132 132 SER N N 132 115.930 118.309 -2.379 1 1 1316 . 16 1 1 A 133 133 ASN H H 133 8.850 9.024 -0.174 1 1 1317 . 16 1 1 A 133 133 ASN HA H 133 4.910 5.044 -0.134 1 1 1322 . 16 1 1 A 133 133 ASN C C 133 175.450 174.935 0.515 1 1 1323 . 16 1 1 A 133 133 ASN CA C 133 54.920 53.883 1.037 1 1 1324 . 16 1 1 A 133 133 ASN CB C 133 41.060 39.145 1.915 1 1 1325 . 16 1 1 A 133 133 ASN N N 133 125.590 122.907 2.683 1 1 1327 . 16 1 1 A 134 134 LEU H H 134 9.070 9.409 -0.339 1 1 1328 . 16 1 1 A 134 134 LEU HA H 134 5.230 5.466 -0.236 1 1 1338 . 16 1 1 A 134 134 LEU C C 134 175.240 175.662 -0.422 1 1 1339 . 16 1 1 A 134 134 LEU CA C 134 53.470 53.342 0.128 1 1 1340 . 16 1 1 A 134 134 LEU CB C 134 45.090 46.206 -1.116 1 1 1344 . 16 1 1 A 134 134 LEU N N 134 129.210 123.989 5.221 1 1 1345 . 16 1 1 A 135 135 SER H H 135 8.690 8.506 0.184 1 1 1346 . 16 1 1 A 135 135 SER HA H 135 5.280 5.253 0.027 1 1 1349 . 16 1 1 A 135 135 SER C C 135 173.590 172.618 0.972 1 1 1350 . 16 1 1 A 135 135 SER CA C 135 56.220 57.506 -1.286 1 1 1351 . 16 1 1 A 135 135 SER CB C 135 66.510 65.295 1.215 1 1 1352 . 16 1 1 A 135 135 SER N N 135 113.020 114.645 -1.625 1 1 1353 . 16 1 1 A 136 136 VAL H H 136 8.940 8.645 0.295 1 1 1354 . 16 1 1 A 136 136 VAL HA H 136 5.500 4.539 0.961 1 1 1362 . 16 1 1 A 136 136 VAL C C 136 175.730 175.388 0.342 1 1 1363 . 16 1 1 A 136 136 VAL CA C 136 60.960 61.965 -1.005 1 1 1364 . 16 1 1 A 136 136 VAL CB C 136 33.630 31.026 2.604 1 1 1367 . 16 1 1 A 136 136 VAL N N 136 124.340 126.620 -2.280 1 1 1368 . 16 1 1 A 137 137 THR H H 137 9.240 8.560 0.680 1 1 1369 . 16 1 1 A 137 137 THR HA H 137 4.920 4.754 0.166 1 1 1374 . 16 1 1 A 137 137 THR C C 137 173.500 174.093 -0.593 1 1 1375 . 16 1 1 A 137 137 THR CA C 137 59.120 60.245 -1.125 1 1 1376 . 16 1 1 A 137 137 THR CB C 137 72.500 70.448 2.052 1 1 1378 . 16 1 1 A 137 137 THR N N 137 117.010 118.605 -1.595 1 1 1379 . 16 1 1 A 138 138 ASN H H 138 9.190 8.825 0.365 1 1 1380 . 16 1 1 A 138 138 ASN HA H 138 4.420 4.265 0.155 1 1 1385 . 16 1 1 A 138 138 ASN C C 138 175.550 174.309 1.241 1 1 1386 . 16 1 1 A 138 138 ASN CA C 138 54.350 54.296 0.054 1 1 1387 . 16 1 1 A 138 138 ASN CB C 138 37.380 36.474 0.906 1 1 1388 . 16 1 1 A 138 138 ASN N N 138 115.270 118.492 -3.222 1 1 1390 . 16 1 1 A 139 139 SER H H 139 8.560 7.940 0.620 1 1 1391 . 16 1 1 A 139 139 SER HA H 139 5.800 4.261 1.539 1 1 1394 . 16 1 1 A 139 139 SER C C 139 175.750 173.824 1.926 1 1 1395 . 16 1 1 A 139 139 SER CA C 139 56.020 59.472 -3.452 1 1 1396 . 16 1 1 A 139 139 SER CB C 139 65.320 62.667 2.653 1 1 1397 . 16 1 1 A 139 139 SER N N 139 112.360 115.076 -2.716 1 1 1398 . 16 1 1 A 140 140 SER H H 140 9.900 8.699 1.201 1 1 1399 . 16 1 1 A 140 140 SER HA H 140 5.360 5.421 -0.061 1 1 1402 . 16 1 1 A 140 140 SER C C 140 172.620 172.639 -0.019 1 1 1403 . 16 1 1 A 140 140 SER CA C 140 57.400 57.225 0.175 1 1 1404 . 16 1 1 A 140 140 SER CB C 140 66.550 65.426 1.124 1 1 1405 . 16 1 1 A 140 140 SER N N 140 119.130 121.130 -2.000 1 1 1406 . 16 1 1 A 141 141 VAL H H 141 9.030 9.105 -0.075 1 1 1407 . 16 1 1 A 141 141 VAL HA H 141 5.520 5.278 0.242 1 1 1415 . 16 1 1 A 141 141 VAL C C 141 174.750 174.521 0.229 1 1 1416 . 16 1 1 A 141 141 VAL CA C 141 58.310 59.796 -1.486 1 1 1417 . 16 1 1 A 141 141 VAL CB C 141 35.030 35.236 -0.206 1 1 1420 . 16 1 1 A 141 141 VAL N N 141 111.410 124.269 -12.859 1 1 1421 . 16 1 1 A 142 142 GLY H H 142 8.790 9.135 -0.345 1 1 1422 . 16 1 1 A 142 142 GLY HA2 H 142 3.600 4.103 -0.503 1 1 1423 . 16 1 1 A 142 142 GLY HA3 H 142 5.310 4.127 1.183 1 1 1424 . 16 1 1 A 142 142 GLY C C 142 174.180 173.712 0.468 1 1 1425 . 16 1 1 A 142 142 GLY CA C 142 44.110 45.471 -1.361 1 1 1426 . 16 1 1 A 142 142 GLY N N 142 109.330 115.153 -5.823 1 1 1427 . 16 1 1 A 143 143 ASP H H 143 8.840 8.915 -0.075 1 1 1428 . 16 1 1 A 143 143 ASP HA H 143 5.790 5.193 0.597 1 1 1431 . 16 1 1 A 143 143 ASP C C 143 178.860 178.153 0.707 1 1 1432 . 16 1 1 A 143 143 ASP CA C 143 53.040 54.747 -1.707 1 1 1433 . 16 1 1 A 143 143 ASP CB C 143 43.660 42.502 1.158 1 1 1434 . 16 1 1 A 143 143 ASP N N 143 125.390 126.386 -0.996 1 1 1435 . 16 1 1 A 144 144 GLY H H 144 9.150 8.889 0.261 1 1 1436 . 16 1 1 A 144 144 GLY HA2 H 144 3.450 3.685 -0.235 1 1 1437 . 16 1 1 A 144 144 GLY HA3 H 144 3.720 3.912 -0.192 1 1 1438 . 16 1 1 A 144 144 GLY C C 144 174.770 176.063 -1.293 1 1 1439 . 16 1 1 A 144 144 GLY CA C 144 46.930 47.803 -0.873 1 1 1440 . 16 1 1 A 144 144 GLY N N 144 106.470 110.395 -3.925 1 1 1441 . 16 1 1 A 145 145 GLU H H 145 8.470 7.860 0.610 1 1 1442 . 16 1 1 A 145 145 GLU HA H 145 4.460 4.253 0.207 1 1 1447 . 16 1 1 A 145 145 GLU C C 145 176.520 176.190 0.330 1 1 1448 . 16 1 1 A 145 145 GLU CA C 145 55.330 57.246 -1.916 1 1 1449 . 16 1 1 A 145 145 GLU CB C 145 30.620 30.053 0.567 1 1 1451 . 16 1 1 A 145 145 GLU N N 145 119.170 121.133 -1.963 1 1 1452 . 16 1 1 A 146 146 GLY H H 146 7.950 7.883 0.067 1 1 1453 . 16 1 1 A 146 146 GLY HA2 H 146 3.630 4.019 -0.389 1 1 1454 . 16 1 1 A 146 146 GLY HA3 H 146 4.130 4.020 0.110 1 1 1455 . 16 1 1 A 146 146 GLY C C 146 174.350 174.759 -0.409 1 1 1456 . 16 1 1 A 146 146 GLY CA C 146 45.330 45.230 0.100 1 1 1457 . 16 1 1 A 146 146 GLY N N 146 108.130 106.307 1.823 1 1 1458 . 16 1 1 A 147 147 LEU H H 147 8.440 7.891 0.549 1 1 1459 . 16 1 1 A 147 147 LEU HA H 147 4.340 4.379 -0.039 1 1 1469 . 16 1 1 A 147 147 LEU C C 147 175.950 175.548 0.402 1 1 1470 . 16 1 1 A 147 147 LEU CA C 147 54.860 54.848 0.012 1 1 1471 . 16 1 1 A 147 147 LEU CB C 147 41.590 42.367 -0.777 1 1 1475 . 16 1 1 A 147 147 LEU N N 147 124.000 122.370 1.630 1 1 1476 . 16 1 1 A 148 148 VAL H H 148 7.780 8.513 -0.733 1 1 1477 . 16 1 1 A 148 148 VAL HA H 148 4.830 5.319 -0.489 1 1 1485 . 16 1 1 A 148 148 VAL C C 148 175.740 173.434 2.306 1 1 1486 . 16 1 1 A 148 148 VAL CA C 148 61.140 59.380 1.760 1 1 1487 . 16 1 1 A 148 148 VAL CB C 148 33.640 34.463 -0.823 1 1 1490 . 16 1 1 A 148 148 VAL N N 148 120.440 120.865 -0.425 1 1 1491 . 16 1 1 A 149 149 HIS H H 149 9.170 8.534 0.636 1 1 1492 . 16 1 1 A 149 149 HIS HA H 149 4.950 4.990 -0.040 1 1 1496 . 16 1 1 A 149 149 HIS C C 149 174.780 174.385 0.395 1 1 1497 . 16 1 1 A 149 149 HIS CA C 149 53.900 54.404 -0.504 1 1 1498 . 16 1 1 A 149 149 HIS CB C 149 32.200 30.265 1.935 1 1 1499 . 16 1 1 A 149 149 HIS N N 149 124.700 126.579 -1.879 1 1 1500 . 16 1 1 A 150 150 GLU H H 150 9.060 8.781 0.279 1 1 1501 . 16 1 1 A 150 150 GLU HA H 150 4.420 4.652 -0.232 1 1 1506 . 16 1 1 A 150 150 GLU C C 150 176.520 175.993 0.527 1 1 1507 . 16 1 1 A 150 150 GLU CA C 150 57.630 57.411 0.219 1 1 1508 . 16 1 1 A 150 150 GLU CB C 150 30.370 30.032 0.338 1 1 1510 . 16 1 1 A 150 150 GLU N N 150 125.540 124.872 0.668 1 1 1511 . 16 1 1 A 151 151 ILE H H 151 8.150 8.265 -0.115 1 1 1512 . 16 1 1 A 151 151 ILE HA H 151 4.780 4.510 0.270 1 1 1522 . 16 1 1 A 151 151 ILE C C 151 174.570 176.203 -1.633 1 1 1523 . 16 1 1 A 151 151 ILE CA C 151 59.390 59.590 -0.200 1 1 1524 . 16 1 1 A 151 151 ILE CB C 151 42.040 39.197 2.843 1 1 1528 . 16 1 1 A 151 151 ILE N N 151 115.880 123.606 -7.726 1 1 1529 . 16 1 1 A 152 152 ALA H H 152 8.010 8.383 -0.373 1 1 1530 . 16 1 1 A 152 152 ALA HA H 152 4.310 4.370 -0.060 1 1 1534 . 16 1 1 A 152 152 ALA C C 152 177.500 176.860 0.640 1 1 1535 . 16 1 1 A 152 152 ALA CA C 152 53.680 51.682 1.998 1 1 1536 . 16 1 1 A 152 152 ALA CB C 152 20.050 19.842 0.208 1 1 1537 . 16 1 1 A 152 152 ALA N N 152 126.640 124.371 2.269 1 1 1538 . 16 1 1 A 153 153 GLY H H 153 8.340 8.347 -0.007 1 1 1539 . 16 1 1 A 153 153 GLY HA2 H 153 4.050 4.348 -0.298 1 1 1540 . 16 1 1 A 153 153 GLY HA3 H 153 4.140 4.349 -0.209 1 1 1541 . 16 1 1 A 153 153 GLY C C 153 173.140 171.909 1.231 1 1 1542 . 16 1 1 A 153 153 GLY CA C 153 44.130 45.697 -1.567 1 1 1543 . 16 1 1 A 153 153 GLY N N 153 107.490 105.277 2.213 1 1 1544 . 16 1 1 A 154 154 THR H H 154 7.380 8.418 -1.038 1 1 1545 . 16 1 1 A 154 154 THR HA H 154 4.700 5.030 -0.330 1 1 1550 . 16 1 1 A 154 154 THR C C 154 171.120 174.050 -2.930 1 1 1551 . 16 1 1 A 154 154 THR CA C 154 60.830 61.025 -0.195 1 1 1552 . 16 1 1 A 154 154 THR CB C 154 68.850 72.408 -3.558 1 1 1554 . 16 1 1 A 154 154 THR N N 154 109.340 114.082 -4.742 1 1 1555 . 16 1 1 A 155 155 GLU H H 155 8.020 8.703 -0.683 1 1 1556 . 16 1 1 A 155 155 GLU HA H 155 5.370 5.261 0.109 1 1 1561 . 16 1 1 A 155 155 GLU C C 155 174.240 174.910 -0.670 1 1 1562 . 16 1 1 A 155 155 GLU CA C 155 54.830 54.951 -0.121 1 1 1563 . 16 1 1 A 155 155 GLU CB C 155 33.620 32.234 1.386 1 1 1565 . 16 1 1 A 155 155 GLU N N 155 118.690 123.089 -4.399 1 1 1566 . 16 1 1 A 156 156 LYS H H 156 9.230 8.464 0.766 1 1 1567 . 16 1 1 A 156 156 LYS HA H 156 4.650 4.821 -0.171 1 1 1576 . 16 1 1 A 156 156 LYS C C 156 174.000 174.638 -0.638 1 1 1577 . 16 1 1 A 156 156 LYS CA C 156 55.840 55.713 0.127 1 1 1578 . 16 1 1 A 156 156 LYS CB C 156 37.550 36.954 0.596 1 1 1582 . 16 1 1 A 156 156 LYS N N 156 121.940 120.776 1.164 1 1 1583 . 16 1 1 A 157 157 THR H H 157 8.160 8.757 -0.597 1 1 1584 . 16 1 1 A 157 157 THR HA H 157 5.440 5.199 0.241 1 1 1589 . 16 1 1 A 157 157 THR C C 157 174.360 174.070 0.290 1 1 1590 . 16 1 1 A 157 157 THR CA C 157 60.410 59.917 0.493 1 1 1591 . 16 1 1 A 157 157 THR CB C 157 71.500 71.637 -0.137 1 1 1593 . 16 1 1 A 157 157 THR N N 157 113.240 112.885 0.355 1 1 1594 . 16 1 1 A 158 158 VAL H H 158 9.120 9.028 0.092 1 1 1595 . 16 1 1 A 158 158 VAL HA H 158 4.580 5.289 -0.709 1 1 1603 . 16 1 1 A 158 158 VAL C C 158 172.800 174.178 -1.378 1 1 1604 . 16 1 1 A 158 158 VAL CA C 158 59.980 59.688 0.292 1 1 1605 . 16 1 1 A 158 158 VAL CB C 158 36.290 35.379 0.911 1 1 1608 . 16 1 1 A 158 158 VAL N N 158 121.710 119.059 2.651 1 1 1609 . 16 1 1 A 159 159 ASN H H 159 8.240 8.792 -0.552 1 1 1610 . 16 1 1 A 159 159 ASN HA H 159 5.420 5.168 0.252 1 1 1615 . 16 1 1 A 159 159 ASN C C 159 173.800 174.081 -0.281 1 1 1616 . 16 1 1 A 159 159 ASN CA C 159 51.740 52.355 -0.615 1 1 1617 . 16 1 1 A 159 159 ASN CB C 159 40.380 39.424 0.956 1 1 1618 . 16 1 1 A 159 159 ASN N N 159 122.730 123.485 -0.755 1 1 1620 . 16 1 1 A 160 160 ILE H H 160 9.160 8.737 0.423 1 1 1621 . 16 1 1 A 160 160 ILE HA H 160 5.130 4.896 0.234 1 1 1631 . 16 1 1 A 160 160 ILE C C 160 177.320 175.738 1.582 1 1 1632 . 16 1 1 A 160 160 ILE CA C 160 60.640 60.847 -0.207 1 1 1633 . 16 1 1 A 160 160 ILE CB C 160 38.520 37.708 0.812 1 1 1637 . 16 1 1 A 160 160 ILE N N 160 123.690 125.765 -2.075 1 1 1638 . 16 1 1 A 161 161 ILE H H 161 8.780 8.891 -0.111 1 1 1639 . 16 1 1 A 161 161 ILE HA H 161 4.590 4.452 0.138 1 1 1649 . 16 1 1 A 161 161 ILE C C 161 174.960 175.804 -0.844 1 1 1650 . 16 1 1 A 161 161 ILE CA C 161 59.320 60.407 -1.087 1 1 1651 . 16 1 1 A 161 161 ILE CB C 161 41.030 38.897 2.133 1 1 1655 . 16 1 1 A 161 161 ILE N N 161 122.490 129.027 -6.537 1 1 1656 . 16 1 1 A 162 162 GLU H H 162 8.620 8.586 0.034 1 1 1657 . 16 1 1 A 162 162 GLU HA H 162 4.290 4.237 0.053 1 1 1662 . 16 1 1 A 162 162 GLU C C 162 176.660 176.825 -0.165 1 1 1663 . 16 1 1 A 162 162 GLU CA C 162 56.470 57.575 -1.105 1 1 1664 . 16 1 1 A 162 162 GLU CB C 162 31.150 30.539 0.611 1 1 1666 . 16 1 1 A 162 162 GLU N N 162 120.520 127.226 -6.706 1 1 1667 . 16 1 1 A 163 163 GLY H H 163 8.480 8.253 0.227 1 1 1668 . 16 1 1 A 163 163 GLY HA2 H 163 3.910 4.081 -0.171 1 1 1669 . 16 1 1 A 163 163 GLY HA3 H 163 4.150 4.083 0.067 1 1 1670 . 16 1 1 A 163 163 GLY C C 163 174.000 173.540 0.460 1 1 1671 . 16 1 1 A 163 163 GLY CA C 163 45.270 44.410 0.860 1 1 1672 . 16 1 1 A 163 163 GLY N N 163 110.210 110.391 -0.181 1 1 1673 . 16 1 1 A 164 164 THR H H 164 8.170 8.318 -0.148 1 1 1674 . 16 1 1 A 164 164 THR HA H 164 4.410 4.463 -0.053 1 1 1679 . 16 1 1 A 164 164 THR C C 164 174.100 173.556 0.544 1 1 1680 . 16 1 1 A 164 164 THR CA C 164 61.620 62.340 -0.720 1 1 1681 . 16 1 1 A 164 164 THR CB C 164 70.060 69.568 0.492 1 1 1683 . 16 1 1 A 164 164 THR N N 164 113.480 117.019 -3.539 1 1 1 . 17 1 1 A 13 13 GLY H H 13 8.350 8.036 0.314 1 1 2 . 17 1 1 A 13 13 GLY HA2 H 13 3.920 3.927 -0.007 1 1 3 . 17 1 1 A 13 13 GLY HA3 H 13 3.920 3.939 -0.019 1 1 4 . 17 1 1 A 13 13 GLY CA C 13 45.290 45.866 -0.576 1 1 5 . 17 1 1 A 13 13 GLY N N 13 110.450 108.606 1.844 1 1 6 . 17 1 1 A 14 14 LEU H H 14 8.050 8.834 -0.784 1 1 7 . 17 1 1 A 14 14 LEU N N 14 121.500 127.288 -5.788 1 1 8 . 17 1 1 A 15 15 VAL H H 15 8.070 7.502 0.568 1 1 9 . 17 1 1 A 15 15 VAL N N 15 122.390 116.001 6.389 1 1 10 . 17 1 1 A 16 16 PRO HA H 16 4.360 4.482 -0.122 1 1 17 . 17 1 1 A 16 16 PRO CA C 16 62.770 63.332 -0.562 1 1 18 . 17 1 1 A 16 16 PRO CB C 16 32.020 32.506 -0.486 1 1 21 . 17 1 1 A 21 21 MET H H 21 8.180 8.392 -0.212 1 1 22 . 17 1 1 A 21 21 MET N N 21 121.310 121.185 0.125 1 1 23 . 17 1 1 A 22 22 ALA H H 22 8.290 8.440 -0.150 1 1 24 . 17 1 1 A 22 22 ALA N N 22 124.800 124.370 0.430 1 1 25 . 17 1 1 A 23 23 SER H H 23 8.210 8.823 -0.613 1 1 26 . 17 1 1 A 23 23 SER N N 23 114.830 121.024 -6.194 1 1 27 . 17 1 1 A 24 24 LYS H H 24 8.250 8.454 -0.204 1 1 28 . 17 1 1 A 24 24 LYS N N 24 122.980 120.410 2.570 1 1 29 . 17 1 1 A 25 25 LEU H H 25 8.140 8.241 -0.101 1 1 30 . 17 1 1 A 25 25 LEU HA H 25 4.290 4.609 -0.319 1 1 40 . 17 1 1 A 25 25 LEU C C 25 177.410 176.912 0.498 1 1 41 . 17 1 1 A 25 25 LEU CA C 25 55.430 53.938 1.492 1 1 42 . 17 1 1 A 25 25 LEU CB C 25 42.350 44.597 -2.247 1 1 46 . 17 1 1 A 25 25 LEU N N 25 122.580 125.127 -2.547 1 1 47 . 17 1 1 A 26 26 LYS H H 26 8.200 9.196 -0.996 1 1 48 . 17 1 1 A 26 26 LYS HA H 26 4.260 3.890 0.370 1 1 57 . 17 1 1 A 26 26 LYS C C 26 176.520 175.414 1.106 1 1 58 . 17 1 1 A 26 26 LYS CA C 26 56.700 57.261 -0.561 1 1 59 . 17 1 1 A 26 26 LYS CB C 26 33.060 31.201 1.859 1 1 63 . 17 1 1 A 26 26 LYS N N 26 121.800 122.680 -0.880 1 1 64 . 17 1 1 A 27 27 GLU H H 27 8.380 8.514 -0.134 1 1 65 . 17 1 1 A 27 27 GLU HA H 27 4.240 4.284 -0.044 1 1 70 . 17 1 1 A 27 27 GLU C C 27 176.130 175.395 0.735 1 1 71 . 17 1 1 A 27 27 GLU CA C 27 56.700 58.623 -1.923 1 1 72 . 17 1 1 A 27 27 GLU CB C 27 30.370 28.528 1.842 1 1 74 . 17 1 1 A 27 27 GLU N N 27 121.700 112.490 9.210 1 1 75 . 17 1 1 A 28 28 ALA H H 28 8.230 8.705 -0.475 1 1 76 . 17 1 1 A 28 28 ALA HA H 28 4.280 5.410 -1.130 1 1 80 . 17 1 1 A 28 28 ALA C C 28 177.090 175.924 1.166 1 1 81 . 17 1 1 A 28 28 ALA CA C 28 52.530 50.317 2.213 1 1 82 . 17 1 1 A 28 28 ALA CB C 28 19.360 22.425 -3.065 1 1 83 . 17 1 1 A 28 28 ALA N N 28 124.640 123.721 0.919 1 1 84 . 17 1 1 A 29 29 ALA H H 29 8.150 8.634 -0.484 1 1 85 . 17 1 1 A 29 29 ALA HA H 29 4.320 4.886 -0.566 1 1 89 . 17 1 1 A 29 29 ALA C C 29 177.120 175.784 1.336 1 1 90 . 17 1 1 A 29 29 ALA CA C 29 52.040 51.924 0.116 1 1 91 . 17 1 1 A 29 29 ALA CB C 29 19.430 18.750 0.680 1 1 92 . 17 1 1 A 29 29 ALA N N 29 123.430 123.892 -0.462 1 1 93 . 17 1 1 A 30 30 GLU H H 30 8.310 8.802 -0.492 1 1 94 . 17 1 1 A 30 30 GLU HA H 30 4.220 4.879 -0.659 1 1 99 . 17 1 1 A 30 30 GLU C C 30 176.310 175.963 0.347 1 1 100 . 17 1 1 A 30 30 GLU CA C 30 56.630 55.037 1.593 1 1 101 . 17 1 1 A 30 30 GLU CB C 30 30.320 31.383 -1.063 1 1 103 . 17 1 1 A 30 30 GLU N N 30 120.630 122.482 -1.852 1 1 104 . 17 1 1 A 31 31 VAL H H 31 8.630 8.765 -0.135 1 1 105 . 17 1 1 A 31 31 VAL HA H 31 4.430 4.698 -0.268 1 1 113 . 17 1 1 A 31 31 VAL C C 31 176.510 176.070 0.440 1 1 114 . 17 1 1 A 31 31 VAL CA C 31 62.360 63.273 -0.913 1 1 115 . 17 1 1 A 31 31 VAL CB C 31 32.370 31.672 0.698 1 1 118 . 17 1 1 A 31 31 VAL N N 31 127.110 125.838 1.272 1 1 119 . 17 1 1 A 32 32 THR H H 32 7.640 8.660 -1.020 1 1 120 . 17 1 1 A 32 32 THR HA H 32 4.870 4.081 0.789 1 1 125 . 17 1 1 A 32 32 THR C C 32 172.220 174.768 -2.548 1 1 126 . 17 1 1 A 32 32 THR CA C 32 59.510 64.196 -4.686 1 1 127 . 17 1 1 A 32 32 THR CB C 32 71.630 69.966 1.664 1 1 129 . 17 1 1 A 32 32 THR N N 32 118.860 120.626 -1.766 1 1 130 . 17 1 1 A 33 33 GLY H H 33 8.350 7.883 0.467 1 1 131 . 17 1 1 A 33 33 GLY HA2 H 33 4.160 4.069 0.091 1 1 132 . 17 1 1 A 33 33 GLY HA3 H 33 4.250 4.071 0.179 1 1 133 . 17 1 1 A 33 33 GLY C C 33 172.820 172.713 0.107 1 1 134 . 17 1 1 A 33 33 GLY CA C 33 46.680 44.773 1.907 1 1 135 . 17 1 1 A 33 33 GLY N N 33 106.720 108.775 -2.055 1 1 136 . 17 1 1 A 34 34 SER H H 34 8.810 8.191 0.619 1 1 137 . 17 1 1 A 34 34 SER HA H 34 5.390 4.945 0.445 1 1 140 . 17 1 1 A 34 34 SER C C 34 173.780 172.751 1.029 1 1 141 . 17 1 1 A 34 34 SER CA C 34 57.380 57.486 -0.106 1 1 142 . 17 1 1 A 34 34 SER CB C 34 65.730 65.453 0.277 1 1 143 . 17 1 1 A 34 34 SER N N 34 112.690 119.140 -6.450 1 1 144 . 17 1 1 A 35 35 VAL H H 35 8.470 8.670 -0.200 1 1 145 . 17 1 1 A 35 35 VAL HA H 35 4.120 4.940 -0.820 1 1 153 . 17 1 1 A 35 35 VAL C C 35 174.750 174.957 -0.207 1 1 154 . 17 1 1 A 35 35 VAL CA C 35 62.310 60.715 1.595 1 1 155 . 17 1 1 A 35 35 VAL CB C 35 34.550 33.325 1.225 1 1 158 . 17 1 1 A 35 35 VAL N N 35 123.150 121.784 1.366 1 1 159 . 17 1 1 A 36 36 SER H H 36 8.240 9.007 -0.767 1 1 160 . 17 1 1 A 36 36 SER HA H 36 4.690 5.042 -0.352 1 1 163 . 17 1 1 A 36 36 SER C C 36 171.860 173.241 -1.381 1 1 164 . 17 1 1 A 36 36 SER CA C 36 56.020 56.677 -0.657 1 1 165 . 17 1 1 A 36 36 SER CB C 36 66.050 64.253 1.797 1 1 166 . 17 1 1 A 36 36 SER N N 36 118.760 120.894 -2.134 1 1 167 . 17 1 1 A 37 37 LEU H H 37 8.310 9.014 -0.704 1 1 168 . 17 1 1 A 37 37 LEU HA H 37 4.870 4.977 -0.107 1 1 178 . 17 1 1 A 37 37 LEU C C 37 174.190 175.593 -1.403 1 1 179 . 17 1 1 A 37 37 LEU CA C 37 53.870 53.683 0.187 1 1 180 . 17 1 1 A 37 37 LEU CB C 37 47.000 43.480 3.520 1 1 184 . 17 1 1 A 37 37 LEU N N 37 124.790 127.330 -2.540 1 1 185 . 17 1 1 A 38 38 GLU H H 38 9.270 8.931 0.339 1 1 186 . 17 1 1 A 38 38 GLU HA H 38 4.650 5.265 -0.615 1 1 191 . 17 1 1 A 38 38 GLU C C 38 173.970 175.433 -1.463 1 1 192 . 17 1 1 A 38 38 GLU CA C 38 54.410 55.295 -0.885 1 1 193 . 17 1 1 A 38 38 GLU CB C 38 32.460 32.334 0.126 1 1 195 . 17 1 1 A 38 38 GLU N N 38 126.550 126.606 -0.056 1 1 196 . 17 1 1 A 39 39 ALA H H 39 8.120 8.482 -0.362 1 1 197 . 17 1 1 A 39 39 ALA HA H 39 4.600 4.703 -0.103 1 1 201 . 17 1 1 A 39 39 ALA C C 39 175.930 177.138 -1.208 1 1 202 . 17 1 1 A 39 39 ALA CA C 39 51.570 51.214 0.356 1 1 203 . 17 1 1 A 39 39 ALA CB C 39 21.780 22.733 -0.953 1 1 204 . 17 1 1 A 39 39 ALA N N 39 124.410 128.277 -3.867 1 1 205 . 17 1 1 A 40 40 LEU H H 40 7.860 9.042 -1.182 1 1 206 . 17 1 1 A 40 40 LEU HA H 40 4.230 4.016 0.214 1 1 216 . 17 1 1 A 40 40 LEU C C 40 175.940 176.701 -0.761 1 1 217 . 17 1 1 A 40 40 LEU CA C 40 55.360 57.314 -1.954 1 1 218 . 17 1 1 A 40 40 LEU CB C 40 42.990 42.233 0.757 1 1 222 . 17 1 1 A 40 40 LEU N N 40 120.640 121.951 -1.311 1 1 223 . 17 1 1 A 41 41 GLU H H 41 8.210 7.879 0.331 1 1 224 . 17 1 1 A 41 41 GLU HA H 41 4.240 4.343 -0.103 1 1 229 . 17 1 1 A 41 41 GLU C C 41 176.920 174.794 2.126 1 1 230 . 17 1 1 A 41 41 GLU CA C 41 58.090 57.750 0.340 1 1 231 . 17 1 1 A 41 41 GLU CB C 41 30.530 27.157 3.373 1 1 233 . 17 1 1 A 41 41 GLU N N 41 114.680 116.432 -1.752 1 1 234 . 17 1 1 A 42 42 GLU H H 42 7.490 7.709 -0.219 1 1 235 . 17 1 1 A 42 42 GLU HA H 42 5.680 4.793 0.887 1 1 240 . 17 1 1 A 42 42 GLU C C 42 173.790 174.143 -0.353 1 1 241 . 17 1 1 A 42 42 GLU CA C 42 54.360 56.168 -1.808 1 1 242 . 17 1 1 A 42 42 GLU CB C 42 33.850 33.325 0.525 1 1 244 . 17 1 1 A 42 42 GLU N N 42 116.670 118.001 -1.331 1 1 245 . 17 1 1 A 43 43 VAL H H 43 8.550 8.865 -0.315 1 1 246 . 17 1 1 A 43 43 VAL HA H 43 4.550 4.877 -0.327 1 1 254 . 17 1 1 A 43 43 VAL C C 43 172.220 173.401 -1.181 1 1 255 . 17 1 1 A 43 43 VAL CA C 43 59.470 59.336 0.134 1 1 256 . 17 1 1 A 43 43 VAL CB C 43 35.470 35.821 -0.351 1 1 259 . 17 1 1 A 43 43 VAL N N 43 120.030 123.625 -3.595 1 1 260 . 17 1 1 A 44 44 GLN H H 44 8.470 8.849 -0.379 1 1 261 . 17 1 1 A 44 44 GLN HA H 44 4.890 5.182 -0.292 1 1 268 . 17 1 1 A 44 44 GLN C C 44 176.130 174.867 1.263 1 1 269 . 17 1 1 A 44 44 GLN CA C 44 54.360 54.020 0.340 1 1 270 . 17 1 1 A 44 44 GLN CB C 44 30.610 32.433 -1.823 1 1 272 . 17 1 1 A 44 44 GLN N N 44 124.690 123.692 0.998 1 1 274 . 17 1 1 A 45 45 VAL H H 45 8.130 8.354 -0.224 1 1 275 . 17 1 1 A 45 45 VAL HA H 45 3.030 3.917 -0.887 1 1 283 . 17 1 1 A 45 45 VAL C C 45 176.710 177.251 -0.541 1 1 284 . 17 1 1 A 45 45 VAL CA C 45 65.810 64.655 1.155 1 1 285 . 17 1 1 A 45 45 VAL CB C 45 31.960 31.469 0.491 1 1 288 . 17 1 1 A 45 45 VAL N N 45 120.450 126.784 -6.334 1 1 289 . 17 1 1 A 46 46 GLY H H 46 8.950 9.941 -0.991 1 1 290 . 17 1 1 A 46 46 GLY HA2 H 46 3.590 3.909 -0.319 1 1 291 . 17 1 1 A 46 46 GLY HA3 H 46 4.410 3.912 0.498 1 1 292 . 17 1 1 A 46 46 GLY C C 46 174.390 173.335 1.055 1 1 293 . 17 1 1 A 46 46 GLY CA C 46 44.730 45.519 -0.789 1 1 294 . 17 1 1 A 46 46 GLY N N 46 116.490 114.693 1.797 1 1 295 . 17 1 1 A 47 47 GLU H H 47 8.260 7.657 0.603 1 1 296 . 17 1 1 A 47 47 GLU HA H 47 4.460 4.875 -0.415 1 1 301 . 17 1 1 A 47 47 GLU C C 47 174.780 174.546 0.234 1 1 302 . 17 1 1 A 47 47 GLU CA C 47 54.830 55.145 -0.315 1 1 303 . 17 1 1 A 47 47 GLU CB C 47 31.140 33.681 -2.541 1 1 305 . 17 1 1 A 47 47 GLU N N 47 120.520 119.396 1.124 1 1 306 . 17 1 1 A 48 48 ASN H H 48 8.440 8.934 -0.494 1 1 307 . 17 1 1 A 48 48 ASN HA H 48 5.380 5.651 -0.271 1 1 312 . 17 1 1 A 48 48 ASN C C 48 174.770 174.356 0.414 1 1 313 . 17 1 1 A 48 48 ASN CA C 48 51.570 51.400 0.170 1 1 314 . 17 1 1 A 48 48 ASN CB C 48 39.010 42.458 -3.448 1 1 315 . 17 1 1 A 48 48 ASN N N 48 117.180 119.318 -2.138 1 1 317 . 17 1 1 A 49 49 LEU H H 49 9.810 8.808 1.002 1 1 318 . 17 1 1 A 49 49 LEU HA H 49 4.510 5.098 -0.588 1 1 328 . 17 1 1 A 49 49 LEU C C 49 174.560 175.576 -1.016 1 1 329 . 17 1 1 A 49 49 LEU CA C 49 53.460 52.589 0.871 1 1 330 . 17 1 1 A 49 49 LEU CB C 49 45.520 44.322 1.198 1 1 333 . 17 1 1 A 49 49 LEU N N 49 125.620 119.789 5.831 1 1 334 . 17 1 1 A 50 50 GLU H H 50 8.750 8.791 -0.041 1 1 335 . 17 1 1 A 50 50 GLU HA H 50 4.360 4.946 -0.586 1 1 340 . 17 1 1 A 50 50 GLU C C 50 175.340 174.570 0.770 1 1 341 . 17 1 1 A 50 50 GLU CA C 50 55.550 55.325 0.225 1 1 342 . 17 1 1 A 50 50 GLU CB C 50 29.890 30.916 -1.026 1 1 344 . 17 1 1 A 50 50 GLU N N 50 125.420 119.182 6.238 1 1 345 . 17 1 1 A 51 51 VAL H H 51 9.230 8.930 0.300 1 1 346 . 17 1 1 A 51 51 VAL HA H 51 4.190 4.781 -0.591 1 1 354 . 17 1 1 A 51 51 VAL C C 51 175.310 174.679 0.631 1 1 355 . 17 1 1 A 51 51 VAL CA C 51 62.520 61.143 1.377 1 1 356 . 17 1 1 A 51 51 VAL CB C 51 31.470 33.425 -1.955 1 1 359 . 17 1 1 A 51 51 VAL N N 51 129.810 125.566 4.244 1 1 360 . 17 1 1 A 52 52 GLY H H 52 9.410 8.667 0.743 1 1 361 . 17 1 1 A 52 52 GLY HA2 H 52 3.460 4.024 -0.564 1 1 362 . 17 1 1 A 52 52 GLY HA3 H 52 4.680 4.076 0.604 1 1 363 . 17 1 1 A 52 52 GLY C C 52 173.000 172.813 0.187 1 1 364 . 17 1 1 A 52 52 GLY CA C 52 46.470 46.487 -0.017 1 1 365 . 17 1 1 A 52 52 GLY N N 52 116.600 116.717 -0.117 1 1 366 . 17 1 1 A 53 53 VAL H H 53 9.130 8.381 0.749 1 1 367 . 17 1 1 A 53 53 VAL HA H 53 4.840 4.714 0.126 1 1 375 . 17 1 1 A 53 53 VAL C C 53 175.470 175.471 -0.001 1 1 376 . 17 1 1 A 53 53 VAL CA C 53 61.350 61.287 0.063 1 1 377 . 17 1 1 A 53 53 VAL CB C 53 34.300 31.596 2.704 1 1 380 . 17 1 1 A 53 53 VAL N N 53 129.050 126.390 2.660 1 1 381 . 17 1 1 A 54 54 GLY H H 54 8.420 8.810 -0.390 1 1 382 . 17 1 1 A 54 54 GLY HA2 H 54 3.850 3.618 0.232 1 1 383 . 17 1 1 A 54 54 GLY HA3 H 54 3.850 3.842 0.008 1 1 384 . 17 1 1 A 54 54 GLY C C 54 173.310 172.866 0.444 1 1 385 . 17 1 1 A 54 54 GLY CA C 54 45.180 44.082 1.098 1 1 386 . 17 1 1 A 54 54 GLY N N 54 116.890 115.341 1.549 1 1 387 . 17 1 1 A 55 55 ILE H H 55 10.190 8.001 2.189 1 1 388 . 17 1 1 A 55 55 ILE HA H 55 4.010 4.508 -0.498 1 1 398 . 17 1 1 A 55 55 ILE C C 55 174.380 175.529 -1.149 1 1 399 . 17 1 1 A 55 55 ILE CA C 55 61.350 60.285 1.065 1 1 400 . 17 1 1 A 55 55 ILE CB C 55 40.840 39.254 1.586 1 1 404 . 17 1 1 A 55 55 ILE N N 55 129.330 121.176 8.154 1 1 405 . 17 1 1 A 56 56 ASP H H 56 8.810 9.830 -1.020 1 1 406 . 17 1 1 A 56 56 ASP HA H 56 4.440 4.710 -0.270 1 1 409 . 17 1 1 A 56 56 ASP C C 56 175.530 175.219 0.311 1 1 410 . 17 1 1 A 56 56 ASP CA C 56 56.460 55.258 1.202 1 1 411 . 17 1 1 A 56 56 ASP CB C 56 42.720 42.882 -0.162 1 1 412 . 17 1 1 A 56 56 ASP N N 56 128.310 127.426 0.884 1 1 413 . 17 1 1 A 57 57 GLU H H 57 7.270 7.548 -0.278 1 1 414 . 17 1 1 A 57 57 GLU HA H 57 4.290 4.847 -0.557 1 1 419 . 17 1 1 A 57 57 GLU C C 57 173.370 174.439 -1.069 1 1 420 . 17 1 1 A 57 57 GLU CA C 57 54.840 55.423 -0.583 1 1 421 . 17 1 1 A 57 57 GLU CB C 57 33.190 33.666 -0.476 1 1 423 . 17 1 1 A 57 57 GLU N N 57 112.810 116.201 -3.391 1 1 424 . 17 1 1 A 58 58 LEU H H 58 8.370 8.483 -0.113 1 1 425 . 17 1 1 A 58 58 LEU HA H 58 4.830 4.682 0.148 1 1 434 . 17 1 1 A 58 58 LEU C C 58 174.180 174.727 -0.547 1 1 435 . 17 1 1 A 58 58 LEU CA C 58 55.320 54.914 0.406 1 1 436 . 17 1 1 A 58 58 LEU CB C 58 44.300 43.095 1.205 1 1 439 . 17 1 1 A 58 58 LEU N N 58 123.130 125.030 -1.900 1 1 440 . 17 1 1 A 59 59 VAL H H 59 9.120 8.920 0.200 1 1 441 . 17 1 1 A 59 59 VAL HA H 59 4.240 4.641 -0.401 1 1 449 . 17 1 1 A 59 59 VAL C C 59 174.960 175.430 -0.470 1 1 450 . 17 1 1 A 59 59 VAL CA C 59 61.760 59.977 1.783 1 1 451 . 17 1 1 A 59 59 VAL CB C 59 33.760 33.231 0.529 1 1 454 . 17 1 1 A 59 59 VAL N N 59 127.930 125.703 2.227 1 1 455 . 17 1 1 A 60 60 ASN H H 60 8.770 8.494 0.276 1 1 456 . 17 1 1 A 60 60 ASN HA H 60 4.250 4.789 -0.539 1 1 461 . 17 1 1 A 60 60 ASN C C 60 172.810 173.834 -1.024 1 1 462 . 17 1 1 A 60 60 ASN CA C 60 54.830 54.608 0.222 1 1 463 . 17 1 1 A 60 60 ASN CB C 60 36.030 36.508 -0.478 1 1 464 . 17 1 1 A 60 60 ASN N N 60 115.500 122.193 -6.693 1 1 466 . 17 1 1 A 61 61 ALA H H 61 7.330 7.366 -0.036 1 1 467 . 17 1 1 A 61 61 ALA HA H 61 4.520 4.611 -0.091 1 1 471 . 17 1 1 A 61 61 ALA C C 61 174.580 174.754 -0.174 1 1 472 . 17 1 1 A 61 61 ALA CA C 61 51.560 51.193 0.367 1 1 473 . 17 1 1 A 61 61 ALA CB C 61 22.870 22.607 0.263 1 1 474 . 17 1 1 A 61 61 ALA N N 61 115.640 117.432 -1.792 1 1 475 . 17 1 1 A 62 62 GLU H H 62 7.900 9.365 -1.465 1 1 476 . 17 1 1 A 62 62 GLU HA H 62 4.310 4.859 -0.549 1 1 481 . 17 1 1 A 62 62 GLU C C 62 173.790 175.494 -1.704 1 1 482 . 17 1 1 A 62 62 GLU CA C 62 55.080 54.890 0.190 1 1 483 . 17 1 1 A 62 62 GLU CB C 62 32.610 30.636 1.974 1 1 485 . 17 1 1 A 62 62 GLU N N 62 117.400 118.300 -0.900 1 1 486 . 17 1 1 A 63 63 ALA H H 63 8.910 8.713 0.197 1 1 487 . 17 1 1 A 63 63 ALA HA H 63 4.690 4.507 0.183 1 1 491 . 17 1 1 A 63 63 ALA C C 63 175.720 176.779 -1.059 1 1 492 . 17 1 1 A 63 63 ALA CA C 63 50.600 53.233 -2.633 1 1 493 . 17 1 1 A 63 63 ALA CB C 63 20.660 19.200 1.460 1 1 494 . 17 1 1 A 63 63 ALA N N 63 122.480 128.532 -6.052 1 1 495 . 17 1 1 A 64 64 PHE H H 64 9.220 9.180 0.040 1 1 496 . 17 1 1 A 64 64 PHE HA H 64 4.320 4.817 -0.497 1 1 501 . 17 1 1 A 64 64 PHE C C 64 174.380 175.773 -1.393 1 1 502 . 17 1 1 A 64 64 PHE CA C 64 59.770 59.013 0.757 1 1 503 . 17 1 1 A 64 64 PHE CB C 64 40.830 41.367 -0.537 1 1 504 . 17 1 1 A 64 64 PHE N N 64 120.870 121.576 -0.706 1 1 505 . 17 1 1 A 65 65 ALA H H 65 8.150 7.994 0.156 1 1 506 . 17 1 1 A 65 65 ALA HA H 65 5.280 4.880 0.400 1 1 510 . 17 1 1 A 65 65 ALA C C 65 175.950 175.324 0.626 1 1 511 . 17 1 1 A 65 65 ALA CA C 65 51.120 50.831 0.289 1 1 512 . 17 1 1 A 65 65 ALA CB C 65 22.850 21.225 1.625 1 1 513 . 17 1 1 A 65 65 ALA N N 65 122.350 119.924 2.426 1 1 514 . 17 1 1 A 66 66 TYR H H 66 9.260 9.318 -0.058 1 1 515 . 17 1 1 A 66 66 TYR HA H 66 5.710 4.915 0.795 1 1 520 . 17 1 1 A 66 66 TYR C C 66 175.690 173.887 1.803 1 1 521 . 17 1 1 A 66 66 TYR CA C 66 54.390 56.891 -2.501 1 1 522 . 17 1 1 A 66 66 TYR CB C 66 41.560 39.027 2.533 1 1 523 . 17 1 1 A 66 66 TYR N N 66 124.350 126.973 -2.623 1 1 524 . 17 1 1 A 67 67 ASP H H 67 9.070 8.972 0.098 1 1 525 . 17 1 1 A 67 67 ASP HA H 67 5.630 5.273 0.357 1 1 528 . 17 1 1 A 67 67 ASP C C 67 174.300 175.040 -0.740 1 1 529 . 17 1 1 A 67 67 ASP CA C 67 51.590 53.675 -2.085 1 1 530 . 17 1 1 A 67 67 ASP CB C 67 44.380 42.175 2.205 1 1 531 . 17 1 1 A 67 67 ASP N N 67 130.490 127.454 3.036 1 1 532 . 17 1 1 A 68 68 PHE H H 68 8.670 8.344 0.326 1 1 533 . 17 1 1 A 68 68 PHE HA H 68 4.890 5.279 -0.389 1 1 538 . 17 1 1 A 68 68 PHE C C 68 172.220 172.290 -0.070 1 1 539 . 17 1 1 A 68 68 PHE CA C 68 57.360 55.767 1.593 1 1 540 . 17 1 1 A 68 68 PHE CB C 68 40.360 42.292 -1.932 1 1 541 . 17 1 1 A 68 68 PHE N N 68 118.200 119.787 -1.587 1 1 542 . 17 1 1 A 69 69 THR H H 69 8.390 8.444 -0.054 1 1 543 . 17 1 1 A 69 69 THR HA H 69 5.170 5.266 -0.096 1 1 548 . 17 1 1 A 69 69 THR C C 69 172.620 171.857 0.763 1 1 549 . 17 1 1 A 69 69 THR CA C 69 61.370 59.416 1.954 1 1 550 . 17 1 1 A 69 69 THR CB C 69 64.880 71.175 -6.295 1 1 552 . 17 1 1 A 69 69 THR N N 69 115.810 114.909 0.901 1 1 553 . 17 1 1 A 70 70 LEU H H 70 9.560 8.687 0.873 1 1 554 . 17 1 1 A 70 70 LEU HA H 70 5.270 5.375 -0.105 1 1 564 . 17 1 1 A 70 70 LEU C C 70 173.800 174.830 -1.030 1 1 565 . 17 1 1 A 70 70 LEU CA C 70 53.460 54.237 -0.777 1 1 566 . 17 1 1 A 70 70 LEU CB C 70 45.040 44.314 0.726 1 1 570 . 17 1 1 A 70 70 LEU N N 70 129.220 130.871 -1.651 1 1 571 . 17 1 1 A 71 71 ASN H H 71 9.590 9.587 0.003 1 1 572 . 17 1 1 A 71 71 ASN HA H 71 5.880 5.518 0.362 1 1 577 . 17 1 1 A 71 71 ASN C C 71 177.970 174.790 3.180 1 1 578 . 17 1 1 A 71 71 ASN CA C 71 52.060 52.801 -0.741 1 1 579 . 17 1 1 A 71 71 ASN CB C 71 41.020 39.363 1.657 1 1 580 . 17 1 1 A 71 71 ASN N N 71 125.970 124.760 1.210 1 1 582 . 17 1 1 A 72 72 TYR H H 72 8.740 8.845 -0.105 1 1 583 . 17 1 1 A 72 72 TYR HA H 72 5.110 5.396 -0.286 1 1 588 . 17 1 1 A 72 72 TYR C C 72 177.720 172.835 4.885 1 1 589 . 17 1 1 A 72 72 TYR CA C 72 55.310 55.336 -0.026 1 1 590 . 17 1 1 A 72 72 TYR CB C 72 41.510 41.293 0.217 1 1 591 . 17 1 1 A 72 72 TYR N N 72 119.640 122.317 -2.677 1 1 592 . 17 1 1 A 73 73 ASP H H 73 9.780 9.043 0.737 1 1 593 . 17 1 1 A 73 73 ASP HA H 73 4.680 4.845 -0.165 1 1 596 . 17 1 1 A 73 73 ASP C C 73 177.290 177.021 0.269 1 1 597 . 17 1 1 A 73 73 ASP CA C 73 53.650 52.956 0.694 1 1 598 . 17 1 1 A 73 73 ASP CB C 73 40.900 42.246 -1.346 1 1 599 . 17 1 1 A 73 73 ASP N N 73 119.290 121.459 -2.169 1 1 600 . 17 1 1 A 74 74 GLU H H 74 9.430 8.694 0.736 1 1 601 . 17 1 1 A 74 74 GLU HA H 74 4.740 4.689 0.051 1 1 606 . 17 1 1 A 74 74 GLU C C 74 176.320 179.020 -2.700 1 1 607 . 17 1 1 A 74 74 GLU CA C 74 57.410 58.931 -1.521 1 1 608 . 17 1 1 A 74 74 GLU CB C 74 29.490 29.581 -0.091 1 1 610 . 17 1 1 A 74 74 GLU N N 74 130.930 124.882 6.048 1 1 611 . 17 1 1 A 75 75 ASN H H 75 8.680 7.811 0.869 1 1 612 . 17 1 1 A 75 75 ASN HA H 75 4.600 4.557 0.043 1 1 617 . 17 1 1 A 75 75 ASN C C 75 175.340 176.463 -1.123 1 1 618 . 17 1 1 A 75 75 ASN CA C 75 54.620 55.960 -1.340 1 1 619 . 17 1 1 A 75 75 ASN CB C 75 38.770 38.505 0.265 1 1 620 . 17 1 1 A 75 75 ASN N N 75 115.040 118.957 -3.917 1 1 622 . 17 1 1 A 76 76 ALA H H 76 7.740 7.945 -0.205 1 1 623 . 17 1 1 A 76 76 ALA HA H 76 4.310 4.507 -0.197 1 1 627 . 17 1 1 A 76 76 ALA C C 76 175.550 176.945 -1.395 1 1 628 . 17 1 1 A 76 76 ALA CA C 76 53.260 53.096 0.164 1 1 629 . 17 1 1 A 76 76 ALA CB C 76 21.450 21.587 -0.137 1 1 630 . 17 1 1 A 76 76 ALA N N 76 122.200 119.567 2.633 1 1 631 . 17 1 1 A 77 77 PHE H H 77 8.070 8.103 -0.033 1 1 632 . 17 1 1 A 77 77 PHE HA H 77 5.650 5.220 0.430 1 1 637 . 17 1 1 A 77 77 PHE C C 77 174.570 175.370 -0.800 1 1 638 . 17 1 1 A 77 77 PHE CA C 77 56.360 57.769 -1.409 1 1 639 . 17 1 1 A 77 77 PHE CB C 77 46.080 41.058 5.022 1 1 640 . 17 1 1 A 77 77 PHE N N 77 114.160 114.407 -0.247 1 1 641 . 17 1 1 A 78 78 GLU H H 78 8.800 8.698 0.102 1 1 642 . 17 1 1 A 78 78 GLU HA H 78 4.900 5.031 -0.131 1 1 647 . 17 1 1 A 78 78 GLU C C 78 175.950 174.785 1.165 1 1 648 . 17 1 1 A 78 78 GLU CA C 78 53.670 55.380 -1.710 1 1 649 . 17 1 1 A 78 78 GLU CB C 78 33.600 33.268 0.332 1 1 651 . 17 1 1 A 78 78 GLU N N 78 117.590 120.684 -3.094 1 1 652 . 17 1 1 A 79 79 TYR H H 79 8.770 9.555 -0.785 1 1 653 . 17 1 1 A 79 79 TYR HA H 79 4.250 4.135 0.115 1 1 658 . 17 1 1 A 79 79 TYR C C 79 174.580 174.938 -0.358 1 1 659 . 17 1 1 A 79 79 TYR CA C 79 59.250 59.547 -0.297 1 1 660 . 17 1 1 A 79 79 TYR CB C 79 38.310 39.238 -0.928 1 1 661 . 17 1 1 A 79 79 TYR N N 79 126.560 128.094 -1.534 1 1 662 . 17 1 1 A 80 80 VAL H H 80 8.220 8.447 -0.227 1 1 663 . 17 1 1 A 80 80 VAL HA H 80 3.690 3.855 -0.165 1 1 671 . 17 1 1 A 80 80 VAL C C 80 174.780 174.831 -0.051 1 1 672 . 17 1 1 A 80 80 VAL CA C 80 64.400 62.599 1.801 1 1 673 . 17 1 1 A 80 80 VAL CB C 80 33.510 32.956 0.554 1 1 676 . 17 1 1 A 80 80 VAL N N 80 129.460 125.179 4.281 1 1 677 . 17 1 1 A 81 81 GLU H H 81 6.920 7.543 -0.623 1 1 678 . 17 1 1 A 81 81 GLU HA H 81 4.260 4.705 -0.445 1 1 683 . 17 1 1 A 81 81 GLU C C 81 171.840 175.633 -3.793 1 1 684 . 17 1 1 A 81 81 GLU CA C 81 55.310 55.332 -0.022 1 1 685 . 17 1 1 A 81 81 GLU CB C 81 30.520 33.469 -2.949 1 1 687 . 17 1 1 A 81 81 GLU N N 81 112.430 117.149 -4.719 1 1 688 . 17 1 1 A 82 82 ALA H H 82 8.310 8.624 -0.314 1 1 689 . 17 1 1 A 82 82 ALA HA H 82 5.650 5.090 0.560 1 1 693 . 17 1 1 A 82 82 ALA C C 82 176.110 177.101 -0.991 1 1 694 . 17 1 1 A 82 82 ALA CA C 82 50.620 51.881 -1.261 1 1 695 . 17 1 1 A 82 82 ALA CB C 82 21.770 19.974 1.796 1 1 696 . 17 1 1 A 82 82 ALA N N 82 121.240 126.566 -5.326 1 1 697 . 17 1 1 A 83 83 ILE H H 83 9.150 9.078 0.072 1 1 698 . 17 1 1 A 83 83 ILE HA H 83 4.600 4.791 -0.191 1 1 708 . 17 1 1 A 83 83 ILE C C 83 174.810 175.167 -0.357 1 1 709 . 17 1 1 A 83 83 ILE CA C 83 60.060 59.326 0.734 1 1 710 . 17 1 1 A 83 83 ILE CB C 83 42.440 41.188 1.252 1 1 714 . 17 1 1 A 83 83 ILE N N 83 119.720 120.743 -1.023 1 1 715 . 17 1 1 A 84 84 SER H H 84 8.350 9.005 -0.655 1 1 716 . 17 1 1 A 84 84 SER HA H 84 4.660 4.863 -0.203 1 1 719 . 17 1 1 A 84 84 SER C C 84 177.550 172.741 4.809 1 1 720 . 17 1 1 A 84 84 SER CA C 84 57.330 55.809 1.521 1 1 721 . 17 1 1 A 84 84 SER CB C 84 66.490 65.300 1.190 1 1 722 . 17 1 1 A 84 84 SER N N 84 116.740 120.442 -3.702 1 1 723 . 17 1 1 A 85 85 ASP H H 85 8.740 8.475 0.265 1 1 724 . 17 1 1 A 85 85 ASP HA H 85 4.820 4.956 -0.136 1 1 727 . 17 1 1 A 85 85 ASP C C 85 176.090 176.017 0.073 1 1 728 . 17 1 1 A 85 85 ASP CA C 85 53.480 52.985 0.495 1 1 729 . 17 1 1 A 85 85 ASP CB C 85 42.480 42.187 0.293 1 1 730 . 17 1 1 A 85 85 ASP N N 85 120.960 121.219 -0.259 1 1 731 . 17 1 1 A 86 86 ASP H H 86 8.380 8.555 -0.175 1 1 732 . 17 1 1 A 86 86 ASP HA H 86 4.450 4.844 -0.394 1 1 735 . 17 1 1 A 86 86 ASP C C 86 177.100 176.951 0.149 1 1 736 . 17 1 1 A 86 86 ASP CA C 86 56.240 53.204 3.036 1 1 737 . 17 1 1 A 86 86 ASP CB C 86 41.100 41.065 0.035 1 1 738 . 17 1 1 A 86 86 ASP N N 86 117.710 121.918 -4.208 1 1 739 . 17 1 1 A 87 87 GLY H H 87 8.690 7.544 1.146 1 1 740 . 17 1 1 A 87 87 GLY HA2 H 87 3.870 4.097 -0.227 1 1 741 . 17 1 1 A 87 87 GLY HA3 H 87 4.090 4.099 -0.009 1 1 742 . 17 1 1 A 87 87 GLY C C 87 173.800 174.345 -0.545 1 1 743 . 17 1 1 A 87 87 GLY CA C 87 45.770 45.588 0.182 1 1 744 . 17 1 1 A 87 87 GLY N N 87 108.540 106.727 1.813 1 1 745 . 17 1 1 A 88 88 VAL H H 88 7.910 7.659 0.251 1 1 746 . 17 1 1 A 88 88 VAL HA H 88 4.780 4.279 0.501 1 1 754 . 17 1 1 A 88 88 VAL C C 88 173.970 175.154 -1.184 1 1 755 . 17 1 1 A 88 88 VAL CA C 88 60.900 62.159 -1.259 1 1 756 . 17 1 1 A 88 88 VAL CB C 88 35.460 33.112 2.348 1 1 759 . 17 1 1 A 88 88 VAL N N 88 119.790 120.681 -0.891 1 1 760 . 17 1 1 A 89 89 PHE H H 89 9.210 9.736 -0.526 1 1 761 . 17 1 1 A 89 89 PHE HA H 89 4.930 5.405 -0.475 1 1 766 . 17 1 1 A 89 89 PHE C C 89 173.970 173.754 0.216 1 1 767 . 17 1 1 A 89 89 PHE CA C 89 56.450 55.541 0.909 1 1 768 . 17 1 1 A 89 89 PHE CB C 89 41.120 42.155 -1.035 1 1 769 . 17 1 1 A 89 89 PHE N N 89 126.780 126.263 0.517 1 1 770 . 17 1 1 A 90 90 VAL H H 90 7.880 8.992 -1.112 1 1 771 . 17 1 1 A 90 90 VAL HA H 90 4.860 5.091 -0.231 1 1 779 . 17 1 1 A 90 90 VAL C C 90 173.190 175.151 -1.961 1 1 780 . 17 1 1 A 90 90 VAL CA C 90 59.750 60.938 -1.188 1 1 781 . 17 1 1 A 90 90 VAL CB C 90 34.770 34.664 0.106 1 1 784 . 17 1 1 A 90 90 VAL N N 90 124.990 127.188 -2.198 1 1 785 . 17 1 1 A 91 91 ASN H H 91 8.670 8.734 -0.064 1 1 786 . 17 1 1 A 91 91 ASN HA H 91 4.730 5.277 -0.547 1 1 791 . 17 1 1 A 91 91 ASN C C 91 173.200 174.141 -0.941 1 1 792 . 17 1 1 A 91 91 ASN CA C 91 51.970 52.906 -0.936 1 1 793 . 17 1 1 A 91 91 ASN CB C 91 41.340 41.945 -0.605 1 1 794 . 17 1 1 A 91 91 ASN N N 91 124.860 125.436 -0.576 1 1 796 . 17 1 1 A 92 92 ALA H H 92 8.840 9.114 -0.274 1 1 797 . 17 1 1 A 92 92 ALA HA H 92 5.290 5.501 -0.211 1 1 801 . 17 1 1 A 92 92 ALA C C 92 176.330 176.309 0.021 1 1 802 . 17 1 1 A 92 92 ALA CA C 92 50.170 51.015 -0.845 1 1 803 . 17 1 1 A 92 92 ALA CB C 92 23.610 21.222 2.388 1 1 804 . 17 1 1 A 92 92 ALA N N 92 128.510 128.866 -0.356 1 1 805 . 17 1 1 A 93 93 LYS H H 93 8.670 9.304 -0.634 1 1 806 . 17 1 1 A 93 93 LYS HA H 93 4.460 4.828 -0.368 1 1 815 . 17 1 1 A 93 93 LYS C C 93 174.170 175.035 -0.865 1 1 816 . 17 1 1 A 93 93 LYS CA C 93 55.010 54.831 0.179 1 1 817 . 17 1 1 A 93 93 LYS CB C 93 36.430 35.647 0.783 1 1 821 . 17 1 1 A 93 93 LYS N N 93 121.300 121.019 0.281 1 1 822 . 17 1 1 A 94 94 LYS H H 94 8.960 8.527 0.433 1 1 823 . 17 1 1 A 94 94 LYS HA H 94 4.460 4.077 0.383 1 1 832 . 17 1 1 A 94 94 LYS C C 94 176.330 176.969 -0.639 1 1 833 . 17 1 1 A 94 94 LYS CA C 94 56.720 56.571 0.149 1 1 834 . 17 1 1 A 94 94 LYS CB C 94 31.930 32.647 -0.717 1 1 837 . 17 1 1 A 94 94 LYS N N 94 127.060 127.055 0.005 1 1 838 . 17 1 1 A 95 95 ILE H H 95 8.290 8.346 -0.056 1 1 839 . 17 1 1 A 95 95 ILE HA H 95 4.120 4.123 -0.003 1 1 849 . 17 1 1 A 95 95 ILE C C 95 175.740 175.320 0.420 1 1 850 . 17 1 1 A 95 95 ILE CA C 95 62.760 62.602 0.158 1 1 851 . 17 1 1 A 95 95 ILE CB C 95 38.890 39.077 -0.187 1 1 855 . 17 1 1 A 95 95 ILE N N 95 126.530 128.025 -1.495 1 1 856 . 17 1 1 A 96 96 GLU H H 96 8.030 7.248 0.782 1 1 857 . 17 1 1 A 96 96 GLU HA H 96 4.450 4.568 -0.118 1 1 862 . 17 1 1 A 96 96 GLU C C 96 174.380 174.002 0.378 1 1 863 . 17 1 1 A 96 96 GLU CA C 96 54.320 55.644 -1.324 1 1 864 . 17 1 1 A 96 96 GLU CB C 96 32.770 32.660 0.110 1 1 866 . 17 1 1 A 96 96 GLU N N 96 117.080 120.406 -3.326 1 1 867 . 17 1 1 A 97 97 ASP H H 97 8.730 8.771 -0.041 1 1 868 . 17 1 1 A 97 97 ASP HA H 97 4.360 4.620 -0.260 1 1 871 . 17 1 1 A 97 97 ASP C C 97 177.100 177.118 -0.018 1 1 872 . 17 1 1 A 97 97 ASP CA C 97 57.160 55.052 2.108 1 1 873 . 17 1 1 A 97 97 ASP CB C 97 39.920 41.140 -1.220 1 1 874 . 17 1 1 A 97 97 ASP N N 97 120.570 120.940 -0.370 1 1 875 . 17 1 1 A 98 98 GLY H H 98 8.760 8.559 0.201 1 1 876 . 17 1 1 A 98 98 GLY HA2 H 98 2.120 1.785 0.335 1 1 877 . 17 1 1 A 98 98 GLY HA3 H 98 3.910 3.415 0.495 1 1 878 . 17 1 1 A 98 98 GLY C C 98 174.000 172.889 1.111 1 1 879 . 17 1 1 A 98 98 GLY CA C 98 45.720 45.252 0.468 1 1 880 . 17 1 1 A 98 98 GLY N N 98 112.090 111.256 0.834 1 1 881 . 17 1 1 A 99 99 LYS H H 99 7.890 7.124 0.766 1 1 882 . 17 1 1 A 99 99 LYS HA H 99 5.330 5.105 0.225 1 1 891 . 17 1 1 A 99 99 LYS C C 99 174.750 174.327 0.423 1 1 892 . 17 1 1 A 99 99 LYS CA C 99 55.990 54.782 1.208 1 1 893 . 17 1 1 A 99 99 LYS CB C 99 37.840 35.461 2.379 1 1 897 . 17 1 1 A 99 99 LYS N N 99 118.050 114.782 3.268 1 1 898 . 17 1 1 A 100 100 VAL H H 100 8.980 8.558 0.422 1 1 899 . 17 1 1 A 100 100 VAL HA H 100 4.510 4.726 -0.216 1 1 907 . 17 1 1 A 100 100 VAL C C 100 174.760 173.879 0.881 1 1 908 . 17 1 1 A 100 100 VAL CA C 100 60.130 59.056 1.074 1 1 909 . 17 1 1 A 100 100 VAL CB C 100 35.240 35.824 -0.584 1 1 912 . 17 1 1 A 100 100 VAL N N 100 123.850 119.719 4.131 1 1 913 . 17 1 1 A 101 101 ARG H H 101 8.810 8.219 0.591 1 1 914 . 17 1 1 A 101 101 ARG HA H 101 4.850 4.458 0.392 1 1 921 . 17 1 1 A 101 101 ARG C C 101 174.770 174.452 0.318 1 1 922 . 17 1 1 A 101 101 ARG CA C 101 54.580 55.139 -0.559 1 1 923 . 17 1 1 A 101 101 ARG CB C 101 32.400 31.250 1.150 1 1 926 . 17 1 1 A 101 101 ARG N N 101 129.210 123.973 5.237 1 1 927 . 17 1 1 A 102 102 VAL H H 102 9.100 8.704 0.396 1 1 928 . 17 1 1 A 102 102 VAL HA H 102 4.120 4.438 -0.318 1 1 936 . 17 1 1 A 102 102 VAL C C 102 171.640 173.849 -2.209 1 1 937 . 17 1 1 A 102 102 VAL CA C 102 61.350 60.622 0.728 1 1 938 . 17 1 1 A 102 102 VAL CB C 102 32.530 32.743 -0.213 1 1 941 . 17 1 1 A 102 102 VAL N N 102 130.470 123.951 6.519 1 1 942 . 17 1 1 A 103 103 LEU H H 103 8.110 9.193 -1.083 1 1 943 . 17 1 1 A 103 103 LEU HA H 103 5.120 4.671 0.449 1 1 953 . 17 1 1 A 103 103 LEU C C 103 176.410 176.386 0.024 1 1 954 . 17 1 1 A 103 103 LEU CA C 103 53.380 54.029 -0.649 1 1 955 . 17 1 1 A 103 103 LEU CB C 103 43.680 40.904 2.776 1 1 959 . 17 1 1 A 103 103 LEU N N 103 125.560 130.007 -4.447 1 1 960 . 17 1 1 A 104 104 VAL H H 104 9.580 8.601 0.979 1 1 961 . 17 1 1 A 104 104 VAL HA H 104 5.260 5.535 -0.275 1 1 969 . 17 1 1 A 104 104 VAL C C 104 176.030 174.833 1.197 1 1 970 . 17 1 1 A 104 104 VAL CA C 104 60.220 59.728 0.492 1 1 971 . 17 1 1 A 104 104 VAL CB C 104 34.310 35.061 -0.751 1 1 974 . 17 1 1 A 104 104 VAL N N 104 125.790 120.225 5.565 1 1 975 . 17 1 1 A 105 105 SER H H 105 9.340 9.378 -0.038 1 1 976 . 17 1 1 A 105 105 SER HA H 105 5.300 5.102 0.198 1 1 979 . 17 1 1 A 105 105 SER C C 105 173.600 173.042 0.558 1 1 980 . 17 1 1 A 105 105 SER CA C 105 57.450 57.439 0.011 1 1 981 . 17 1 1 A 105 105 SER CB C 105 65.600 66.737 -1.137 1 1 982 . 17 1 1 A 105 105 SER N N 105 119.220 116.632 2.588 1 1 983 . 17 1 1 A 106 106 SER H H 106 8.350 9.129 -0.779 1 1 984 . 17 1 1 A 106 106 SER HA H 106 4.720 4.583 0.137 1 1 987 . 17 1 1 A 106 106 SER C C 106 176.930 174.438 2.492 1 1 988 . 17 1 1 A 106 106 SER CA C 106 58.170 58.981 -0.811 1 1 989 . 17 1 1 A 106 106 SER CB C 106 64.170 63.302 0.868 1 1 990 . 17 1 1 A 106 106 SER N N 106 114.800 120.367 -5.567 1 1 991 . 17 1 1 A 107 107 LEU H H 107 8.770 8.468 0.302 1 1 992 . 17 1 1 A 107 107 LEU HA H 107 4.710 4.667 0.043 1 1 1001 . 17 1 1 A 107 107 LEU C C 107 178.280 177.287 0.993 1 1 1002 . 17 1 1 A 107 107 LEU CA C 107 55.280 54.861 0.419 1 1 1003 . 17 1 1 A 107 107 LEU CB C 107 43.410 42.035 1.375 1 1 1007 . 17 1 1 A 107 107 LEU N N 107 127.210 128.372 -1.162 1 1 1008 . 17 1 1 A 108 108 THR H H 108 8.210 7.850 0.360 1 1 1009 . 17 1 1 A 108 108 THR HA H 108 4.400 4.632 -0.232 1 1 1015 . 17 1 1 A 108 108 THR C C 108 176.130 175.824 0.306 1 1 1016 . 17 1 1 A 108 108 THR CA C 108 62.050 62.167 -0.117 1 1 1017 . 17 1 1 A 108 108 THR CB C 108 70.910 71.440 -0.530 1 1 1019 . 17 1 1 A 108 108 THR N N 108 108.810 111.965 -3.155 1 1 1020 . 17 1 1 A 109 109 GLY H H 109 8.250 8.208 0.042 1 1 1021 . 17 1 1 A 109 109 GLY HA2 H 109 3.780 4.095 -0.315 1 1 1022 . 17 1 1 A 109 109 GLY HA3 H 109 4.290 4.114 0.176 1 1 1023 . 17 1 1 A 109 109 GLY C C 109 173.180 174.471 -1.291 1 1 1024 . 17 1 1 A 109 109 GLY CA C 109 45.340 45.210 0.130 1 1 1025 . 17 1 1 A 109 109 GLY N N 109 110.160 111.165 -1.005 1 1 1026 . 17 1 1 A 110 110 GLU H H 110 7.960 7.618 0.342 1 1 1027 . 17 1 1 A 110 110 GLU HA H 110 4.760 4.722 0.038 1 1 1032 . 17 1 1 A 110 110 GLU CA C 110 53.450 53.909 -0.459 1 1 1033 . 17 1 1 A 110 110 GLU CB C 110 30.020 29.621 0.399 1 1 1035 . 17 1 1 A 110 110 GLU N N 110 119.720 120.865 -1.145 1 1 1036 . 17 1 1 A 111 111 PRO HA H 111 3.250 3.857 -0.607 1 1 1043 . 17 1 1 A 111 111 PRO C C 111 176.710 176.244 0.466 1 1 1044 . 17 1 1 A 111 111 PRO CA C 111 62.240 61.773 0.467 1 1 1045 . 17 1 1 A 111 111 PRO CB C 111 31.990 32.047 -0.057 1 1 1048 . 17 1 1 A 112 112 LEU H H 112 8.840 8.618 0.222 1 1 1049 . 17 1 1 A 112 112 LEU HA H 112 4.290 4.245 0.045 1 1 1059 . 17 1 1 A 112 112 LEU CA C 112 52.220 53.169 -0.949 1 1 1060 . 17 1 1 A 112 112 LEU CB C 112 41.090 42.900 -1.810 1 1 1063 . 17 1 1 A 112 112 LEU N N 112 122.420 123.343 -0.923 1 1 1064 . 17 1 1 A 113 113 PRO HA H 113 4.380 4.242 0.138 1 1 1071 . 17 1 1 A 113 113 PRO C C 113 176.100 177.518 -1.418 1 1 1072 . 17 1 1 A 113 113 PRO CA C 113 61.930 65.015 -3.085 1 1 1073 . 17 1 1 A 113 113 PRO CB C 113 32.470 31.784 0.686 1 1 1076 . 17 1 1 A 114 114 ALA H H 114 8.070 7.794 0.276 1 1 1077 . 17 1 1 A 114 114 ALA HA H 114 4.550 3.926 0.624 1 1 1081 . 17 1 1 A 114 114 ALA C C 114 177.490 177.268 0.222 1 1 1082 . 17 1 1 A 114 114 ALA CA C 114 51.340 53.965 -2.625 1 1 1083 . 17 1 1 A 114 114 ALA CB C 114 19.940 18.159 1.781 1 1 1084 . 17 1 1 A 114 114 ALA N N 114 121.460 121.002 0.458 1 1 1085 . 17 1 1 A 115 115 LYS H H 115 9.000 8.781 0.219 1 1 1086 . 17 1 1 A 115 115 LYS HA H 115 3.930 3.814 0.116 1 1 1095 . 17 1 1 A 115 115 LYS C C 115 175.740 175.234 0.506 1 1 1096 . 17 1 1 A 115 115 LYS CA C 115 57.580 57.565 0.015 1 1 1097 . 17 1 1 A 115 115 LYS CB C 115 29.510 30.810 -1.300 1 1 1101 . 17 1 1 A 115 115 LYS N N 115 112.560 116.160 -3.600 1 1 1102 . 17 1 1 A 116 116 GLU H H 116 7.620 7.622 -0.002 1 1 1103 . 17 1 1 A 116 116 GLU HA H 116 4.550 4.922 -0.372 1 1 1108 . 17 1 1 A 116 116 GLU C C 116 176.110 175.318 0.792 1 1 1109 . 17 1 1 A 116 116 GLU CA C 116 54.570 54.362 0.208 1 1 1110 . 17 1 1 A 116 116 GLU CB C 116 33.680 33.812 -0.132 1 1 1112 . 17 1 1 A 116 116 GLU N N 116 115.710 117.614 -1.904 1 1 1113 . 17 1 1 A 117 117 VAL H H 117 8.770 8.846 -0.076 1 1 1114 . 17 1 1 A 117 117 VAL HA H 117 3.200 3.982 -0.782 1 1 1122 . 17 1 1 A 117 117 VAL C C 117 175.740 175.682 0.058 1 1 1123 . 17 1 1 A 117 117 VAL CA C 117 65.340 63.228 2.112 1 1 1124 . 17 1 1 A 117 117 VAL CB C 117 31.290 30.863 0.427 1 1 1127 . 17 1 1 A 117 117 VAL N N 117 124.450 120.939 3.511 1 1 1128 . 17 1 1 A 118 118 LEU H H 118 8.550 8.905 -0.355 1 1 1129 . 17 1 1 A 118 118 LEU HA H 118 4.540 4.367 0.173 1 1 1139 . 17 1 1 A 118 118 LEU C C 118 176.210 177.045 -0.835 1 1 1140 . 17 1 1 A 118 118 LEU CA C 118 55.510 55.904 -0.394 1 1 1141 . 17 1 1 A 118 118 LEU CB C 118 44.600 42.297 2.303 1 1 1145 . 17 1 1 A 118 118 LEU N N 118 128.440 128.870 -0.430 1 1 1146 . 17 1 1 A 119 119 ALA H H 119 7.970 7.602 0.368 1 1 1147 . 17 1 1 A 119 119 ALA HA H 119 4.740 4.837 -0.097 1 1 1151 . 17 1 1 A 119 119 ALA C C 119 174.570 175.273 -0.703 1 1 1152 . 17 1 1 A 119 119 ALA CA C 119 50.770 51.780 -1.010 1 1 1153 . 17 1 1 A 119 119 ALA CB C 119 22.450 22.254 0.196 1 1 1154 . 17 1 1 A 119 119 ALA N N 119 118.100 117.353 0.747 1 1 1155 . 17 1 1 A 120 120 LYS H H 120 8.760 8.927 -0.167 1 1 1156 . 17 1 1 A 120 120 LYS HA H 120 5.240 5.484 -0.244 1 1 1165 . 17 1 1 A 120 120 LYS C C 120 175.340 174.450 0.890 1 1 1166 . 17 1 1 A 120 120 LYS CA C 120 54.220 54.869 -0.649 1 1 1167 . 17 1 1 A 120 120 LYS CB C 120 34.340 34.641 -0.301 1 1 1171 . 17 1 1 A 120 120 LYS N N 120 120.010 122.637 -2.627 1 1 1172 . 17 1 1 A 121 121 VAL H H 121 9.410 8.649 0.761 1 1 1173 . 17 1 1 A 121 121 VAL HA H 121 4.230 4.689 -0.459 1 1 1181 . 17 1 1 A 121 121 VAL C C 121 173.980 174.976 -0.996 1 1 1182 . 17 1 1 A 121 121 VAL CA C 121 62.370 61.354 1.016 1 1 1183 . 17 1 1 A 121 121 VAL CB C 121 32.410 32.983 -0.573 1 1 1186 . 17 1 1 A 121 121 VAL N N 121 124.960 125.646 -0.686 1 1 1187 . 17 1 1 A 122 122 VAL H H 122 9.280 8.320 0.960 1 1 1188 . 17 1 1 A 122 122 VAL HA H 122 4.360 4.657 -0.297 1 1 1196 . 17 1 1 A 122 122 VAL C C 122 174.190 175.815 -1.625 1 1 1197 . 17 1 1 A 122 122 VAL CA C 122 62.760 61.717 1.043 1 1 1198 . 17 1 1 A 122 122 VAL CB C 122 32.020 32.224 -0.204 1 1 1201 . 17 1 1 A 122 122 VAL N N 122 128.990 126.923 2.067 1 1 1202 . 17 1 1 A 123 123 LEU H H 123 8.610 8.728 -0.118 1 1 1203 . 17 1 1 A 123 123 LEU HA H 123 4.900 4.582 0.318 1 1 1213 . 17 1 1 A 123 123 LEU C C 123 174.950 176.237 -1.287 1 1 1214 . 17 1 1 A 123 123 LEU CA C 123 52.050 53.400 -1.350 1 1 1215 . 17 1 1 A 123 123 LEU CB C 123 45.210 42.350 2.860 1 1 1219 . 17 1 1 A 123 123 LEU N N 123 127.200 127.751 -0.551 1 1 1220 . 17 1 1 A 124 124 ARG H H 124 9.540 9.149 0.391 1 1 1221 . 17 1 1 A 124 124 ARG HA H 124 4.900 4.963 -0.063 1 1 1229 . 17 1 1 A 124 124 ARG C C 124 176.320 175.362 0.958 1 1 1230 . 17 1 1 A 124 124 ARG CA C 124 55.320 54.681 0.639 1 1 1231 . 17 1 1 A 124 124 ARG CB C 124 31.750 32.175 -0.425 1 1 1234 . 17 1 1 A 124 124 ARG N N 124 124.290 122.317 1.973 1 1 1236 . 17 1 1 A 125 125 ALA H H 125 8.880 8.593 0.287 1 1 1237 . 17 1 1 A 125 125 ALA HA H 125 4.380 3.724 0.656 1 1 1241 . 17 1 1 A 125 125 ALA C C 125 177.290 177.704 -0.414 1 1 1242 . 17 1 1 A 125 125 ALA CA C 125 52.530 51.127 1.403 1 1 1243 . 17 1 1 A 125 125 ALA CB C 125 19.870 17.383 2.487 1 1 1244 . 17 1 1 A 125 125 ALA N N 125 130.790 129.417 1.373 1 1 1245 . 17 1 1 A 126 126 GLU H H 126 9.260 8.247 1.013 1 1 1246 . 17 1 1 A 126 126 GLU HA H 126 4.460 4.358 0.102 1 1 1251 . 17 1 1 A 126 126 GLU C C 126 176.120 176.008 0.112 1 1 1252 . 17 1 1 A 126 126 GLU CA C 126 56.940 57.064 -0.124 1 1 1253 . 17 1 1 A 126 126 GLU CB C 126 32.450 30.234 2.216 1 1 1255 . 17 1 1 A 126 126 GLU N N 126 125.740 123.311 2.429 1 1 1256 . 17 1 1 A 127 127 ALA H H 127 7.460 7.440 0.020 1 1 1257 . 17 1 1 A 127 127 ALA HA H 127 4.360 4.596 -0.236 1 1 1261 . 17 1 1 A 127 127 ALA C C 127 173.400 175.975 -2.575 1 1 1262 . 17 1 1 A 127 127 ALA CA C 127 51.360 51.581 -0.221 1 1 1263 . 17 1 1 A 127 127 ALA CB C 127 22.180 22.203 -0.023 1 1 1264 . 17 1 1 A 127 127 ALA N N 127 120.910 119.610 1.300 1 1 1265 . 17 1 1 A 128 128 LYS H H 128 7.940 8.416 -0.476 1 1 1266 . 17 1 1 A 128 128 LYS HA H 128 3.580 4.065 -0.485 1 1 1275 . 17 1 1 A 128 128 LYS C C 128 176.080 175.799 0.281 1 1 1276 . 17 1 1 A 128 128 LYS CA C 128 56.860 56.550 0.310 1 1 1277 . 17 1 1 A 128 128 LYS CB C 128 33.170 33.032 0.138 1 1 1281 . 17 1 1 A 128 128 LYS N N 128 116.520 121.778 -5.258 1 1 1282 . 17 1 1 A 129 129 ALA H H 129 8.590 8.711 -0.121 1 1 1283 . 17 1 1 A 129 129 ALA HA H 129 4.390 4.688 -0.298 1 1 1287 . 17 1 1 A 129 129 ALA C C 129 174.970 175.397 -0.427 1 1 1288 . 17 1 1 A 129 129 ALA CA C 129 52.970 51.448 1.522 1 1 1289 . 17 1 1 A 129 129 ALA CB C 129 21.500 18.789 2.711 1 1 1290 . 17 1 1 A 129 129 ALA N N 129 124.710 122.702 2.008 1 1 1291 . 17 1 1 A 130 130 GLU H H 130 8.660 8.235 0.425 1 1 1292 . 17 1 1 A 130 130 GLU HA H 130 4.660 4.222 0.438 1 1 1297 . 17 1 1 A 130 130 GLU C C 130 177.390 177.071 0.319 1 1 1298 . 17 1 1 A 130 130 GLU CA C 130 55.070 57.605 -2.535 1 1 1299 . 17 1 1 A 130 130 GLU CB C 130 30.860 29.169 1.691 1 1 1301 . 17 1 1 A 130 130 GLU N N 130 123.180 118.542 4.638 1 1 1302 . 17 1 1 A 131 131 GLY H H 131 9.170 9.013 0.157 1 1 1303 . 17 1 1 A 131 131 GLY HA2 H 131 3.560 3.991 -0.431 1 1 1304 . 17 1 1 A 131 131 GLY HA3 H 131 3.750 3.994 -0.244 1 1 1305 . 17 1 1 A 131 131 GLY C C 131 174.550 174.606 -0.056 1 1 1306 . 17 1 1 A 131 131 GLY CA C 131 47.660 44.994 2.666 1 1 1307 . 17 1 1 A 131 131 GLY N N 131 115.530 113.982 1.548 1 1 1308 . 17 1 1 A 132 132 SER H H 132 8.430 8.237 0.193 1 1 1309 . 17 1 1 A 132 132 SER HA H 132 4.170 4.430 -0.260 1 1 1312 . 17 1 1 A 132 132 SER C C 132 175.350 173.687 1.663 1 1 1313 . 17 1 1 A 132 132 SER CA C 132 59.050 58.967 0.083 1 1 1314 . 17 1 1 A 132 132 SER CB C 132 64.880 62.457 2.423 1 1 1315 . 17 1 1 A 132 132 SER N N 132 115.930 119.310 -3.380 1 1 1316 . 17 1 1 A 133 133 ASN H H 133 8.850 8.366 0.484 1 1 1317 . 17 1 1 A 133 133 ASN HA H 133 4.910 5.157 -0.247 1 1 1322 . 17 1 1 A 133 133 ASN C C 133 175.450 174.671 0.779 1 1 1323 . 17 1 1 A 133 133 ASN CA C 133 54.920 53.945 0.975 1 1 1324 . 17 1 1 A 133 133 ASN CB C 133 41.060 39.212 1.848 1 1 1325 . 17 1 1 A 133 133 ASN N N 133 125.590 123.366 2.224 1 1 1327 . 17 1 1 A 134 134 LEU H H 134 9.070 9.382 -0.312 1 1 1328 . 17 1 1 A 134 134 LEU HA H 134 5.230 5.274 -0.044 1 1 1338 . 17 1 1 A 134 134 LEU C C 134 175.240 175.638 -0.398 1 1 1339 . 17 1 1 A 134 134 LEU CA C 134 53.470 54.172 -0.702 1 1 1340 . 17 1 1 A 134 134 LEU CB C 134 45.090 44.211 0.879 1 1 1344 . 17 1 1 A 134 134 LEU N N 134 129.210 121.442 7.768 1 1 1345 . 17 1 1 A 135 135 SER H H 135 8.690 8.766 -0.076 1 1 1346 . 17 1 1 A 135 135 SER HA H 135 5.280 5.393 -0.113 1 1 1349 . 17 1 1 A 135 135 SER C C 135 173.590 173.683 -0.093 1 1 1350 . 17 1 1 A 135 135 SER CA C 135 56.220 56.624 -0.404 1 1 1351 . 17 1 1 A 135 135 SER CB C 135 66.510 64.636 1.874 1 1 1352 . 17 1 1 A 135 135 SER N N 135 113.020 120.360 -7.340 1 1 1353 . 17 1 1 A 136 136 VAL H H 136 8.940 8.889 0.051 1 1 1354 . 17 1 1 A 136 136 VAL HA H 136 5.500 5.428 0.072 1 1 1362 . 17 1 1 A 136 136 VAL C C 136 175.730 175.175 0.555 1 1 1363 . 17 1 1 A 136 136 VAL CA C 136 60.960 60.656 0.304 1 1 1364 . 17 1 1 A 136 136 VAL CB C 136 33.630 33.669 -0.039 1 1 1367 . 17 1 1 A 136 136 VAL N N 136 124.340 119.115 5.225 1 1 1368 . 17 1 1 A 137 137 THR H H 137 9.240 8.317 0.923 1 1 1369 . 17 1 1 A 137 137 THR HA H 137 4.920 4.805 0.115 1 1 1374 . 17 1 1 A 137 137 THR C C 137 173.500 174.620 -1.120 1 1 1375 . 17 1 1 A 137 137 THR CA C 137 59.120 60.151 -1.031 1 1 1376 . 17 1 1 A 137 137 THR CB C 137 72.500 70.885 1.615 1 1 1378 . 17 1 1 A 137 137 THR N N 137 117.010 117.350 -0.340 1 1 1379 . 17 1 1 A 138 138 ASN H H 138 9.190 8.989 0.201 1 1 1380 . 17 1 1 A 138 138 ASN HA H 138 4.420 4.425 -0.005 1 1 1385 . 17 1 1 A 138 138 ASN C C 138 175.550 174.638 0.912 1 1 1386 . 17 1 1 A 138 138 ASN CA C 138 54.350 54.017 0.333 1 1 1387 . 17 1 1 A 138 138 ASN CB C 138 37.380 36.221 1.159 1 1 1388 . 17 1 1 A 138 138 ASN N N 138 115.270 120.792 -5.522 1 1 1390 . 17 1 1 A 139 139 SER H H 139 8.560 7.829 0.731 1 1 1391 . 17 1 1 A 139 139 SER HA H 139 5.800 4.243 1.557 1 1 1394 . 17 1 1 A 139 139 SER C C 139 175.750 173.384 2.366 1 1 1395 . 17 1 1 A 139 139 SER CA C 139 56.020 59.088 -3.068 1 1 1396 . 17 1 1 A 139 139 SER CB C 139 65.320 62.123 3.197 1 1 1397 . 17 1 1 A 139 139 SER N N 139 112.360 116.445 -4.085 1 1 1398 . 17 1 1 A 140 140 SER H H 140 9.900 8.448 1.452 1 1 1399 . 17 1 1 A 140 140 SER HA H 140 5.360 4.962 0.398 1 1 1402 . 17 1 1 A 140 140 SER C C 140 172.620 173.769 -1.149 1 1 1403 . 17 1 1 A 140 140 SER CA C 140 57.400 57.071 0.329 1 1 1404 . 17 1 1 A 140 140 SER CB C 140 66.550 64.701 1.849 1 1 1405 . 17 1 1 A 140 140 SER N N 140 119.130 122.950 -3.820 1 1 1406 . 17 1 1 A 141 141 VAL H H 141 9.030 8.677 0.353 1 1 1407 . 17 1 1 A 141 141 VAL HA H 141 5.520 4.977 0.543 1 1 1415 . 17 1 1 A 141 141 VAL C C 141 174.750 174.942 -0.192 1 1 1416 . 17 1 1 A 141 141 VAL CA C 141 58.310 59.885 -1.575 1 1 1417 . 17 1 1 A 141 141 VAL CB C 141 35.030 35.495 -0.465 1 1 1420 . 17 1 1 A 141 141 VAL N N 141 111.410 116.239 -4.829 1 1 1421 . 17 1 1 A 142 142 GLY H H 142 8.790 8.681 0.109 1 1 1422 . 17 1 1 A 142 142 GLY HA2 H 142 3.600 4.055 -0.455 1 1 1423 . 17 1 1 A 142 142 GLY HA3 H 142 5.310 4.105 1.205 1 1 1424 . 17 1 1 A 142 142 GLY C C 142 174.180 173.466 0.714 1 1 1425 . 17 1 1 A 142 142 GLY CA C 142 44.110 46.131 -2.021 1 1 1426 . 17 1 1 A 142 142 GLY N N 142 109.330 111.467 -2.137 1 1 1427 . 17 1 1 A 143 143 ASP H H 143 8.840 8.634 0.206 1 1 1428 . 17 1 1 A 143 143 ASP HA H 143 5.790 5.162 0.628 1 1 1431 . 17 1 1 A 143 143 ASP C C 143 178.860 178.016 0.844 1 1 1432 . 17 1 1 A 143 143 ASP CA C 143 53.040 54.746 -1.706 1 1 1433 . 17 1 1 A 143 143 ASP CB C 143 43.660 42.573 1.087 1 1 1434 . 17 1 1 A 143 143 ASP N N 143 125.390 126.401 -1.011 1 1 1435 . 17 1 1 A 144 144 GLY H H 144 9.150 8.871 0.279 1 1 1436 . 17 1 1 A 144 144 GLY HA2 H 144 3.450 4.033 -0.583 1 1 1437 . 17 1 1 A 144 144 GLY HA3 H 144 3.720 4.080 -0.360 1 1 1438 . 17 1 1 A 144 144 GLY C C 144 174.770 176.259 -1.489 1 1 1439 . 17 1 1 A 144 144 GLY CA C 144 46.930 47.304 -0.374 1 1 1440 . 17 1 1 A 144 144 GLY N N 144 106.470 110.359 -3.889 1 1 1441 . 17 1 1 A 145 145 GLU H H 145 8.470 7.863 0.607 1 1 1442 . 17 1 1 A 145 145 GLU HA H 145 4.460 4.127 0.333 1 1 1447 . 17 1 1 A 145 145 GLU C C 145 176.520 176.517 0.003 1 1 1448 . 17 1 1 A 145 145 GLU CA C 145 55.330 58.424 -3.094 1 1 1449 . 17 1 1 A 145 145 GLU CB C 145 30.620 30.102 0.518 1 1 1451 . 17 1 1 A 145 145 GLU N N 145 119.170 120.451 -1.281 1 1 1452 . 17 1 1 A 146 146 GLY H H 146 7.950 7.731 0.219 1 1 1453 . 17 1 1 A 146 146 GLY HA2 H 146 3.630 4.023 -0.393 1 1 1454 . 17 1 1 A 146 146 GLY HA3 H 146 4.130 4.030 0.100 1 1 1455 . 17 1 1 A 146 146 GLY C C 146 174.350 174.705 -0.355 1 1 1456 . 17 1 1 A 146 146 GLY CA C 146 45.330 45.436 -0.106 1 1 1457 . 17 1 1 A 146 146 GLY N N 146 108.130 106.792 1.338 1 1 1458 . 17 1 1 A 147 147 LEU H H 147 8.440 7.938 0.502 1 1 1459 . 17 1 1 A 147 147 LEU HA H 147 4.340 4.479 -0.139 1 1 1469 . 17 1 1 A 147 147 LEU C C 147 175.950 175.551 0.399 1 1 1470 . 17 1 1 A 147 147 LEU CA C 147 54.860 54.339 0.521 1 1 1471 . 17 1 1 A 147 147 LEU CB C 147 41.590 42.155 -0.565 1 1 1475 . 17 1 1 A 147 147 LEU N N 147 124.000 122.082 1.918 1 1 1476 . 17 1 1 A 148 148 VAL H H 148 7.780 8.476 -0.696 1 1 1477 . 17 1 1 A 148 148 VAL HA H 148 4.830 5.125 -0.295 1 1 1485 . 17 1 1 A 148 148 VAL C C 148 175.740 173.405 2.335 1 1 1486 . 17 1 1 A 148 148 VAL CA C 148 61.140 59.494 1.646 1 1 1487 . 17 1 1 A 148 148 VAL CB C 148 33.640 35.141 -1.501 1 1 1490 . 17 1 1 A 148 148 VAL N N 148 120.440 119.396 1.044 1 1 1491 . 17 1 1 A 149 149 HIS H H 149 9.170 8.513 0.657 1 1 1492 . 17 1 1 A 149 149 HIS HA H 149 4.950 5.076 -0.126 1 1 1496 . 17 1 1 A 149 149 HIS C C 149 174.780 174.312 0.468 1 1 1497 . 17 1 1 A 149 149 HIS CA C 149 53.900 54.252 -0.352 1 1 1498 . 17 1 1 A 149 149 HIS CB C 149 32.200 30.758 1.442 1 1 1499 . 17 1 1 A 149 149 HIS N N 149 124.700 125.393 -0.693 1 1 1500 . 17 1 1 A 150 150 GLU H H 150 9.060 8.800 0.260 1 1 1501 . 17 1 1 A 150 150 GLU HA H 150 4.420 4.262 0.158 1 1 1506 . 17 1 1 A 150 150 GLU C C 150 176.520 176.109 0.411 1 1 1507 . 17 1 1 A 150 150 GLU CA C 150 57.630 57.396 0.234 1 1 1508 . 17 1 1 A 150 150 GLU CB C 150 30.370 30.047 0.323 1 1 1510 . 17 1 1 A 150 150 GLU N N 150 125.540 124.947 0.593 1 1 1511 . 17 1 1 A 151 151 ILE H H 151 8.150 8.090 0.060 1 1 1512 . 17 1 1 A 151 151 ILE HA H 151 4.780 4.474 0.306 1 1 1522 . 17 1 1 A 151 151 ILE C C 151 174.570 176.183 -1.613 1 1 1523 . 17 1 1 A 151 151 ILE CA C 151 59.390 59.551 -0.161 1 1 1524 . 17 1 1 A 151 151 ILE CB C 151 42.040 39.297 2.743 1 1 1528 . 17 1 1 A 151 151 ILE N N 151 115.880 123.059 -7.179 1 1 1529 . 17 1 1 A 152 152 ALA H H 152 8.010 8.351 -0.341 1 1 1530 . 17 1 1 A 152 152 ALA HA H 152 4.310 4.419 -0.109 1 1 1534 . 17 1 1 A 152 152 ALA C C 152 177.500 176.881 0.619 1 1 1535 . 17 1 1 A 152 152 ALA CA C 152 53.680 52.003 1.677 1 1 1536 . 17 1 1 A 152 152 ALA CB C 152 20.050 19.786 0.264 1 1 1537 . 17 1 1 A 152 152 ALA N N 152 126.640 124.361 2.279 1 1 1538 . 17 1 1 A 153 153 GLY H H 153 8.340 8.337 0.003 1 1 1539 . 17 1 1 A 153 153 GLY HA2 H 153 4.050 4.290 -0.240 1 1 1540 . 17 1 1 A 153 153 GLY HA3 H 153 4.140 4.296 -0.156 1 1 1541 . 17 1 1 A 153 153 GLY C C 153 173.140 171.732 1.408 1 1 1542 . 17 1 1 A 153 153 GLY CA C 153 44.130 45.776 -1.646 1 1 1543 . 17 1 1 A 153 153 GLY N N 153 107.490 105.462 2.028 1 1 1544 . 17 1 1 A 154 154 THR H H 154 7.380 8.380 -1.000 1 1 1545 . 17 1 1 A 154 154 THR HA H 154 4.700 4.750 -0.050 1 1 1550 . 17 1 1 A 154 154 THR C C 154 171.120 171.819 -0.699 1 1 1551 . 17 1 1 A 154 154 THR CA C 154 60.830 60.312 0.518 1 1 1552 . 17 1 1 A 154 154 THR CB C 154 68.850 69.842 -0.992 1 1 1554 . 17 1 1 A 154 154 THR N N 154 109.340 112.464 -3.124 1 1 1555 . 17 1 1 A 155 155 GLU H H 155 8.020 8.567 -0.547 1 1 1556 . 17 1 1 A 155 155 GLU HA H 155 5.370 5.032 0.338 1 1 1561 . 17 1 1 A 155 155 GLU C C 155 174.240 174.215 0.025 1 1 1562 . 17 1 1 A 155 155 GLU CA C 155 54.830 55.316 -0.486 1 1 1563 . 17 1 1 A 155 155 GLU CB C 155 33.620 33.975 -0.355 1 1 1565 . 17 1 1 A 155 155 GLU N N 155 118.690 124.039 -5.349 1 1 1566 . 17 1 1 A 156 156 LYS H H 156 9.230 8.914 0.316 1 1 1567 . 17 1 1 A 156 156 LYS HA H 156 4.650 5.139 -0.489 1 1 1576 . 17 1 1 A 156 156 LYS C C 156 174.000 174.520 -0.520 1 1 1577 . 17 1 1 A 156 156 LYS CA C 156 55.840 54.546 1.294 1 1 1578 . 17 1 1 A 156 156 LYS CB C 156 37.550 36.544 1.006 1 1 1582 . 17 1 1 A 156 156 LYS N N 156 121.940 125.512 -3.572 1 1 1583 . 17 1 1 A 157 157 THR H H 157 8.160 8.704 -0.544 1 1 1584 . 17 1 1 A 157 157 THR HA H 157 5.440 5.188 0.252 1 1 1589 . 17 1 1 A 157 157 THR C C 157 174.360 173.441 0.919 1 1 1590 . 17 1 1 A 157 157 THR CA C 157 60.410 60.261 0.149 1 1 1591 . 17 1 1 A 157 157 THR CB C 157 71.500 71.702 -0.202 1 1 1593 . 17 1 1 A 157 157 THR N N 157 113.240 112.705 0.535 1 1 1594 . 17 1 1 A 158 158 VAL H H 158 9.120 9.002 0.118 1 1 1595 . 17 1 1 A 158 158 VAL HA H 158 4.580 4.860 -0.280 1 1 1603 . 17 1 1 A 158 158 VAL C C 158 172.800 174.111 -1.311 1 1 1604 . 17 1 1 A 158 158 VAL CA C 158 59.980 59.725 0.255 1 1 1605 . 17 1 1 A 158 158 VAL CB C 158 36.290 35.276 1.014 1 1 1608 . 17 1 1 A 158 158 VAL N N 158 121.710 119.365 2.345 1 1 1609 . 17 1 1 A 159 159 ASN H H 159 8.240 8.474 -0.234 1 1 1610 . 17 1 1 A 159 159 ASN HA H 159 5.420 5.134 0.286 1 1 1615 . 17 1 1 A 159 159 ASN C C 159 173.800 174.611 -0.811 1 1 1616 . 17 1 1 A 159 159 ASN CA C 159 51.740 52.886 -1.146 1 1 1617 . 17 1 1 A 159 159 ASN CB C 159 40.380 39.599 0.781 1 1 1618 . 17 1 1 A 159 159 ASN N N 159 122.730 124.152 -1.422 1 1 1620 . 17 1 1 A 160 160 ILE H H 160 9.160 8.761 0.399 1 1 1621 . 17 1 1 A 160 160 ILE HA H 160 5.130 5.107 0.023 1 1 1631 . 17 1 1 A 160 160 ILE C C 160 177.320 175.591 1.729 1 1 1632 . 17 1 1 A 160 160 ILE CA C 160 60.640 60.601 0.039 1 1 1633 . 17 1 1 A 160 160 ILE CB C 160 38.520 37.443 1.077 1 1 1637 . 17 1 1 A 160 160 ILE N N 160 123.690 125.680 -1.990 1 1 1638 . 17 1 1 A 161 161 ILE H H 161 8.780 9.377 -0.597 1 1 1639 . 17 1 1 A 161 161 ILE HA H 161 4.590 4.595 -0.005 1 1 1649 . 17 1 1 A 161 161 ILE C C 161 174.960 175.788 -0.828 1 1 1650 . 17 1 1 A 161 161 ILE CA C 161 59.320 60.319 -0.999 1 1 1651 . 17 1 1 A 161 161 ILE CB C 161 41.030 39.870 1.160 1 1 1655 . 17 1 1 A 161 161 ILE N N 161 122.490 129.047 -6.557 1 1 1656 . 17 1 1 A 162 162 GLU H H 162 8.620 8.434 0.186 1 1 1657 . 17 1 1 A 162 162 GLU HA H 162 4.290 4.365 -0.075 1 1 1662 . 17 1 1 A 162 162 GLU C C 162 176.660 177.423 -0.763 1 1 1663 . 17 1 1 A 162 162 GLU CA C 162 56.470 57.087 -0.617 1 1 1664 . 17 1 1 A 162 162 GLU CB C 162 31.150 30.336 0.814 1 1 1666 . 17 1 1 A 162 162 GLU N N 162 120.520 126.048 -5.528 1 1 1667 . 17 1 1 A 163 163 GLY H H 163 8.480 8.540 -0.060 1 1 1668 . 17 1 1 A 163 163 GLY HA2 H 163 3.910 4.069 -0.159 1 1 1669 . 17 1 1 A 163 163 GLY HA3 H 163 4.150 4.071 0.079 1 1 1670 . 17 1 1 A 163 163 GLY C C 163 174.000 173.050 0.950 1 1 1671 . 17 1 1 A 163 163 GLY CA C 163 45.270 44.924 0.346 1 1 1672 . 17 1 1 A 163 163 GLY N N 163 110.210 110.169 0.041 1 1 1673 . 17 1 1 A 164 164 THR H H 164 8.170 8.334 -0.164 1 1 1674 . 17 1 1 A 164 164 THR HA H 164 4.410 4.332 0.078 1 1 1679 . 17 1 1 A 164 164 THR C C 164 174.100 173.747 0.353 1 1 1680 . 17 1 1 A 164 164 THR CA C 164 61.620 62.357 -0.737 1 1 1681 . 17 1 1 A 164 164 THR CB C 164 70.060 69.862 0.198 1 1 1683 . 17 1 1 A 164 164 THR N N 164 113.480 116.338 -2.858 1 1 1 . 18 1 1 A 13 13 GLY H H 13 8.350 8.327 0.023 1 1 2 . 18 1 1 A 13 13 GLY HA2 H 13 3.920 4.186 -0.266 1 1 3 . 18 1 1 A 13 13 GLY HA3 H 13 3.920 4.196 -0.276 1 1 4 . 18 1 1 A 13 13 GLY CA C 13 45.290 45.451 -0.161 1 1 5 . 18 1 1 A 13 13 GLY N N 13 110.450 111.866 -1.416 1 1 6 . 18 1 1 A 14 14 LEU H H 14 8.050 8.278 -0.228 1 1 7 . 18 1 1 A 14 14 LEU N N 14 121.500 119.017 2.483 1 1 8 . 18 1 1 A 15 15 VAL H H 15 8.070 8.143 -0.073 1 1 9 . 18 1 1 A 15 15 VAL N N 15 122.390 113.979 8.411 1 1 10 . 18 1 1 A 16 16 PRO HA H 16 4.360 4.497 -0.137 1 1 17 . 18 1 1 A 16 16 PRO CA C 16 62.770 63.267 -0.497 1 1 18 . 18 1 1 A 16 16 PRO CB C 16 32.020 32.321 -0.301 1 1 21 . 18 1 1 A 21 21 MET H H 21 8.180 7.865 0.315 1 1 22 . 18 1 1 A 21 21 MET N N 21 121.310 119.016 2.294 1 1 23 . 18 1 1 A 22 22 ALA H H 22 8.290 8.341 -0.051 1 1 24 . 18 1 1 A 22 22 ALA N N 22 124.800 129.169 -4.369 1 1 25 . 18 1 1 A 23 23 SER H H 23 8.210 8.971 -0.761 1 1 26 . 18 1 1 A 23 23 SER N N 23 114.830 120.444 -5.614 1 1 27 . 18 1 1 A 24 24 LYS H H 24 8.250 8.090 0.160 1 1 28 . 18 1 1 A 24 24 LYS N N 24 122.980 118.699 4.281 1 1 29 . 18 1 1 A 25 25 LEU H H 25 8.140 8.584 -0.444 1 1 30 . 18 1 1 A 25 25 LEU HA H 25 4.290 4.474 -0.184 1 1 40 . 18 1 1 A 25 25 LEU C C 25 177.410 176.896 0.514 1 1 41 . 18 1 1 A 25 25 LEU CA C 25 55.430 55.971 -0.541 1 1 42 . 18 1 1 A 25 25 LEU CB C 25 42.350 43.613 -1.263 1 1 46 . 18 1 1 A 25 25 LEU N N 25 122.580 124.590 -2.010 1 1 47 . 18 1 1 A 26 26 LYS H H 26 8.200 7.943 0.257 1 1 48 . 18 1 1 A 26 26 LYS HA H 26 4.260 4.537 -0.277 1 1 57 . 18 1 1 A 26 26 LYS C C 26 176.520 175.952 0.568 1 1 58 . 18 1 1 A 26 26 LYS CA C 26 56.700 57.577 -0.877 1 1 59 . 18 1 1 A 26 26 LYS CB C 26 33.060 35.237 -2.177 1 1 63 . 18 1 1 A 26 26 LYS N N 26 121.800 116.716 5.084 1 1 64 . 18 1 1 A 27 27 GLU H H 27 8.380 8.140 0.240 1 1 65 . 18 1 1 A 27 27 GLU HA H 27 4.240 4.343 -0.103 1 1 70 . 18 1 1 A 27 27 GLU C C 27 176.130 175.499 0.631 1 1 71 . 18 1 1 A 27 27 GLU CA C 27 56.700 58.638 -1.938 1 1 72 . 18 1 1 A 27 27 GLU CB C 27 30.370 28.545 1.825 1 1 74 . 18 1 1 A 27 27 GLU N N 27 121.700 117.982 3.718 1 1 75 . 18 1 1 A 28 28 ALA H H 28 8.230 8.780 -0.550 1 1 76 . 18 1 1 A 28 28 ALA HA H 28 4.280 5.289 -1.009 1 1 80 . 18 1 1 A 28 28 ALA C C 28 177.090 175.816 1.274 1 1 81 . 18 1 1 A 28 28 ALA CA C 28 52.530 50.314 2.216 1 1 82 . 18 1 1 A 28 28 ALA CB C 28 19.360 23.585 -4.225 1 1 83 . 18 1 1 A 28 28 ALA N N 28 124.640 123.216 1.424 1 1 84 . 18 1 1 A 29 29 ALA H H 29 8.150 8.464 -0.314 1 1 85 . 18 1 1 A 29 29 ALA HA H 29 4.320 4.829 -0.509 1 1 89 . 18 1 1 A 29 29 ALA C C 29 177.120 176.981 0.139 1 1 90 . 18 1 1 A 29 29 ALA CA C 29 52.040 51.311 0.729 1 1 91 . 18 1 1 A 29 29 ALA CB C 29 19.430 19.681 -0.251 1 1 92 . 18 1 1 A 29 29 ALA N N 29 123.430 120.728 2.702 1 1 93 . 18 1 1 A 30 30 GLU H H 30 8.310 7.712 0.598 1 1 94 . 18 1 1 A 30 30 GLU HA H 30 4.220 4.546 -0.326 1 1 99 . 18 1 1 A 30 30 GLU C C 30 176.310 175.943 0.367 1 1 100 . 18 1 1 A 30 30 GLU CA C 30 56.630 56.235 0.395 1 1 101 . 18 1 1 A 30 30 GLU CB C 30 30.320 30.466 -0.146 1 1 103 . 18 1 1 A 30 30 GLU N N 30 120.630 118.141 2.489 1 1 104 . 18 1 1 A 31 31 VAL H H 31 8.630 8.908 -0.278 1 1 105 . 18 1 1 A 31 31 VAL HA H 31 4.430 4.979 -0.549 1 1 113 . 18 1 1 A 31 31 VAL C C 31 176.510 176.535 -0.025 1 1 114 . 18 1 1 A 31 31 VAL CA C 31 62.360 62.822 -0.462 1 1 115 . 18 1 1 A 31 31 VAL CB C 31 32.370 32.027 0.343 1 1 118 . 18 1 1 A 31 31 VAL N N 31 127.110 125.381 1.729 1 1 119 . 18 1 1 A 32 32 THR H H 32 7.640 8.811 -1.171 1 1 120 . 18 1 1 A 32 32 THR HA H 32 4.870 4.045 0.825 1 1 125 . 18 1 1 A 32 32 THR C C 32 172.220 174.783 -2.563 1 1 126 . 18 1 1 A 32 32 THR CA C 32 59.510 64.426 -4.916 1 1 127 . 18 1 1 A 32 32 THR CB C 32 71.630 70.207 1.423 1 1 129 . 18 1 1 A 32 32 THR N N 32 118.860 121.503 -2.643 1 1 130 . 18 1 1 A 33 33 GLY H H 33 8.350 7.847 0.503 1 1 131 . 18 1 1 A 33 33 GLY HA2 H 33 4.160 4.052 0.108 1 1 132 . 18 1 1 A 33 33 GLY HA3 H 33 4.250 4.066 0.184 1 1 133 . 18 1 1 A 33 33 GLY C C 33 172.820 172.853 -0.033 1 1 134 . 18 1 1 A 33 33 GLY CA C 33 46.680 44.881 1.799 1 1 135 . 18 1 1 A 33 33 GLY N N 33 106.720 109.390 -2.670 1 1 136 . 18 1 1 A 34 34 SER H H 34 8.810 8.055 0.755 1 1 137 . 18 1 1 A 34 34 SER HA H 34 5.390 5.107 0.283 1 1 140 . 18 1 1 A 34 34 SER C C 34 173.780 172.705 1.075 1 1 141 . 18 1 1 A 34 34 SER CA C 34 57.380 57.296 0.084 1 1 142 . 18 1 1 A 34 34 SER CB C 34 65.730 65.655 0.075 1 1 143 . 18 1 1 A 34 34 SER N N 34 112.690 120.042 -7.352 1 1 144 . 18 1 1 A 35 35 VAL H H 35 8.470 8.744 -0.274 1 1 145 . 18 1 1 A 35 35 VAL HA H 35 4.120 5.116 -0.996 1 1 153 . 18 1 1 A 35 35 VAL C C 35 174.750 174.296 0.454 1 1 154 . 18 1 1 A 35 35 VAL CA C 35 62.310 60.345 1.965 1 1 155 . 18 1 1 A 35 35 VAL CB C 35 34.550 33.957 0.593 1 1 158 . 18 1 1 A 35 35 VAL N N 35 123.150 120.252 2.898 1 1 159 . 18 1 1 A 36 36 SER H H 36 8.240 8.809 -0.569 1 1 160 . 18 1 1 A 36 36 SER HA H 36 4.690 4.812 -0.122 1 1 163 . 18 1 1 A 36 36 SER C C 36 171.860 173.403 -1.543 1 1 164 . 18 1 1 A 36 36 SER CA C 36 56.020 56.654 -0.634 1 1 165 . 18 1 1 A 36 36 SER CB C 36 66.050 63.945 2.105 1 1 166 . 18 1 1 A 36 36 SER N N 36 118.760 122.818 -4.058 1 1 167 . 18 1 1 A 37 37 LEU H H 37 8.310 8.916 -0.606 1 1 168 . 18 1 1 A 37 37 LEU HA H 37 4.870 4.962 -0.092 1 1 178 . 18 1 1 A 37 37 LEU C C 37 174.190 175.849 -1.659 1 1 179 . 18 1 1 A 37 37 LEU CA C 37 53.870 53.725 0.145 1 1 180 . 18 1 1 A 37 37 LEU CB C 37 47.000 43.770 3.230 1 1 184 . 18 1 1 A 37 37 LEU N N 37 124.790 128.663 -3.873 1 1 185 . 18 1 1 A 38 38 GLU H H 38 9.270 8.803 0.467 1 1 186 . 18 1 1 A 38 38 GLU HA H 38 4.650 4.994 -0.344 1 1 191 . 18 1 1 A 38 38 GLU C C 38 173.970 175.245 -1.275 1 1 192 . 18 1 1 A 38 38 GLU CA C 38 54.410 55.767 -1.357 1 1 193 . 18 1 1 A 38 38 GLU CB C 38 32.460 32.091 0.369 1 1 195 . 18 1 1 A 38 38 GLU N N 38 126.550 126.005 0.545 1 1 196 . 18 1 1 A 39 39 ALA H H 39 8.120 8.511 -0.391 1 1 197 . 18 1 1 A 39 39 ALA HA H 39 4.600 4.784 -0.184 1 1 201 . 18 1 1 A 39 39 ALA C C 39 175.930 177.158 -1.228 1 1 202 . 18 1 1 A 39 39 ALA CA C 39 51.570 50.669 0.901 1 1 203 . 18 1 1 A 39 39 ALA CB C 39 21.780 22.822 -1.042 1 1 204 . 18 1 1 A 39 39 ALA N N 39 124.410 128.791 -4.381 1 1 205 . 18 1 1 A 40 40 LEU H H 40 7.860 9.099 -1.239 1 1 206 . 18 1 1 A 40 40 LEU HA H 40 4.230 4.001 0.229 1 1 216 . 18 1 1 A 40 40 LEU C C 40 175.940 176.657 -0.717 1 1 217 . 18 1 1 A 40 40 LEU CA C 40 55.360 57.284 -1.924 1 1 218 . 18 1 1 A 40 40 LEU CB C 40 42.990 42.203 0.787 1 1 222 . 18 1 1 A 40 40 LEU N N 40 120.640 121.982 -1.342 1 1 223 . 18 1 1 A 41 41 GLU H H 41 8.210 7.858 0.352 1 1 224 . 18 1 1 A 41 41 GLU HA H 41 4.240 4.005 0.235 1 1 229 . 18 1 1 A 41 41 GLU C C 41 176.920 174.790 2.130 1 1 230 . 18 1 1 A 41 41 GLU CA C 41 58.090 57.750 0.340 1 1 231 . 18 1 1 A 41 41 GLU CB C 41 30.530 27.151 3.379 1 1 233 . 18 1 1 A 41 41 GLU N N 41 114.680 116.776 -2.096 1 1 234 . 18 1 1 A 42 42 GLU H H 42 7.490 7.707 -0.217 1 1 235 . 18 1 1 A 42 42 GLU HA H 42 5.680 4.776 0.904 1 1 240 . 18 1 1 A 42 42 GLU C C 42 173.790 174.003 -0.213 1 1 241 . 18 1 1 A 42 42 GLU CA C 42 54.360 56.199 -1.839 1 1 242 . 18 1 1 A 42 42 GLU CB C 42 33.850 33.145 0.705 1 1 244 . 18 1 1 A 42 42 GLU N N 42 116.670 118.415 -1.745 1 1 245 . 18 1 1 A 43 43 VAL H H 43 8.550 8.784 -0.234 1 1 246 . 18 1 1 A 43 43 VAL HA H 43 4.550 4.971 -0.421 1 1 254 . 18 1 1 A 43 43 VAL C C 43 172.220 173.225 -1.005 1 1 255 . 18 1 1 A 43 43 VAL CA C 43 59.470 59.395 0.075 1 1 256 . 18 1 1 A 43 43 VAL CB C 43 35.470 36.034 -0.564 1 1 259 . 18 1 1 A 43 43 VAL N N 43 120.030 124.672 -4.642 1 1 260 . 18 1 1 A 44 44 GLN H H 44 8.470 8.847 -0.377 1 1 261 . 18 1 1 A 44 44 GLN HA H 44 4.890 5.178 -0.288 1 1 268 . 18 1 1 A 44 44 GLN C C 44 176.130 174.861 1.269 1 1 269 . 18 1 1 A 44 44 GLN CA C 44 54.360 54.156 0.204 1 1 270 . 18 1 1 A 44 44 GLN CB C 44 30.610 32.250 -1.640 1 1 272 . 18 1 1 A 44 44 GLN N N 44 124.690 125.382 -0.692 1 1 274 . 18 1 1 A 45 45 VAL H H 45 8.130 8.597 -0.467 1 1 275 . 18 1 1 A 45 45 VAL HA H 45 3.030 3.911 -0.881 1 1 283 . 18 1 1 A 45 45 VAL C C 45 176.710 177.110 -0.400 1 1 284 . 18 1 1 A 45 45 VAL CA C 45 65.810 64.971 0.839 1 1 285 . 18 1 1 A 45 45 VAL CB C 45 31.960 31.588 0.372 1 1 288 . 18 1 1 A 45 45 VAL N N 45 120.450 127.053 -6.603 1 1 289 . 18 1 1 A 46 46 GLY H H 46 8.950 9.493 -0.543 1 1 290 . 18 1 1 A 46 46 GLY HA2 H 46 3.590 3.993 -0.403 1 1 291 . 18 1 1 A 46 46 GLY HA3 H 46 4.410 3.996 0.414 1 1 292 . 18 1 1 A 46 46 GLY C C 46 174.390 174.338 0.052 1 1 293 . 18 1 1 A 46 46 GLY CA C 46 44.730 45.227 -0.497 1 1 294 . 18 1 1 A 46 46 GLY N N 46 116.490 115.144 1.346 1 1 295 . 18 1 1 A 47 47 GLU H H 47 8.260 7.848 0.412 1 1 296 . 18 1 1 A 47 47 GLU HA H 47 4.460 4.753 -0.293 1 1 301 . 18 1 1 A 47 47 GLU C C 47 174.780 175.293 -0.513 1 1 302 . 18 1 1 A 47 47 GLU CA C 47 54.830 54.932 -0.102 1 1 303 . 18 1 1 A 47 47 GLU CB C 47 31.140 31.634 -0.494 1 1 305 . 18 1 1 A 47 47 GLU N N 47 120.520 119.774 0.746 1 1 306 . 18 1 1 A 48 48 ASN H H 48 8.440 8.722 -0.282 1 1 307 . 18 1 1 A 48 48 ASN HA H 48 5.380 5.719 -0.339 1 1 312 . 18 1 1 A 48 48 ASN C C 48 174.770 173.016 1.754 1 1 313 . 18 1 1 A 48 48 ASN CA C 48 51.570 51.251 0.319 1 1 314 . 18 1 1 A 48 48 ASN CB C 48 39.010 41.933 -2.923 1 1 315 . 18 1 1 A 48 48 ASN N N 48 117.180 116.823 0.357 1 1 317 . 18 1 1 A 49 49 LEU H H 49 9.810 8.327 1.483 1 1 318 . 18 1 1 A 49 49 LEU HA H 49 4.510 5.236 -0.726 1 1 328 . 18 1 1 A 49 49 LEU C C 49 174.560 174.611 -0.051 1 1 329 . 18 1 1 A 49 49 LEU CA C 49 53.460 53.473 -0.013 1 1 330 . 18 1 1 A 49 49 LEU CB C 49 45.520 46.416 -0.896 1 1 333 . 18 1 1 A 49 49 LEU N N 49 125.620 123.113 2.507 1 1 334 . 18 1 1 A 50 50 GLU H H 50 8.750 8.860 -0.110 1 1 335 . 18 1 1 A 50 50 GLU HA H 50 4.360 4.880 -0.520 1 1 340 . 18 1 1 A 50 50 GLU C C 50 175.340 175.058 0.282 1 1 341 . 18 1 1 A 50 50 GLU CA C 50 55.550 55.271 0.279 1 1 342 . 18 1 1 A 50 50 GLU CB C 50 29.890 31.003 -1.113 1 1 344 . 18 1 1 A 50 50 GLU N N 50 125.420 124.791 0.629 1 1 345 . 18 1 1 A 51 51 VAL H H 51 9.230 8.798 0.432 1 1 346 . 18 1 1 A 51 51 VAL HA H 51 4.190 4.743 -0.553 1 1 354 . 18 1 1 A 51 51 VAL C C 51 175.310 174.421 0.889 1 1 355 . 18 1 1 A 51 51 VAL CA C 51 62.520 61.021 1.499 1 1 356 . 18 1 1 A 51 51 VAL CB C 51 31.470 32.910 -1.440 1 1 359 . 18 1 1 A 51 51 VAL N N 51 129.810 120.475 9.335 1 1 360 . 18 1 1 A 52 52 GLY H H 52 9.410 8.554 0.856 1 1 361 . 18 1 1 A 52 52 GLY HA2 H 52 3.460 3.905 -0.445 1 1 362 . 18 1 1 A 52 52 GLY HA3 H 52 4.680 3.924 0.756 1 1 363 . 18 1 1 A 52 52 GLY C C 52 173.000 173.083 -0.083 1 1 364 . 18 1 1 A 52 52 GLY CA C 52 46.470 47.339 -0.869 1 1 365 . 18 1 1 A 52 52 GLY N N 52 116.600 113.202 3.398 1 1 366 . 18 1 1 A 53 53 VAL H H 53 9.130 8.585 0.545 1 1 367 . 18 1 1 A 53 53 VAL HA H 53 4.840 4.708 0.132 1 1 375 . 18 1 1 A 53 53 VAL C C 53 175.470 175.250 0.220 1 1 376 . 18 1 1 A 53 53 VAL CA C 53 61.350 61.500 -0.150 1 1 377 . 18 1 1 A 53 53 VAL CB C 53 34.300 31.629 2.671 1 1 380 . 18 1 1 A 53 53 VAL N N 53 129.050 123.699 5.351 1 1 381 . 18 1 1 A 54 54 GLY H H 54 8.420 8.686 -0.266 1 1 382 . 18 1 1 A 54 54 GLY HA2 H 54 3.850 3.983 -0.133 1 1 383 . 18 1 1 A 54 54 GLY HA3 H 54 3.850 4.010 -0.160 1 1 384 . 18 1 1 A 54 54 GLY C C 54 173.310 173.195 0.115 1 1 385 . 18 1 1 A 54 54 GLY CA C 54 45.180 44.361 0.819 1 1 386 . 18 1 1 A 54 54 GLY N N 54 116.890 115.528 1.362 1 1 387 . 18 1 1 A 55 55 ILE H H 55 10.190 8.112 2.078 1 1 388 . 18 1 1 A 55 55 ILE HA H 55 4.010 4.896 -0.886 1 1 398 . 18 1 1 A 55 55 ILE C C 55 174.380 175.140 -0.760 1 1 399 . 18 1 1 A 55 55 ILE CA C 55 61.350 59.825 1.525 1 1 400 . 18 1 1 A 55 55 ILE CB C 55 40.840 40.519 0.321 1 1 404 . 18 1 1 A 55 55 ILE N N 55 129.330 121.317 8.013 1 1 405 . 18 1 1 A 56 56 ASP H H 56 8.810 8.976 -0.166 1 1 406 . 18 1 1 A 56 56 ASP HA H 56 4.440 4.785 -0.345 1 1 409 . 18 1 1 A 56 56 ASP C C 56 175.530 175.848 -0.318 1 1 410 . 18 1 1 A 56 56 ASP CA C 56 56.460 55.061 1.399 1 1 411 . 18 1 1 A 56 56 ASP CB C 56 42.720 42.921 -0.201 1 1 412 . 18 1 1 A 56 56 ASP N N 56 128.310 127.532 0.778 1 1 413 . 18 1 1 A 57 57 GLU H H 57 7.270 7.697 -0.427 1 1 414 . 18 1 1 A 57 57 GLU HA H 57 4.290 4.692 -0.402 1 1 419 . 18 1 1 A 57 57 GLU C C 57 173.370 174.233 -0.863 1 1 420 . 18 1 1 A 57 57 GLU CA C 57 54.840 55.569 -0.729 1 1 421 . 18 1 1 A 57 57 GLU CB C 57 33.190 32.463 0.727 1 1 423 . 18 1 1 A 57 57 GLU N N 57 112.810 114.619 -1.809 1 1 424 . 18 1 1 A 58 58 LEU H H 58 8.370 8.683 -0.313 1 1 425 . 18 1 1 A 58 58 LEU HA H 58 4.830 4.687 0.143 1 1 434 . 18 1 1 A 58 58 LEU C C 58 174.180 174.480 -0.300 1 1 435 . 18 1 1 A 58 58 LEU CA C 58 55.320 54.621 0.699 1 1 436 . 18 1 1 A 58 58 LEU CB C 58 44.300 43.047 1.253 1 1 439 . 18 1 1 A 58 58 LEU N N 58 123.130 122.681 0.449 1 1 440 . 18 1 1 A 59 59 VAL H H 59 9.120 8.792 0.328 1 1 441 . 18 1 1 A 59 59 VAL HA H 59 4.240 4.515 -0.275 1 1 449 . 18 1 1 A 59 59 VAL C C 59 174.960 175.805 -0.845 1 1 450 . 18 1 1 A 59 59 VAL CA C 59 61.760 60.061 1.699 1 1 451 . 18 1 1 A 59 59 VAL CB C 59 33.760 33.468 0.292 1 1 454 . 18 1 1 A 59 59 VAL N N 59 127.930 126.824 1.106 1 1 455 . 18 1 1 A 60 60 ASN H H 60 8.770 8.785 -0.015 1 1 456 . 18 1 1 A 60 60 ASN HA H 60 4.250 4.331 -0.081 1 1 461 . 18 1 1 A 60 60 ASN C C 60 172.810 173.880 -1.070 1 1 462 . 18 1 1 A 60 60 ASN CA C 60 54.830 54.513 0.317 1 1 463 . 18 1 1 A 60 60 ASN CB C 60 36.030 37.017 -0.987 1 1 464 . 18 1 1 A 60 60 ASN N N 60 115.500 122.556 -7.056 1 1 466 . 18 1 1 A 61 61 ALA H H 61 7.330 7.276 0.054 1 1 467 . 18 1 1 A 61 61 ALA HA H 61 4.520 4.881 -0.361 1 1 471 . 18 1 1 A 61 61 ALA C C 61 174.580 176.088 -1.508 1 1 472 . 18 1 1 A 61 61 ALA CA C 61 51.560 50.589 0.971 1 1 473 . 18 1 1 A 61 61 ALA CB C 61 22.870 22.436 0.434 1 1 474 . 18 1 1 A 61 61 ALA N N 61 115.640 118.779 -3.139 1 1 475 . 18 1 1 A 62 62 GLU H H 62 7.900 9.283 -1.383 1 1 476 . 18 1 1 A 62 62 GLU HA H 62 4.310 4.751 -0.441 1 1 481 . 18 1 1 A 62 62 GLU C C 62 173.790 175.679 -1.889 1 1 482 . 18 1 1 A 62 62 GLU CA C 62 55.080 55.193 -0.113 1 1 483 . 18 1 1 A 62 62 GLU CB C 62 32.610 29.714 2.896 1 1 485 . 18 1 1 A 62 62 GLU N N 62 117.400 122.569 -5.169 1 1 486 . 18 1 1 A 63 63 ALA H H 63 8.910 8.756 0.154 1 1 487 . 18 1 1 A 63 63 ALA HA H 63 4.690 4.596 0.094 1 1 491 . 18 1 1 A 63 63 ALA C C 63 175.720 176.689 -0.969 1 1 492 . 18 1 1 A 63 63 ALA CA C 63 50.600 53.254 -2.654 1 1 493 . 18 1 1 A 63 63 ALA CB C 63 20.660 18.957 1.703 1 1 494 . 18 1 1 A 63 63 ALA N N 63 122.480 128.417 -5.937 1 1 495 . 18 1 1 A 64 64 PHE H H 64 9.220 9.201 0.019 1 1 496 . 18 1 1 A 64 64 PHE HA H 64 4.320 4.661 -0.341 1 1 501 . 18 1 1 A 64 64 PHE C C 64 174.380 176.196 -1.816 1 1 502 . 18 1 1 A 64 64 PHE CA C 64 59.770 58.727 1.043 1 1 503 . 18 1 1 A 64 64 PHE CB C 64 40.830 41.194 -0.364 1 1 504 . 18 1 1 A 64 64 PHE N N 64 120.870 123.152 -2.282 1 1 505 . 18 1 1 A 65 65 ALA H H 65 8.150 7.906 0.244 1 1 506 . 18 1 1 A 65 65 ALA HA H 65 5.280 4.819 0.461 1 1 510 . 18 1 1 A 65 65 ALA C C 65 175.950 175.648 0.302 1 1 511 . 18 1 1 A 65 65 ALA CA C 65 51.120 51.387 -0.267 1 1 512 . 18 1 1 A 65 65 ALA CB C 65 22.850 21.134 1.716 1 1 513 . 18 1 1 A 65 65 ALA N N 65 122.350 119.740 2.610 1 1 514 . 18 1 1 A 66 66 TYR H H 66 9.260 9.288 -0.028 1 1 515 . 18 1 1 A 66 66 TYR HA H 66 5.710 4.990 0.720 1 1 520 . 18 1 1 A 66 66 TYR C C 66 175.690 174.974 0.716 1 1 521 . 18 1 1 A 66 66 TYR CA C 66 54.390 58.306 -3.916 1 1 522 . 18 1 1 A 66 66 TYR CB C 66 41.560 40.102 1.458 1 1 523 . 18 1 1 A 66 66 TYR N N 66 124.350 126.611 -2.261 1 1 524 . 18 1 1 A 67 67 ASP H H 67 9.070 8.258 0.812 1 1 525 . 18 1 1 A 67 67 ASP HA H 67 5.630 5.188 0.442 1 1 528 . 18 1 1 A 67 67 ASP C C 67 174.300 174.322 -0.022 1 1 529 . 18 1 1 A 67 67 ASP CA C 67 51.590 53.763 -2.173 1 1 530 . 18 1 1 A 67 67 ASP CB C 67 44.380 43.578 0.802 1 1 531 . 18 1 1 A 67 67 ASP N N 67 130.490 128.230 2.260 1 1 532 . 18 1 1 A 68 68 PHE H H 68 8.670 8.518 0.152 1 1 533 . 18 1 1 A 68 68 PHE HA H 68 4.890 5.410 -0.520 1 1 538 . 18 1 1 A 68 68 PHE C C 68 172.220 173.373 -1.153 1 1 539 . 18 1 1 A 68 68 PHE CA C 68 57.360 55.021 2.339 1 1 540 . 18 1 1 A 68 68 PHE CB C 68 40.360 41.857 -1.497 1 1 541 . 18 1 1 A 68 68 PHE N N 68 118.200 121.739 -3.539 1 1 542 . 18 1 1 A 69 69 THR H H 69 8.390 8.438 -0.048 1 1 543 . 18 1 1 A 69 69 THR HA H 69 5.170 5.151 0.019 1 1 548 . 18 1 1 A 69 69 THR C C 69 172.620 173.689 -1.069 1 1 549 . 18 1 1 A 69 69 THR CA C 69 61.370 61.364 0.006 1 1 550 . 18 1 1 A 69 69 THR CB C 69 64.880 71.584 -6.704 1 1 552 . 18 1 1 A 69 69 THR N N 69 115.810 114.275 1.535 1 1 553 . 18 1 1 A 70 70 LEU H H 70 9.560 8.991 0.569 1 1 554 . 18 1 1 A 70 70 LEU HA H 70 5.270 4.789 0.481 1 1 564 . 18 1 1 A 70 70 LEU C C 70 173.800 175.292 -1.492 1 1 565 . 18 1 1 A 70 70 LEU CA C 70 53.460 55.676 -2.216 1 1 566 . 18 1 1 A 70 70 LEU CB C 70 45.040 43.279 1.761 1 1 570 . 18 1 1 A 70 70 LEU N N 70 129.220 130.453 -1.233 1 1 571 . 18 1 1 A 71 71 ASN H H 71 9.590 8.426 1.164 1 1 572 . 18 1 1 A 71 71 ASN HA H 71 5.880 5.480 0.400 1 1 577 . 18 1 1 A 71 71 ASN C C 71 177.970 174.015 3.955 1 1 578 . 18 1 1 A 71 71 ASN CA C 71 52.060 52.264 -0.204 1 1 579 . 18 1 1 A 71 71 ASN CB C 71 41.020 40.108 0.912 1 1 580 . 18 1 1 A 71 71 ASN N N 71 125.970 124.029 1.941 1 1 582 . 18 1 1 A 72 72 TYR H H 72 8.740 8.627 0.113 1 1 583 . 18 1 1 A 72 72 TYR HA H 72 5.110 5.292 -0.182 1 1 588 . 18 1 1 A 72 72 TYR C C 72 177.720 172.577 5.143 1 1 589 . 18 1 1 A 72 72 TYR CA C 72 55.310 55.371 -0.061 1 1 590 . 18 1 1 A 72 72 TYR CB C 72 41.510 41.279 0.231 1 1 591 . 18 1 1 A 72 72 TYR N N 72 119.640 120.721 -1.081 1 1 592 . 18 1 1 A 73 73 ASP H H 73 9.780 9.020 0.760 1 1 593 . 18 1 1 A 73 73 ASP HA H 73 4.680 5.122 -0.442 1 1 596 . 18 1 1 A 73 73 ASP C C 73 177.290 177.433 -0.143 1 1 597 . 18 1 1 A 73 73 ASP CA C 73 53.650 52.810 0.840 1 1 598 . 18 1 1 A 73 73 ASP CB C 73 40.900 43.214 -2.314 1 1 599 . 18 1 1 A 73 73 ASP N N 73 119.290 121.223 -1.933 1 1 600 . 18 1 1 A 74 74 GLU H H 74 9.430 8.792 0.638 1 1 601 . 18 1 1 A 74 74 GLU HA H 74 4.740 4.732 0.008 1 1 606 . 18 1 1 A 74 74 GLU C C 74 176.320 178.721 -2.401 1 1 607 . 18 1 1 A 74 74 GLU CA C 74 57.410 58.922 -1.512 1 1 608 . 18 1 1 A 74 74 GLU CB C 74 29.490 29.882 -0.392 1 1 610 . 18 1 1 A 74 74 GLU N N 74 130.930 124.093 6.837 1 1 611 . 18 1 1 A 75 75 ASN H H 75 8.680 8.325 0.355 1 1 612 . 18 1 1 A 75 75 ASN HA H 75 4.600 4.489 0.111 1 1 617 . 18 1 1 A 75 75 ASN C C 75 175.340 176.994 -1.654 1 1 618 . 18 1 1 A 75 75 ASN CA C 75 54.620 56.081 -1.461 1 1 619 . 18 1 1 A 75 75 ASN CB C 75 38.770 38.582 0.188 1 1 620 . 18 1 1 A 75 75 ASN N N 75 115.040 118.449 -3.409 1 1 622 . 18 1 1 A 76 76 ALA H H 76 7.740 7.892 -0.152 1 1 623 . 18 1 1 A 76 76 ALA HA H 76 4.310 4.479 -0.169 1 1 627 . 18 1 1 A 76 76 ALA C C 76 175.550 176.833 -1.283 1 1 628 . 18 1 1 A 76 76 ALA CA C 76 53.260 53.103 0.157 1 1 629 . 18 1 1 A 76 76 ALA CB C 76 21.450 21.134 0.316 1 1 630 . 18 1 1 A 76 76 ALA N N 76 122.200 119.444 2.756 1 1 631 . 18 1 1 A 77 77 PHE H H 77 8.070 7.903 0.167 1 1 632 . 18 1 1 A 77 77 PHE HA H 77 5.650 5.017 0.633 1 1 637 . 18 1 1 A 77 77 PHE C C 77 174.570 175.331 -0.761 1 1 638 . 18 1 1 A 77 77 PHE CA C 77 56.360 57.356 -0.996 1 1 639 . 18 1 1 A 77 77 PHE CB C 77 46.080 41.041 5.039 1 1 640 . 18 1 1 A 77 77 PHE N N 77 114.160 114.033 0.127 1 1 641 . 18 1 1 A 78 78 GLU H H 78 8.800 8.885 -0.085 1 1 642 . 18 1 1 A 78 78 GLU HA H 78 4.900 4.972 -0.072 1 1 647 . 18 1 1 A 78 78 GLU C C 78 175.950 174.632 1.318 1 1 648 . 18 1 1 A 78 78 GLU CA C 78 53.670 56.279 -2.609 1 1 649 . 18 1 1 A 78 78 GLU CB C 78 33.600 32.902 0.698 1 1 651 . 18 1 1 A 78 78 GLU N N 78 117.590 120.489 -2.899 1 1 652 . 18 1 1 A 79 79 TYR H H 79 8.770 9.485 -0.715 1 1 653 . 18 1 1 A 79 79 TYR HA H 79 4.250 4.312 -0.062 1 1 658 . 18 1 1 A 79 79 TYR C C 79 174.580 174.944 -0.364 1 1 659 . 18 1 1 A 79 79 TYR CA C 79 59.250 59.566 -0.316 1 1 660 . 18 1 1 A 79 79 TYR CB C 79 38.310 39.361 -1.051 1 1 661 . 18 1 1 A 79 79 TYR N N 79 126.560 128.907 -2.347 1 1 662 . 18 1 1 A 80 80 VAL H H 80 8.220 7.815 0.405 1 1 663 . 18 1 1 A 80 80 VAL HA H 80 3.690 3.868 -0.178 1 1 671 . 18 1 1 A 80 80 VAL C C 80 174.780 175.486 -0.706 1 1 672 . 18 1 1 A 80 80 VAL CA C 80 64.400 62.760 1.640 1 1 673 . 18 1 1 A 80 80 VAL CB C 80 33.510 32.901 0.609 1 1 676 . 18 1 1 A 80 80 VAL N N 80 129.460 124.309 5.151 1 1 677 . 18 1 1 A 81 81 GLU H H 81 6.920 7.569 -0.649 1 1 678 . 18 1 1 A 81 81 GLU HA H 81 4.260 4.777 -0.517 1 1 683 . 18 1 1 A 81 81 GLU C C 81 171.840 174.599 -2.759 1 1 684 . 18 1 1 A 81 81 GLU CA C 81 55.310 54.680 0.630 1 1 685 . 18 1 1 A 81 81 GLU CB C 81 30.520 33.081 -2.561 1 1 687 . 18 1 1 A 81 81 GLU N N 81 112.430 114.514 -2.084 1 1 688 . 18 1 1 A 82 82 ALA H H 82 8.310 8.779 -0.469 1 1 689 . 18 1 1 A 82 82 ALA HA H 82 5.650 5.041 0.609 1 1 693 . 18 1 1 A 82 82 ALA C C 82 176.110 176.977 -0.867 1 1 694 . 18 1 1 A 82 82 ALA CA C 82 50.620 51.804 -1.184 1 1 695 . 18 1 1 A 82 82 ALA CB C 82 21.770 20.075 1.695 1 1 696 . 18 1 1 A 82 82 ALA N N 82 121.240 126.057 -4.817 1 1 697 . 18 1 1 A 83 83 ILE H H 83 9.150 9.193 -0.043 1 1 698 . 18 1 1 A 83 83 ILE HA H 83 4.600 4.893 -0.293 1 1 708 . 18 1 1 A 83 83 ILE C C 83 174.810 174.946 -0.136 1 1 709 . 18 1 1 A 83 83 ILE CA C 83 60.060 59.131 0.929 1 1 710 . 18 1 1 A 83 83 ILE CB C 83 42.440 41.940 0.500 1 1 714 . 18 1 1 A 83 83 ILE N N 83 119.720 119.638 0.082 1 1 715 . 18 1 1 A 84 84 SER H H 84 8.350 8.787 -0.437 1 1 716 . 18 1 1 A 84 84 SER HA H 84 4.660 4.997 -0.337 1 1 719 . 18 1 1 A 84 84 SER C C 84 177.550 173.008 4.542 1 1 720 . 18 1 1 A 84 84 SER CA C 84 57.330 56.333 0.997 1 1 721 . 18 1 1 A 84 84 SER CB C 84 66.490 65.328 1.162 1 1 722 . 18 1 1 A 84 84 SER N N 84 116.740 116.569 0.171 1 1 723 . 18 1 1 A 85 85 ASP H H 85 8.740 8.702 0.038 1 1 724 . 18 1 1 A 85 85 ASP HA H 85 4.820 4.831 -0.011 1 1 727 . 18 1 1 A 85 85 ASP C C 85 176.090 175.835 0.255 1 1 728 . 18 1 1 A 85 85 ASP CA C 85 53.480 52.212 1.268 1 1 729 . 18 1 1 A 85 85 ASP CB C 85 42.480 43.409 -0.929 1 1 730 . 18 1 1 A 85 85 ASP N N 85 120.960 121.553 -0.593 1 1 731 . 18 1 1 A 86 86 ASP H H 86 8.380 8.576 -0.196 1 1 732 . 18 1 1 A 86 86 ASP HA H 86 4.450 4.940 -0.490 1 1 735 . 18 1 1 A 86 86 ASP C C 86 177.100 176.916 0.184 1 1 736 . 18 1 1 A 86 86 ASP CA C 86 56.240 53.312 2.928 1 1 737 . 18 1 1 A 86 86 ASP CB C 86 41.100 41.408 -0.308 1 1 738 . 18 1 1 A 86 86 ASP N N 86 117.710 121.879 -4.169 1 1 739 . 18 1 1 A 87 87 GLY H H 87 8.690 7.601 1.089 1 1 740 . 18 1 1 A 87 87 GLY HA2 H 87 3.870 4.095 -0.225 1 1 741 . 18 1 1 A 87 87 GLY HA3 H 87 4.090 4.103 -0.013 1 1 742 . 18 1 1 A 87 87 GLY C C 87 173.800 174.021 -0.221 1 1 743 . 18 1 1 A 87 87 GLY CA C 87 45.770 45.727 0.043 1 1 744 . 18 1 1 A 87 87 GLY N N 87 108.540 107.513 1.027 1 1 745 . 18 1 1 A 88 88 VAL H H 88 7.910 7.751 0.159 1 1 746 . 18 1 1 A 88 88 VAL HA H 88 4.780 4.475 0.305 1 1 754 . 18 1 1 A 88 88 VAL C C 88 173.970 174.583 -0.613 1 1 755 . 18 1 1 A 88 88 VAL CA C 88 60.900 60.638 0.262 1 1 756 . 18 1 1 A 88 88 VAL CB C 88 35.460 33.802 1.658 1 1 759 . 18 1 1 A 88 88 VAL N N 88 119.790 117.948 1.842 1 1 760 . 18 1 1 A 89 89 PHE H H 89 9.210 9.765 -0.555 1 1 761 . 18 1 1 A 89 89 PHE HA H 89 4.930 5.260 -0.330 1 1 766 . 18 1 1 A 89 89 PHE C C 89 173.970 174.708 -0.738 1 1 767 . 18 1 1 A 89 89 PHE CA C 89 56.450 56.956 -0.506 1 1 768 . 18 1 1 A 89 89 PHE CB C 89 41.120 43.049 -1.929 1 1 769 . 18 1 1 A 89 89 PHE N N 89 126.780 121.484 5.296 1 1 770 . 18 1 1 A 90 90 VAL H H 90 7.880 8.170 -0.290 1 1 771 . 18 1 1 A 90 90 VAL HA H 90 4.860 5.087 -0.227 1 1 779 . 18 1 1 A 90 90 VAL C C 90 173.190 174.428 -1.238 1 1 780 . 18 1 1 A 90 90 VAL CA C 90 59.750 61.136 -1.386 1 1 781 . 18 1 1 A 90 90 VAL CB C 90 34.770 35.079 -0.309 1 1 784 . 18 1 1 A 90 90 VAL N N 90 124.990 120.535 4.455 1 1 785 . 18 1 1 A 91 91 ASN H H 91 8.670 8.942 -0.272 1 1 786 . 18 1 1 A 91 91 ASN HA H 91 4.730 5.465 -0.735 1 1 791 . 18 1 1 A 91 91 ASN C C 91 173.200 173.959 -0.759 1 1 792 . 18 1 1 A 91 91 ASN CA C 91 51.970 51.996 -0.026 1 1 793 . 18 1 1 A 91 91 ASN CB C 91 41.340 41.454 -0.114 1 1 794 . 18 1 1 A 91 91 ASN N N 91 124.860 124.991 -0.131 1 1 796 . 18 1 1 A 92 92 ALA H H 92 8.840 9.045 -0.205 1 1 797 . 18 1 1 A 92 92 ALA HA H 92 5.290 5.465 -0.175 1 1 801 . 18 1 1 A 92 92 ALA C C 92 176.330 176.040 0.290 1 1 802 . 18 1 1 A 92 92 ALA CA C 92 50.170 50.483 -0.313 1 1 803 . 18 1 1 A 92 92 ALA CB C 92 23.610 20.651 2.959 1 1 804 . 18 1 1 A 92 92 ALA N N 92 128.510 127.845 0.665 1 1 805 . 18 1 1 A 93 93 LYS H H 93 8.670 9.559 -0.889 1 1 806 . 18 1 1 A 93 93 LYS HA H 93 4.460 4.771 -0.311 1 1 815 . 18 1 1 A 93 93 LYS C C 93 174.170 175.105 -0.935 1 1 816 . 18 1 1 A 93 93 LYS CA C 93 55.010 54.666 0.344 1 1 817 . 18 1 1 A 93 93 LYS CB C 93 36.430 34.541 1.889 1 1 821 . 18 1 1 A 93 93 LYS N N 93 121.300 122.794 -1.494 1 1 822 . 18 1 1 A 94 94 LYS H H 94 8.960 8.682 0.278 1 1 823 . 18 1 1 A 94 94 LYS HA H 94 4.460 4.309 0.151 1 1 832 . 18 1 1 A 94 94 LYS C C 94 176.330 177.139 -0.809 1 1 833 . 18 1 1 A 94 94 LYS CA C 94 56.720 56.266 0.454 1 1 834 . 18 1 1 A 94 94 LYS CB C 94 31.930 32.446 -0.516 1 1 837 . 18 1 1 A 94 94 LYS N N 94 127.060 126.902 0.158 1 1 838 . 18 1 1 A 95 95 ILE H H 95 8.290 8.245 0.045 1 1 839 . 18 1 1 A 95 95 ILE HA H 95 4.120 4.105 0.015 1 1 849 . 18 1 1 A 95 95 ILE C C 95 175.740 175.412 0.328 1 1 850 . 18 1 1 A 95 95 ILE CA C 95 62.760 61.872 0.888 1 1 851 . 18 1 1 A 95 95 ILE CB C 95 38.890 37.789 1.101 1 1 855 . 18 1 1 A 95 95 ILE N N 95 126.530 121.600 4.930 1 1 856 . 18 1 1 A 96 96 GLU H H 96 8.030 7.669 0.361 1 1 857 . 18 1 1 A 96 96 GLU HA H 96 4.450 4.594 -0.144 1 1 862 . 18 1 1 A 96 96 GLU C C 96 174.380 173.904 0.476 1 1 863 . 18 1 1 A 96 96 GLU CA C 96 54.320 55.717 -1.397 1 1 864 . 18 1 1 A 96 96 GLU CB C 96 32.770 32.757 0.013 1 1 866 . 18 1 1 A 96 96 GLU N N 96 117.080 119.691 -2.611 1 1 867 . 18 1 1 A 97 97 ASP H H 97 8.730 8.721 0.009 1 1 868 . 18 1 1 A 97 97 ASP HA H 97 4.360 4.835 -0.475 1 1 871 . 18 1 1 A 97 97 ASP C C 97 177.100 176.846 0.254 1 1 872 . 18 1 1 A 97 97 ASP CA C 97 57.160 54.582 2.578 1 1 873 . 18 1 1 A 97 97 ASP CB C 97 39.920 40.218 -0.298 1 1 874 . 18 1 1 A 97 97 ASP N N 97 120.570 120.595 -0.025 1 1 875 . 18 1 1 A 98 98 GLY H H 98 8.760 8.553 0.207 1 1 876 . 18 1 1 A 98 98 GLY HA2 H 98 2.120 2.320 -0.200 1 1 877 . 18 1 1 A 98 98 GLY HA3 H 98 3.910 3.533 0.377 1 1 878 . 18 1 1 A 98 98 GLY C C 98 174.000 172.953 1.047 1 1 879 . 18 1 1 A 98 98 GLY CA C 98 45.720 45.544 0.176 1 1 880 . 18 1 1 A 98 98 GLY N N 98 112.090 111.588 0.502 1 1 881 . 18 1 1 A 99 99 LYS H H 99 7.890 7.151 0.739 1 1 882 . 18 1 1 A 99 99 LYS HA H 99 5.330 4.851 0.479 1 1 891 . 18 1 1 A 99 99 LYS C C 99 174.750 174.222 0.528 1 1 892 . 18 1 1 A 99 99 LYS CA C 99 55.990 54.766 1.224 1 1 893 . 18 1 1 A 99 99 LYS CB C 99 37.840 35.537 2.303 1 1 897 . 18 1 1 A 99 99 LYS N N 99 118.050 114.687 3.363 1 1 898 . 18 1 1 A 100 100 VAL H H 100 8.980 8.404 0.576 1 1 899 . 18 1 1 A 100 100 VAL HA H 100 4.510 4.652 -0.142 1 1 907 . 18 1 1 A 100 100 VAL C C 100 174.760 172.774 1.986 1 1 908 . 18 1 1 A 100 100 VAL CA C 100 60.130 59.759 0.371 1 1 909 . 18 1 1 A 100 100 VAL CB C 100 35.240 35.195 0.045 1 1 912 . 18 1 1 A 100 100 VAL N N 100 123.850 120.560 3.290 1 1 913 . 18 1 1 A 101 101 ARG H H 101 8.810 8.484 0.326 1 1 914 . 18 1 1 A 101 101 ARG HA H 101 4.850 5.066 -0.216 1 1 921 . 18 1 1 A 101 101 ARG C C 101 174.770 174.352 0.418 1 1 922 . 18 1 1 A 101 101 ARG CA C 101 54.580 54.461 0.119 1 1 923 . 18 1 1 A 101 101 ARG CB C 101 32.400 32.163 0.237 1 1 926 . 18 1 1 A 101 101 ARG N N 101 129.210 129.306 -0.096 1 1 927 . 18 1 1 A 102 102 VAL H H 102 9.100 8.412 0.688 1 1 928 . 18 1 1 A 102 102 VAL HA H 102 4.120 5.084 -0.964 1 1 936 . 18 1 1 A 102 102 VAL C C 102 171.640 173.722 -2.082 1 1 937 . 18 1 1 A 102 102 VAL CA C 102 61.350 59.093 2.257 1 1 938 . 18 1 1 A 102 102 VAL CB C 102 32.530 35.337 -2.807 1 1 941 . 18 1 1 A 102 102 VAL N N 102 130.470 123.183 7.287 1 1 942 . 18 1 1 A 103 103 LEU H H 103 8.110 8.975 -0.865 1 1 943 . 18 1 1 A 103 103 LEU HA H 103 5.120 4.951 0.169 1 1 953 . 18 1 1 A 103 103 LEU C C 103 176.410 175.728 0.682 1 1 954 . 18 1 1 A 103 103 LEU CA C 103 53.380 53.438 -0.058 1 1 955 . 18 1 1 A 103 103 LEU CB C 103 43.680 43.797 -0.117 1 1 959 . 18 1 1 A 103 103 LEU N N 103 125.560 126.428 -0.868 1 1 960 . 18 1 1 A 104 104 VAL H H 104 9.580 9.736 -0.156 1 1 961 . 18 1 1 A 104 104 VAL HA H 104 5.260 5.389 -0.129 1 1 969 . 18 1 1 A 104 104 VAL C C 104 176.030 174.798 1.232 1 1 970 . 18 1 1 A 104 104 VAL CA C 104 60.220 61.233 -1.013 1 1 971 . 18 1 1 A 104 104 VAL CB C 104 34.310 33.692 0.618 1 1 974 . 18 1 1 A 104 104 VAL N N 104 125.790 127.238 -1.448 1 1 975 . 18 1 1 A 105 105 SER H H 105 9.340 8.699 0.641 1 1 976 . 18 1 1 A 105 105 SER HA H 105 5.300 5.102 0.198 1 1 979 . 18 1 1 A 105 105 SER C C 105 173.600 172.850 0.750 1 1 980 . 18 1 1 A 105 105 SER CA C 105 57.450 57.417 0.033 1 1 981 . 18 1 1 A 105 105 SER CB C 105 65.600 66.807 -1.207 1 1 982 . 18 1 1 A 105 105 SER N N 105 119.220 119.948 -0.728 1 1 983 . 18 1 1 A 106 106 SER H H 106 8.350 8.994 -0.644 1 1 984 . 18 1 1 A 106 106 SER HA H 106 4.720 4.651 0.069 1 1 987 . 18 1 1 A 106 106 SER C C 106 176.930 174.344 2.586 1 1 988 . 18 1 1 A 106 106 SER CA C 106 58.170 58.582 -0.412 1 1 989 . 18 1 1 A 106 106 SER CB C 106 64.170 63.499 0.671 1 1 990 . 18 1 1 A 106 106 SER N N 106 114.800 120.182 -5.382 1 1 991 . 18 1 1 A 107 107 LEU H H 107 8.770 8.185 0.585 1 1 992 . 18 1 1 A 107 107 LEU HA H 107 4.710 4.534 0.176 1 1 1001 . 18 1 1 A 107 107 LEU C C 107 178.280 177.346 0.934 1 1 1002 . 18 1 1 A 107 107 LEU CA C 107 55.280 54.254 1.026 1 1 1003 . 18 1 1 A 107 107 LEU CB C 107 43.410 41.292 2.118 1 1 1007 . 18 1 1 A 107 107 LEU N N 107 127.210 127.667 -0.457 1 1 1008 . 18 1 1 A 108 108 THR H H 108 8.210 7.755 0.455 1 1 1009 . 18 1 1 A 108 108 THR HA H 108 4.400 4.581 -0.181 1 1 1015 . 18 1 1 A 108 108 THR C C 108 176.130 175.626 0.504 1 1 1016 . 18 1 1 A 108 108 THR CA C 108 62.050 62.076 -0.026 1 1 1017 . 18 1 1 A 108 108 THR CB C 108 70.910 71.370 -0.460 1 1 1019 . 18 1 1 A 108 108 THR N N 108 108.810 111.685 -2.875 1 1 1020 . 18 1 1 A 109 109 GLY H H 109 8.250 8.087 0.163 1 1 1021 . 18 1 1 A 109 109 GLY HA2 H 109 3.780 3.992 -0.212 1 1 1022 . 18 1 1 A 109 109 GLY HA3 H 109 4.290 4.003 0.287 1 1 1023 . 18 1 1 A 109 109 GLY C C 109 173.180 174.253 -1.073 1 1 1024 . 18 1 1 A 109 109 GLY CA C 109 45.340 45.058 0.282 1 1 1025 . 18 1 1 A 109 109 GLY N N 109 110.160 110.959 -0.799 1 1 1026 . 18 1 1 A 110 110 GLU H H 110 7.960 7.487 0.473 1 1 1027 . 18 1 1 A 110 110 GLU HA H 110 4.760 4.619 0.141 1 1 1032 . 18 1 1 A 110 110 GLU CA C 110 53.450 53.512 -0.062 1 1 1033 . 18 1 1 A 110 110 GLU CB C 110 30.020 29.788 0.232 1 1 1035 . 18 1 1 A 110 110 GLU N N 110 119.720 120.609 -0.889 1 1 1036 . 18 1 1 A 111 111 PRO HA H 111 3.250 4.140 -0.890 1 1 1043 . 18 1 1 A 111 111 PRO C C 111 176.710 176.339 0.371 1 1 1044 . 18 1 1 A 111 111 PRO CA C 111 62.240 61.934 0.306 1 1 1045 . 18 1 1 A 111 111 PRO CB C 111 31.990 32.646 -0.656 1 1 1048 . 18 1 1 A 112 112 LEU H H 112 8.840 8.992 -0.152 1 1 1049 . 18 1 1 A 112 112 LEU HA H 112 4.290 4.300 -0.010 1 1 1059 . 18 1 1 A 112 112 LEU CA C 112 52.220 53.337 -1.117 1 1 1060 . 18 1 1 A 112 112 LEU CB C 112 41.090 43.101 -2.011 1 1 1063 . 18 1 1 A 112 112 LEU N N 112 122.420 123.485 -1.065 1 1 1064 . 18 1 1 A 113 113 PRO HA H 113 4.380 4.304 0.076 1 1 1071 . 18 1 1 A 113 113 PRO C C 113 176.100 177.468 -1.368 1 1 1072 . 18 1 1 A 113 113 PRO CA C 113 61.930 65.389 -3.459 1 1 1073 . 18 1 1 A 113 113 PRO CB C 113 32.470 31.621 0.849 1 1 1076 . 18 1 1 A 114 114 ALA H H 114 8.070 7.797 0.273 1 1 1077 . 18 1 1 A 114 114 ALA HA H 114 4.550 3.982 0.568 1 1 1081 . 18 1 1 A 114 114 ALA C C 114 177.490 176.964 0.526 1 1 1082 . 18 1 1 A 114 114 ALA CA C 114 51.340 53.792 -2.452 1 1 1083 . 18 1 1 A 114 114 ALA CB C 114 19.940 18.140 1.800 1 1 1084 . 18 1 1 A 114 114 ALA N N 114 121.460 120.793 0.667 1 1 1085 . 18 1 1 A 115 115 LYS H H 115 9.000 8.763 0.237 1 1 1086 . 18 1 1 A 115 115 LYS HA H 115 3.930 3.991 -0.061 1 1 1095 . 18 1 1 A 115 115 LYS C C 115 175.740 175.304 0.436 1 1 1096 . 18 1 1 A 115 115 LYS CA C 115 57.580 57.750 -0.170 1 1 1097 . 18 1 1 A 115 115 LYS CB C 115 29.510 30.698 -1.188 1 1 1101 . 18 1 1 A 115 115 LYS N N 115 112.560 115.637 -3.077 1 1 1102 . 18 1 1 A 116 116 GLU H H 116 7.620 7.644 -0.024 1 1 1103 . 18 1 1 A 116 116 GLU HA H 116 4.550 4.936 -0.386 1 1 1108 . 18 1 1 A 116 116 GLU C C 116 176.110 175.320 0.790 1 1 1109 . 18 1 1 A 116 116 GLU CA C 116 54.570 54.408 0.162 1 1 1110 . 18 1 1 A 116 116 GLU CB C 116 33.680 33.695 -0.015 1 1 1112 . 18 1 1 A 116 116 GLU N N 116 115.710 117.639 -1.929 1 1 1113 . 18 1 1 A 117 117 VAL H H 117 8.770 8.842 -0.072 1 1 1114 . 18 1 1 A 117 117 VAL HA H 117 3.200 4.038 -0.838 1 1 1122 . 18 1 1 A 117 117 VAL C C 117 175.740 175.898 -0.158 1 1 1123 . 18 1 1 A 117 117 VAL CA C 117 65.340 63.300 2.040 1 1 1124 . 18 1 1 A 117 117 VAL CB C 117 31.290 30.897 0.393 1 1 1127 . 18 1 1 A 117 117 VAL N N 117 124.450 120.296 4.154 1 1 1128 . 18 1 1 A 118 118 LEU H H 118 8.550 9.032 -0.482 1 1 1129 . 18 1 1 A 118 118 LEU HA H 118 4.540 4.491 0.049 1 1 1139 . 18 1 1 A 118 118 LEU C C 118 176.210 176.444 -0.234 1 1 1140 . 18 1 1 A 118 118 LEU CA C 118 55.510 55.772 -0.262 1 1 1141 . 18 1 1 A 118 118 LEU CB C 118 44.600 43.151 1.449 1 1 1145 . 18 1 1 A 118 118 LEU N N 118 128.440 128.685 -0.245 1 1 1146 . 18 1 1 A 119 119 ALA H H 119 7.970 7.674 0.296 1 1 1147 . 18 1 1 A 119 119 ALA HA H 119 4.740 4.839 -0.099 1 1 1151 . 18 1 1 A 119 119 ALA C C 119 174.570 175.450 -0.880 1 1 1152 . 18 1 1 A 119 119 ALA CA C 119 50.770 51.718 -0.948 1 1 1153 . 18 1 1 A 119 119 ALA CB C 119 22.450 22.479 -0.029 1 1 1154 . 18 1 1 A 119 119 ALA N N 119 118.100 118.777 -0.677 1 1 1155 . 18 1 1 A 120 120 LYS H H 120 8.760 9.001 -0.241 1 1 1156 . 18 1 1 A 120 120 LYS HA H 120 5.240 5.333 -0.093 1 1 1165 . 18 1 1 A 120 120 LYS C C 120 175.340 174.617 0.723 1 1 1166 . 18 1 1 A 120 120 LYS CA C 120 54.220 54.965 -0.745 1 1 1167 . 18 1 1 A 120 120 LYS CB C 120 34.340 33.964 0.376 1 1 1171 . 18 1 1 A 120 120 LYS N N 120 120.010 122.987 -2.977 1 1 1172 . 18 1 1 A 121 121 VAL H H 121 9.410 8.551 0.859 1 1 1173 . 18 1 1 A 121 121 VAL HA H 121 4.230 4.718 -0.488 1 1 1181 . 18 1 1 A 121 121 VAL C C 121 173.980 175.118 -1.138 1 1 1182 . 18 1 1 A 121 121 VAL CA C 121 62.370 61.476 0.894 1 1 1183 . 18 1 1 A 121 121 VAL CB C 121 32.410 33.166 -0.756 1 1 1186 . 18 1 1 A 121 121 VAL N N 121 124.960 126.034 -1.074 1 1 1187 . 18 1 1 A 122 122 VAL H H 122 9.280 8.420 0.860 1 1 1188 . 18 1 1 A 122 122 VAL HA H 122 4.360 4.734 -0.374 1 1 1196 . 18 1 1 A 122 122 VAL C C 122 174.190 175.761 -1.571 1 1 1197 . 18 1 1 A 122 122 VAL CA C 122 62.760 61.806 0.954 1 1 1198 . 18 1 1 A 122 122 VAL CB C 122 32.020 32.246 -0.226 1 1 1201 . 18 1 1 A 122 122 VAL N N 122 128.990 127.011 1.979 1 1 1202 . 18 1 1 A 123 123 LEU H H 123 8.610 8.709 -0.099 1 1 1203 . 18 1 1 A 123 123 LEU HA H 123 4.900 4.682 0.218 1 1 1213 . 18 1 1 A 123 123 LEU C C 123 174.950 176.100 -1.150 1 1 1214 . 18 1 1 A 123 123 LEU CA C 123 52.050 53.269 -1.219 1 1 1215 . 18 1 1 A 123 123 LEU CB C 123 45.210 42.930 2.280 1 1 1219 . 18 1 1 A 123 123 LEU N N 123 127.200 127.830 -0.630 1 1 1220 . 18 1 1 A 124 124 ARG H H 124 9.540 8.958 0.582 1 1 1221 . 18 1 1 A 124 124 ARG HA H 124 4.900 4.909 -0.009 1 1 1229 . 18 1 1 A 124 124 ARG C C 124 176.320 175.207 1.113 1 1 1230 . 18 1 1 A 124 124 ARG CA C 124 55.320 54.469 0.851 1 1 1231 . 18 1 1 A 124 124 ARG CB C 124 31.750 32.571 -0.821 1 1 1234 . 18 1 1 A 124 124 ARG N N 124 124.290 121.848 2.442 1 1 1236 . 18 1 1 A 125 125 ALA H H 125 8.880 8.511 0.369 1 1 1237 . 18 1 1 A 125 125 ALA HA H 125 4.380 4.045 0.335 1 1 1241 . 18 1 1 A 125 125 ALA C C 125 177.290 177.747 -0.457 1 1 1242 . 18 1 1 A 125 125 ALA CA C 125 52.530 51.268 1.262 1 1 1243 . 18 1 1 A 125 125 ALA CB C 125 19.870 17.442 2.428 1 1 1244 . 18 1 1 A 125 125 ALA N N 125 130.790 129.299 1.491 1 1 1245 . 18 1 1 A 126 126 GLU H H 126 9.260 8.323 0.937 1 1 1246 . 18 1 1 A 126 126 GLU HA H 126 4.460 4.386 0.074 1 1 1251 . 18 1 1 A 126 126 GLU C C 126 176.120 176.230 -0.110 1 1 1252 . 18 1 1 A 126 126 GLU CA C 126 56.940 57.148 -0.208 1 1 1253 . 18 1 1 A 126 126 GLU CB C 126 32.450 30.279 2.171 1 1 1255 . 18 1 1 A 126 126 GLU N N 126 125.740 123.008 2.732 1 1 1256 . 18 1 1 A 127 127 ALA H H 127 7.460 7.458 0.002 1 1 1257 . 18 1 1 A 127 127 ALA HA H 127 4.360 4.592 -0.232 1 1 1261 . 18 1 1 A 127 127 ALA C C 127 173.400 175.817 -2.417 1 1 1262 . 18 1 1 A 127 127 ALA CA C 127 51.360 51.607 -0.247 1 1 1263 . 18 1 1 A 127 127 ALA CB C 127 22.180 22.197 -0.017 1 1 1264 . 18 1 1 A 127 127 ALA N N 127 120.910 119.276 1.634 1 1 1265 . 18 1 1 A 128 128 LYS H H 128 7.940 8.687 -0.747 1 1 1266 . 18 1 1 A 128 128 LYS HA H 128 3.580 4.132 -0.552 1 1 1275 . 18 1 1 A 128 128 LYS C C 128 176.080 175.779 0.301 1 1 1276 . 18 1 1 A 128 128 LYS CA C 128 56.860 57.139 -0.279 1 1 1277 . 18 1 1 A 128 128 LYS CB C 128 33.170 33.136 0.034 1 1 1281 . 18 1 1 A 128 128 LYS N N 128 116.520 124.382 -7.862 1 1 1282 . 18 1 1 A 129 129 ALA H H 129 8.590 8.660 -0.070 1 1 1283 . 18 1 1 A 129 129 ALA HA H 129 4.390 4.685 -0.295 1 1 1287 . 18 1 1 A 129 129 ALA C C 129 174.970 176.514 -1.544 1 1 1288 . 18 1 1 A 129 129 ALA CA C 129 52.970 51.415 1.555 1 1 1289 . 18 1 1 A 129 129 ALA CB C 129 21.500 18.902 2.598 1 1 1290 . 18 1 1 A 129 129 ALA N N 129 124.710 127.760 -3.050 1 1 1291 . 18 1 1 A 130 130 GLU H H 130 8.660 8.262 0.398 1 1 1292 . 18 1 1 A 130 130 GLU HA H 130 4.660 3.966 0.694 1 1 1297 . 18 1 1 A 130 130 GLU C C 130 177.390 177.534 -0.144 1 1 1298 . 18 1 1 A 130 130 GLU CA C 130 55.070 58.470 -3.400 1 1 1299 . 18 1 1 A 130 130 GLU CB C 130 30.860 29.194 1.666 1 1 1301 . 18 1 1 A 130 130 GLU N N 130 123.180 122.807 0.373 1 1 1302 . 18 1 1 A 131 131 GLY H H 131 9.170 9.136 0.034 1 1 1303 . 18 1 1 A 131 131 GLY HA2 H 131 3.560 4.013 -0.453 1 1 1304 . 18 1 1 A 131 131 GLY HA3 H 131 3.750 4.019 -0.269 1 1 1305 . 18 1 1 A 131 131 GLY C C 131 174.550 174.669 -0.119 1 1 1306 . 18 1 1 A 131 131 GLY CA C 131 47.660 45.545 2.115 1 1 1307 . 18 1 1 A 131 131 GLY N N 131 115.530 115.914 -0.384 1 1 1308 . 18 1 1 A 132 132 SER H H 132 8.430 8.138 0.292 1 1 1309 . 18 1 1 A 132 132 SER HA H 132 4.170 4.659 -0.489 1 1 1312 . 18 1 1 A 132 132 SER C C 132 175.350 174.132 1.218 1 1 1313 . 18 1 1 A 132 132 SER CA C 132 59.050 57.619 1.431 1 1 1314 . 18 1 1 A 132 132 SER CB C 132 64.880 61.994 2.886 1 1 1315 . 18 1 1 A 132 132 SER N N 132 115.930 118.455 -2.525 1 1 1316 . 18 1 1 A 133 133 ASN H H 133 8.850 9.054 -0.204 1 1 1317 . 18 1 1 A 133 133 ASN HA H 133 4.910 5.203 -0.293 1 1 1322 . 18 1 1 A 133 133 ASN C C 133 175.450 174.611 0.839 1 1 1323 . 18 1 1 A 133 133 ASN CA C 133 54.920 53.856 1.064 1 1 1324 . 18 1 1 A 133 133 ASN CB C 133 41.060 39.010 2.050 1 1 1325 . 18 1 1 A 133 133 ASN N N 133 125.590 122.624 2.966 1 1 1327 . 18 1 1 A 134 134 LEU H H 134 9.070 9.633 -0.563 1 1 1328 . 18 1 1 A 134 134 LEU HA H 134 5.230 5.313 -0.083 1 1 1338 . 18 1 1 A 134 134 LEU C C 134 175.240 175.259 -0.019 1 1 1339 . 18 1 1 A 134 134 LEU CA C 134 53.470 53.401 0.069 1 1 1340 . 18 1 1 A 134 134 LEU CB C 134 45.090 43.423 1.667 1 1 1344 . 18 1 1 A 134 134 LEU N N 134 129.210 126.356 2.854 1 1 1345 . 18 1 1 A 135 135 SER H H 135 8.690 8.631 0.059 1 1 1346 . 18 1 1 A 135 135 SER HA H 135 5.280 5.380 -0.100 1 1 1349 . 18 1 1 A 135 135 SER C C 135 173.590 173.436 0.154 1 1 1350 . 18 1 1 A 135 135 SER CA C 135 56.220 56.647 -0.427 1 1 1351 . 18 1 1 A 135 135 SER CB C 135 66.510 64.555 1.955 1 1 1352 . 18 1 1 A 135 135 SER N N 135 113.020 119.017 -5.997 1 1 1353 . 18 1 1 A 136 136 VAL H H 136 8.940 8.819 0.121 1 1 1354 . 18 1 1 A 136 136 VAL HA H 136 5.500 4.560 0.940 1 1 1362 . 18 1 1 A 136 136 VAL C C 136 175.730 175.252 0.478 1 1 1363 . 18 1 1 A 136 136 VAL CA C 136 60.960 61.605 -0.645 1 1 1364 . 18 1 1 A 136 136 VAL CB C 136 33.630 31.788 1.842 1 1 1367 . 18 1 1 A 136 136 VAL N N 136 124.340 125.848 -1.508 1 1 1368 . 18 1 1 A 137 137 THR H H 137 9.240 8.521 0.719 1 1 1369 . 18 1 1 A 137 137 THR HA H 137 4.920 4.795 0.125 1 1 1374 . 18 1 1 A 137 137 THR C C 137 173.500 174.358 -0.858 1 1 1375 . 18 1 1 A 137 137 THR CA C 137 59.120 60.117 -0.997 1 1 1376 . 18 1 1 A 137 137 THR CB C 137 72.500 70.793 1.707 1 1 1378 . 18 1 1 A 137 137 THR N N 137 117.010 118.117 -1.107 1 1 1379 . 18 1 1 A 138 138 ASN H H 138 9.190 8.760 0.430 1 1 1380 . 18 1 1 A 138 138 ASN HA H 138 4.420 4.347 0.073 1 1 1385 . 18 1 1 A 138 138 ASN C C 138 175.550 174.296 1.254 1 1 1386 . 18 1 1 A 138 138 ASN CA C 138 54.350 53.884 0.466 1 1 1387 . 18 1 1 A 138 138 ASN CB C 138 37.380 36.371 1.009 1 1 1388 . 18 1 1 A 138 138 ASN N N 138 115.270 120.643 -5.373 1 1 1390 . 18 1 1 A 139 139 SER H H 139 8.560 7.887 0.673 1 1 1391 . 18 1 1 A 139 139 SER HA H 139 5.800 4.193 1.607 1 1 1394 . 18 1 1 A 139 139 SER C C 139 175.750 173.634 2.116 1 1 1395 . 18 1 1 A 139 139 SER CA C 139 56.020 59.135 -3.115 1 1 1396 . 18 1 1 A 139 139 SER CB C 139 65.320 62.336 2.984 1 1 1397 . 18 1 1 A 139 139 SER N N 139 112.360 115.419 -3.059 1 1 1398 . 18 1 1 A 140 140 SER H H 140 9.900 8.112 1.788 1 1 1399 . 18 1 1 A 140 140 SER HA H 140 5.360 5.333 0.027 1 1 1402 . 18 1 1 A 140 140 SER C C 140 172.620 174.040 -1.420 1 1 1403 . 18 1 1 A 140 140 SER CA C 140 57.400 56.242 1.158 1 1 1404 . 18 1 1 A 140 140 SER CB C 140 66.550 66.080 0.470 1 1 1405 . 18 1 1 A 140 140 SER N N 140 119.130 119.432 -0.302 1 1 1406 . 18 1 1 A 141 141 VAL H H 141 9.030 8.710 0.320 1 1 1407 . 18 1 1 A 141 141 VAL HA H 141 5.520 5.033 0.487 1 1 1415 . 18 1 1 A 141 141 VAL C C 141 174.750 174.628 0.122 1 1 1416 . 18 1 1 A 141 141 VAL CA C 141 58.310 59.938 -1.628 1 1 1417 . 18 1 1 A 141 141 VAL CB C 141 35.030 35.655 -0.625 1 1 1420 . 18 1 1 A 141 141 VAL N N 141 111.410 114.805 -3.395 1 1 1421 . 18 1 1 A 142 142 GLY H H 142 8.790 8.883 -0.093 1 1 1422 . 18 1 1 A 142 142 GLY HA2 H 142 3.600 3.947 -0.347 1 1 1423 . 18 1 1 A 142 142 GLY HA3 H 142 5.310 3.962 1.348 1 1 1424 . 18 1 1 A 142 142 GLY C C 142 174.180 173.157 1.023 1 1 1425 . 18 1 1 A 142 142 GLY CA C 142 44.110 46.805 -2.695 1 1 1426 . 18 1 1 A 142 142 GLY N N 142 109.330 111.062 -1.732 1 1 1427 . 18 1 1 A 143 143 ASP H H 143 8.840 8.503 0.337 1 1 1428 . 18 1 1 A 143 143 ASP HA H 143 5.790 4.959 0.831 1 1 1431 . 18 1 1 A 143 143 ASP C C 143 178.860 177.836 1.024 1 1 1432 . 18 1 1 A 143 143 ASP CA C 143 53.040 54.947 -1.907 1 1 1433 . 18 1 1 A 143 143 ASP CB C 143 43.660 42.767 0.893 1 1 1434 . 18 1 1 A 143 143 ASP N N 143 125.390 125.876 -0.486 1 1 1435 . 18 1 1 A 144 144 GLY H H 144 9.150 8.604 0.546 1 1 1436 . 18 1 1 A 144 144 GLY HA2 H 144 3.450 3.166 0.284 1 1 1437 . 18 1 1 A 144 144 GLY HA3 H 144 3.720 3.349 0.371 1 1 1438 . 18 1 1 A 144 144 GLY C C 144 174.770 175.206 -0.436 1 1 1439 . 18 1 1 A 144 144 GLY CA C 144 46.930 47.236 -0.306 1 1 1440 . 18 1 1 A 144 144 GLY N N 144 106.470 111.125 -4.655 1 1 1441 . 18 1 1 A 145 145 GLU H H 145 8.470 8.270 0.200 1 1 1442 . 18 1 1 A 145 145 GLU HA H 145 4.460 4.181 0.279 1 1 1447 . 18 1 1 A 145 145 GLU C C 145 176.520 176.389 0.131 1 1 1448 . 18 1 1 A 145 145 GLU CA C 145 55.330 56.895 -1.565 1 1 1449 . 18 1 1 A 145 145 GLU CB C 145 30.620 29.936 0.684 1 1 1451 . 18 1 1 A 145 145 GLU N N 145 119.170 120.632 -1.462 1 1 1452 . 18 1 1 A 146 146 GLY H H 146 7.950 8.167 -0.217 1 1 1453 . 18 1 1 A 146 146 GLY HA2 H 146 3.630 4.002 -0.372 1 1 1454 . 18 1 1 A 146 146 GLY HA3 H 146 4.130 4.014 0.116 1 1 1455 . 18 1 1 A 146 146 GLY C C 146 174.350 174.511 -0.161 1 1 1456 . 18 1 1 A 146 146 GLY CA C 146 45.330 44.982 0.348 1 1 1457 . 18 1 1 A 146 146 GLY N N 146 108.130 107.034 1.096 1 1 1458 . 18 1 1 A 147 147 LEU H H 147 8.440 8.044 0.396 1 1 1459 . 18 1 1 A 147 147 LEU HA H 147 4.340 4.621 -0.281 1 1 1469 . 18 1 1 A 147 147 LEU C C 147 175.950 175.598 0.352 1 1 1470 . 18 1 1 A 147 147 LEU CA C 147 54.860 53.741 1.119 1 1 1471 . 18 1 1 A 147 147 LEU CB C 147 41.590 43.065 -1.475 1 1 1475 . 18 1 1 A 147 147 LEU N N 147 124.000 121.836 2.164 1 1 1476 . 18 1 1 A 148 148 VAL H H 148 7.780 8.707 -0.927 1 1 1477 . 18 1 1 A 148 148 VAL HA H 148 4.830 5.356 -0.526 1 1 1485 . 18 1 1 A 148 148 VAL C C 148 175.740 173.586 2.154 1 1 1486 . 18 1 1 A 148 148 VAL CA C 148 61.140 59.901 1.239 1 1 1487 . 18 1 1 A 148 148 VAL CB C 148 33.640 34.370 -0.730 1 1 1490 . 18 1 1 A 148 148 VAL N N 148 120.440 120.426 0.014 1 1 1491 . 18 1 1 A 149 149 HIS H H 149 9.170 9.074 0.096 1 1 1492 . 18 1 1 A 149 149 HIS HA H 149 4.950 4.895 0.055 1 1 1496 . 18 1 1 A 149 149 HIS C C 149 174.780 174.599 0.181 1 1 1497 . 18 1 1 A 149 149 HIS CA C 149 53.900 54.829 -0.929 1 1 1498 . 18 1 1 A 149 149 HIS CB C 149 32.200 29.036 3.164 1 1 1499 . 18 1 1 A 149 149 HIS N N 149 124.700 128.521 -3.821 1 1 1500 . 18 1 1 A 150 150 GLU H H 150 9.060 8.669 0.391 1 1 1501 . 18 1 1 A 150 150 GLU HA H 150 4.420 4.271 0.149 1 1 1506 . 18 1 1 A 150 150 GLU C C 150 176.520 175.986 0.534 1 1 1507 . 18 1 1 A 150 150 GLU CA C 150 57.630 57.402 0.228 1 1 1508 . 18 1 1 A 150 150 GLU CB C 150 30.370 30.384 -0.014 1 1 1510 . 18 1 1 A 150 150 GLU N N 150 125.540 125.146 0.394 1 1 1511 . 18 1 1 A 151 151 ILE H H 151 8.150 7.877 0.273 1 1 1512 . 18 1 1 A 151 151 ILE HA H 151 4.780 4.475 0.305 1 1 1522 . 18 1 1 A 151 151 ILE C C 151 174.570 176.285 -1.715 1 1 1523 . 18 1 1 A 151 151 ILE CA C 151 59.390 59.605 -0.215 1 1 1524 . 18 1 1 A 151 151 ILE CB C 151 42.040 40.098 1.942 1 1 1528 . 18 1 1 A 151 151 ILE N N 151 115.880 123.232 -7.352 1 1 1529 . 18 1 1 A 152 152 ALA H H 152 8.010 8.848 -0.838 1 1 1530 . 18 1 1 A 152 152 ALA HA H 152 4.310 4.399 -0.089 1 1 1534 . 18 1 1 A 152 152 ALA C C 152 177.500 176.686 0.814 1 1 1535 . 18 1 1 A 152 152 ALA CA C 152 53.680 51.720 1.960 1 1 1536 . 18 1 1 A 152 152 ALA CB C 152 20.050 19.658 0.392 1 1 1537 . 18 1 1 A 152 152 ALA N N 152 126.640 124.693 1.947 1 1 1538 . 18 1 1 A 153 153 GLY H H 153 8.340 8.325 0.015 1 1 1539 . 18 1 1 A 153 153 GLY HA2 H 153 4.050 4.310 -0.260 1 1 1540 . 18 1 1 A 153 153 GLY HA3 H 153 4.140 4.310 -0.170 1 1 1541 . 18 1 1 A 153 153 GLY C C 153 173.140 171.701 1.439 1 1 1542 . 18 1 1 A 153 153 GLY CA C 153 44.130 45.710 -1.580 1 1 1543 . 18 1 1 A 153 153 GLY N N 153 107.490 105.246 2.244 1 1 1544 . 18 1 1 A 154 154 THR H H 154 7.380 7.986 -0.606 1 1 1545 . 18 1 1 A 154 154 THR HA H 154 4.700 5.019 -0.319 1 1 1550 . 18 1 1 A 154 154 THR C C 154 171.120 173.784 -2.664 1 1 1551 . 18 1 1 A 154 154 THR CA C 154 60.830 60.911 -0.081 1 1 1552 . 18 1 1 A 154 154 THR CB C 154 68.850 72.760 -3.910 1 1 1554 . 18 1 1 A 154 154 THR N N 154 109.340 114.110 -4.770 1 1 1555 . 18 1 1 A 155 155 GLU H H 155 8.020 8.713 -0.693 1 1 1556 . 18 1 1 A 155 155 GLU HA H 155 5.370 5.514 -0.144 1 1 1561 . 18 1 1 A 155 155 GLU C C 155 174.240 174.136 0.104 1 1 1562 . 18 1 1 A 155 155 GLU CA C 155 54.830 53.974 0.856 1 1 1563 . 18 1 1 A 155 155 GLU CB C 155 33.620 33.160 0.460 1 1 1565 . 18 1 1 A 155 155 GLU N N 155 118.690 122.330 -3.640 1 1 1566 . 18 1 1 A 156 156 LYS H H 156 9.230 9.006 0.224 1 1 1567 . 18 1 1 A 156 156 LYS HA H 156 4.650 4.865 -0.215 1 1 1576 . 18 1 1 A 156 156 LYS C C 156 174.000 174.546 -0.546 1 1 1577 . 18 1 1 A 156 156 LYS CA C 156 55.840 55.217 0.623 1 1 1578 . 18 1 1 A 156 156 LYS CB C 156 37.550 36.503 1.047 1 1 1582 . 18 1 1 A 156 156 LYS N N 156 121.940 121.187 0.753 1 1 1583 . 18 1 1 A 157 157 THR H H 157 8.160 8.644 -0.484 1 1 1584 . 18 1 1 A 157 157 THR HA H 157 5.440 5.147 0.293 1 1 1589 . 18 1 1 A 157 157 THR C C 157 174.360 173.630 0.730 1 1 1590 . 18 1 1 A 157 157 THR CA C 157 60.410 60.710 -0.300 1 1 1591 . 18 1 1 A 157 157 THR CB C 157 71.500 71.170 0.330 1 1 1593 . 18 1 1 A 157 157 THR N N 157 113.240 112.911 0.329 1 1 1594 . 18 1 1 A 158 158 VAL H H 158 9.120 9.091 0.029 1 1 1595 . 18 1 1 A 158 158 VAL HA H 158 4.580 4.973 -0.393 1 1 1603 . 18 1 1 A 158 158 VAL C C 158 172.800 174.674 -1.874 1 1 1604 . 18 1 1 A 158 158 VAL CA C 158 59.980 60.259 -0.279 1 1 1605 . 18 1 1 A 158 158 VAL CB C 158 36.290 34.266 2.024 1 1 1608 . 18 1 1 A 158 158 VAL N N 158 121.710 122.255 -0.545 1 1 1609 . 18 1 1 A 159 159 ASN H H 159 8.240 8.476 -0.236 1 1 1610 . 18 1 1 A 159 159 ASN HA H 159 5.420 5.056 0.364 1 1 1615 . 18 1 1 A 159 159 ASN C C 159 173.800 174.429 -0.629 1 1 1616 . 18 1 1 A 159 159 ASN CA C 159 51.740 52.779 -1.039 1 1 1617 . 18 1 1 A 159 159 ASN CB C 159 40.380 39.372 1.008 1 1 1618 . 18 1 1 A 159 159 ASN N N 159 122.730 124.656 -1.926 1 1 1620 . 18 1 1 A 160 160 ILE H H 160 9.160 8.620 0.540 1 1 1621 . 18 1 1 A 160 160 ILE HA H 160 5.130 5.057 0.073 1 1 1631 . 18 1 1 A 160 160 ILE C C 160 177.320 175.625 1.695 1 1 1632 . 18 1 1 A 160 160 ILE CA C 160 60.640 60.815 -0.175 1 1 1633 . 18 1 1 A 160 160 ILE CB C 160 38.520 37.793 0.727 1 1 1637 . 18 1 1 A 160 160 ILE N N 160 123.690 125.434 -1.744 1 1 1638 . 18 1 1 A 161 161 ILE H H 161 8.780 9.549 -0.769 1 1 1639 . 18 1 1 A 161 161 ILE HA H 161 4.590 4.539 0.051 1 1 1649 . 18 1 1 A 161 161 ILE C C 161 174.960 175.820 -0.860 1 1 1650 . 18 1 1 A 161 161 ILE CA C 161 59.320 60.341 -1.021 1 1 1651 . 18 1 1 A 161 161 ILE CB C 161 41.030 39.501 1.529 1 1 1655 . 18 1 1 A 161 161 ILE N N 161 122.490 129.380 -6.890 1 1 1656 . 18 1 1 A 162 162 GLU H H 162 8.620 8.626 -0.006 1 1 1657 . 18 1 1 A 162 162 GLU HA H 162 4.290 4.282 0.008 1 1 1662 . 18 1 1 A 162 162 GLU C C 162 176.660 176.680 -0.020 1 1 1663 . 18 1 1 A 162 162 GLU CA C 162 56.470 57.870 -1.400 1 1 1664 . 18 1 1 A 162 162 GLU CB C 162 31.150 30.448 0.702 1 1 1666 . 18 1 1 A 162 162 GLU N N 162 120.520 127.013 -6.493 1 1 1667 . 18 1 1 A 163 163 GLY H H 163 8.480 8.356 0.124 1 1 1668 . 18 1 1 A 163 163 GLY HA2 H 163 3.910 4.198 -0.288 1 1 1669 . 18 1 1 A 163 163 GLY HA3 H 163 4.150 4.199 -0.049 1 1 1670 . 18 1 1 A 163 163 GLY C C 163 174.000 172.059 1.941 1 1 1671 . 18 1 1 A 163 163 GLY CA C 163 45.270 46.255 -0.985 1 1 1672 . 18 1 1 A 163 163 GLY N N 163 110.210 110.117 0.093 1 1 1673 . 18 1 1 A 164 164 THR H H 164 8.170 8.337 -0.167 1 1 1674 . 18 1 1 A 164 164 THR HA H 164 4.410 4.332 0.078 1 1 1679 . 18 1 1 A 164 164 THR C C 164 174.100 174.449 -0.349 1 1 1680 . 18 1 1 A 164 164 THR CA C 164 61.620 62.378 -0.758 1 1 1681 . 18 1 1 A 164 164 THR CB C 164 70.060 69.650 0.410 1 1 1683 . 18 1 1 A 164 164 THR N N 164 113.480 118.645 -5.165 1 1 1 . 19 1 1 A 13 13 GLY H H 13 8.350 8.556 -0.206 1 1 2 . 19 1 1 A 13 13 GLY HA2 H 13 3.920 4.190 -0.270 1 1 3 . 19 1 1 A 13 13 GLY HA3 H 13 3.920 4.191 -0.271 1 1 4 . 19 1 1 A 13 13 GLY CA C 13 45.290 45.755 -0.465 1 1 5 . 19 1 1 A 13 13 GLY N N 13 110.450 109.571 0.879 1 1 6 . 19 1 1 A 14 14 LEU H H 14 8.050 7.708 0.342 1 1 7 . 19 1 1 A 14 14 LEU N N 14 121.500 120.805 0.695 1 1 8 . 19 1 1 A 15 15 VAL H H 15 8.070 8.503 -0.433 1 1 9 . 19 1 1 A 15 15 VAL N N 15 122.390 119.069 3.321 1 1 10 . 19 1 1 A 16 16 PRO HA H 16 4.360 4.313 0.047 1 1 17 . 19 1 1 A 16 16 PRO CA C 16 62.770 65.404 -2.634 1 1 18 . 19 1 1 A 16 16 PRO CB C 16 32.020 31.714 0.306 1 1 21 . 19 1 1 A 21 21 MET H H 21 8.180 8.964 -0.784 1 1 22 . 19 1 1 A 21 21 MET N N 21 121.310 120.860 0.450 1 1 23 . 19 1 1 A 22 22 ALA H H 22 8.290 7.770 0.520 1 1 24 . 19 1 1 A 22 22 ALA N N 22 124.800 123.869 0.931 1 1 25 . 19 1 1 A 23 23 SER H H 23 8.210 8.658 -0.448 1 1 26 . 19 1 1 A 23 23 SER N N 23 114.830 114.189 0.641 1 1 27 . 19 1 1 A 24 24 LYS H H 24 8.250 8.924 -0.674 1 1 28 . 19 1 1 A 24 24 LYS N N 24 122.980 123.297 -0.317 1 1 29 . 19 1 1 A 25 25 LEU H H 25 8.140 7.923 0.217 1 1 30 . 19 1 1 A 25 25 LEU HA H 25 4.290 4.778 -0.488 1 1 40 . 19 1 1 A 25 25 LEU C C 25 177.410 175.565 1.845 1 1 41 . 19 1 1 A 25 25 LEU CA C 25 55.430 54.093 1.337 1 1 42 . 19 1 1 A 25 25 LEU CB C 25 42.350 45.212 -2.862 1 1 46 . 19 1 1 A 25 25 LEU N N 25 122.580 119.891 2.689 1 1 47 . 19 1 1 A 26 26 LYS H H 26 8.200 8.770 -0.570 1 1 48 . 19 1 1 A 26 26 LYS HA H 26 4.260 4.488 -0.228 1 1 57 . 19 1 1 A 26 26 LYS C C 26 176.520 174.919 1.601 1 1 58 . 19 1 1 A 26 26 LYS CA C 26 56.700 57.757 -1.057 1 1 59 . 19 1 1 A 26 26 LYS CB C 26 33.060 35.074 -2.014 1 1 63 . 19 1 1 A 26 26 LYS N N 26 121.800 128.403 -6.603 1 1 64 . 19 1 1 A 27 27 GLU H H 27 8.380 7.750 0.630 1 1 65 . 19 1 1 A 27 27 GLU HA H 27 4.240 4.786 -0.546 1 1 70 . 19 1 1 A 27 27 GLU C C 27 176.130 174.881 1.249 1 1 71 . 19 1 1 A 27 27 GLU CA C 27 56.700 54.559 2.141 1 1 72 . 19 1 1 A 27 27 GLU CB C 27 30.370 33.239 -2.869 1 1 74 . 19 1 1 A 27 27 GLU N N 27 121.700 116.882 4.818 1 1 75 . 19 1 1 A 28 28 ALA H H 28 8.230 8.520 -0.290 1 1 76 . 19 1 1 A 28 28 ALA HA H 28 4.280 4.998 -0.718 1 1 80 . 19 1 1 A 28 28 ALA C C 28 177.090 175.543 1.547 1 1 81 . 19 1 1 A 28 28 ALA CA C 28 52.530 51.329 1.201 1 1 82 . 19 1 1 A 28 28 ALA CB C 28 19.360 24.229 -4.869 1 1 83 . 19 1 1 A 28 28 ALA N N 28 124.640 121.632 3.008 1 1 84 . 19 1 1 A 29 29 ALA H H 29 8.150 8.388 -0.238 1 1 85 . 19 1 1 A 29 29 ALA HA H 29 4.320 4.703 -0.383 1 1 89 . 19 1 1 A 29 29 ALA C C 29 177.120 175.913 1.207 1 1 90 . 19 1 1 A 29 29 ALA CA C 29 52.040 51.445 0.595 1 1 91 . 19 1 1 A 29 29 ALA CB C 29 19.430 18.826 0.604 1 1 92 . 19 1 1 A 29 29 ALA N N 29 123.430 119.859 3.571 1 1 93 . 19 1 1 A 30 30 GLU H H 30 8.310 7.813 0.497 1 1 94 . 19 1 1 A 30 30 GLU HA H 30 4.220 4.510 -0.290 1 1 99 . 19 1 1 A 30 30 GLU C C 30 176.310 176.447 -0.137 1 1 100 . 19 1 1 A 30 30 GLU CA C 30 56.630 56.273 0.357 1 1 101 . 19 1 1 A 30 30 GLU CB C 30 30.320 30.001 0.319 1 1 103 . 19 1 1 A 30 30 GLU N N 30 120.630 117.790 2.840 1 1 104 . 19 1 1 A 31 31 VAL H H 31 8.630 8.729 -0.099 1 1 105 . 19 1 1 A 31 31 VAL HA H 31 4.430 4.618 -0.188 1 1 113 . 19 1 1 A 31 31 VAL C C 31 176.510 176.734 -0.224 1 1 114 . 19 1 1 A 31 31 VAL CA C 31 62.360 63.234 -0.874 1 1 115 . 19 1 1 A 31 31 VAL CB C 31 32.370 31.697 0.673 1 1 118 . 19 1 1 A 31 31 VAL N N 31 127.110 123.725 3.385 1 1 119 . 19 1 1 A 32 32 THR H H 32 7.640 8.715 -1.075 1 1 120 . 19 1 1 A 32 32 THR HA H 32 4.870 3.911 0.959 1 1 125 . 19 1 1 A 32 32 THR C C 32 172.220 174.733 -2.513 1 1 126 . 19 1 1 A 32 32 THR CA C 32 59.510 65.115 -5.605 1 1 127 . 19 1 1 A 32 32 THR CB C 32 71.630 69.603 2.027 1 1 129 . 19 1 1 A 32 32 THR N N 32 118.860 121.116 -2.256 1 1 130 . 19 1 1 A 33 33 GLY H H 33 8.350 8.015 0.335 1 1 131 . 19 1 1 A 33 33 GLY HA2 H 33 4.160 3.976 0.184 1 1 132 . 19 1 1 A 33 33 GLY HA3 H 33 4.250 3.979 0.271 1 1 133 . 19 1 1 A 33 33 GLY C C 33 172.820 173.169 -0.349 1 1 134 . 19 1 1 A 33 33 GLY CA C 33 46.680 45.970 0.710 1 1 135 . 19 1 1 A 33 33 GLY N N 33 106.720 108.910 -2.190 1 1 136 . 19 1 1 A 34 34 SER H H 34 8.810 8.059 0.751 1 1 137 . 19 1 1 A 34 34 SER HA H 34 5.390 4.916 0.474 1 1 140 . 19 1 1 A 34 34 SER C C 34 173.780 172.884 0.896 1 1 141 . 19 1 1 A 34 34 SER CA C 34 57.380 57.536 -0.156 1 1 142 . 19 1 1 A 34 34 SER CB C 34 65.730 66.169 -0.439 1 1 143 . 19 1 1 A 34 34 SER N N 34 112.690 119.308 -6.618 1 1 144 . 19 1 1 A 35 35 VAL H H 35 8.470 8.773 -0.303 1 1 145 . 19 1 1 A 35 35 VAL HA H 35 4.120 4.800 -0.680 1 1 153 . 19 1 1 A 35 35 VAL C C 35 174.750 174.295 0.455 1 1 154 . 19 1 1 A 35 35 VAL CA C 35 62.310 60.882 1.428 1 1 155 . 19 1 1 A 35 35 VAL CB C 35 34.550 33.237 1.313 1 1 158 . 19 1 1 A 35 35 VAL N N 35 123.150 122.521 0.629 1 1 159 . 19 1 1 A 36 36 SER H H 36 8.240 8.884 -0.644 1 1 160 . 19 1 1 A 36 36 SER HA H 36 4.690 4.842 -0.152 1 1 163 . 19 1 1 A 36 36 SER C C 36 171.860 173.521 -1.661 1 1 164 . 19 1 1 A 36 36 SER CA C 36 56.020 56.437 -0.417 1 1 165 . 19 1 1 A 36 36 SER CB C 36 66.050 64.188 1.862 1 1 166 . 19 1 1 A 36 36 SER N N 36 118.760 119.503 -0.743 1 1 167 . 19 1 1 A 37 37 LEU H H 37 8.310 9.107 -0.797 1 1 168 . 19 1 1 A 37 37 LEU HA H 37 4.870 4.931 -0.061 1 1 178 . 19 1 1 A 37 37 LEU C C 37 174.190 175.642 -1.452 1 1 179 . 19 1 1 A 37 37 LEU CA C 37 53.870 53.712 0.158 1 1 180 . 19 1 1 A 37 37 LEU CB C 37 47.000 43.424 3.576 1 1 184 . 19 1 1 A 37 37 LEU N N 37 124.790 128.837 -4.047 1 1 185 . 19 1 1 A 38 38 GLU H H 38 9.270 8.811 0.459 1 1 186 . 19 1 1 A 38 38 GLU HA H 38 4.650 5.296 -0.646 1 1 191 . 19 1 1 A 38 38 GLU C C 38 173.970 174.953 -0.983 1 1 192 . 19 1 1 A 38 38 GLU CA C 38 54.410 55.162 -0.752 1 1 193 . 19 1 1 A 38 38 GLU CB C 38 32.460 32.838 -0.378 1 1 195 . 19 1 1 A 38 38 GLU N N 38 126.550 125.716 0.834 1 1 196 . 19 1 1 A 39 39 ALA H H 39 8.120 8.384 -0.264 1 1 197 . 19 1 1 A 39 39 ALA HA H 39 4.600 4.723 -0.123 1 1 201 . 19 1 1 A 39 39 ALA C C 39 175.930 177.189 -1.259 1 1 202 . 19 1 1 A 39 39 ALA CA C 39 51.570 51.455 0.115 1 1 203 . 19 1 1 A 39 39 ALA CB C 39 21.780 22.401 -0.621 1 1 204 . 19 1 1 A 39 39 ALA N N 39 124.410 126.245 -1.835 1 1 205 . 19 1 1 A 40 40 LEU H H 40 7.860 8.852 -0.992 1 1 206 . 19 1 1 A 40 40 LEU HA H 40 4.230 4.000 0.230 1 1 216 . 19 1 1 A 40 40 LEU C C 40 175.940 176.706 -0.766 1 1 217 . 19 1 1 A 40 40 LEU CA C 40 55.360 57.968 -2.608 1 1 218 . 19 1 1 A 40 40 LEU CB C 40 42.990 42.831 0.159 1 1 222 . 19 1 1 A 40 40 LEU N N 40 120.640 121.673 -1.033 1 1 223 . 19 1 1 A 41 41 GLU H H 41 8.210 7.884 0.326 1 1 224 . 19 1 1 A 41 41 GLU HA H 41 4.240 4.056 0.184 1 1 229 . 19 1 1 A 41 41 GLU C C 41 176.920 174.787 2.133 1 1 230 . 19 1 1 A 41 41 GLU CA C 41 58.090 57.669 0.421 1 1 231 . 19 1 1 A 41 41 GLU CB C 41 30.530 27.075 3.455 1 1 233 . 19 1 1 A 41 41 GLU N N 41 114.680 117.615 -2.935 1 1 234 . 19 1 1 A 42 42 GLU H H 42 7.490 7.732 -0.242 1 1 235 . 19 1 1 A 42 42 GLU HA H 42 5.680 4.813 0.867 1 1 240 . 19 1 1 A 42 42 GLU C C 42 173.790 174.162 -0.372 1 1 241 . 19 1 1 A 42 42 GLU CA C 42 54.360 56.203 -1.843 1 1 242 . 19 1 1 A 42 42 GLU CB C 42 33.850 33.434 0.416 1 1 244 . 19 1 1 A 42 42 GLU N N 42 116.670 118.227 -1.557 1 1 245 . 19 1 1 A 43 43 VAL H H 43 8.550 8.966 -0.416 1 1 246 . 19 1 1 A 43 43 VAL HA H 43 4.550 4.651 -0.101 1 1 254 . 19 1 1 A 43 43 VAL C C 43 172.220 173.763 -1.543 1 1 255 . 19 1 1 A 43 43 VAL CA C 43 59.470 60.538 -1.068 1 1 256 . 19 1 1 A 43 43 VAL CB C 43 35.470 34.605 0.865 1 1 259 . 19 1 1 A 43 43 VAL N N 43 120.030 125.131 -5.101 1 1 260 . 19 1 1 A 44 44 GLN H H 44 8.470 8.615 -0.145 1 1 261 . 19 1 1 A 44 44 GLN HA H 44 4.890 4.661 0.229 1 1 268 . 19 1 1 A 44 44 GLN C C 44 176.130 175.985 0.145 1 1 269 . 19 1 1 A 44 44 GLN CA C 44 54.360 55.663 -1.303 1 1 270 . 19 1 1 A 44 44 GLN CB C 44 30.610 28.975 1.635 1 1 272 . 19 1 1 A 44 44 GLN N N 44 124.690 130.165 -5.475 1 1 274 . 19 1 1 A 45 45 VAL H H 45 8.130 8.188 -0.058 1 1 275 . 19 1 1 A 45 45 VAL HA H 45 3.030 3.908 -0.878 1 1 283 . 19 1 1 A 45 45 VAL C C 45 176.710 177.252 -0.542 1 1 284 . 19 1 1 A 45 45 VAL CA C 45 65.810 64.736 1.074 1 1 285 . 19 1 1 A 45 45 VAL CB C 45 31.960 31.447 0.513 1 1 288 . 19 1 1 A 45 45 VAL N N 45 120.450 126.364 -5.914 1 1 289 . 19 1 1 A 46 46 GLY H H 46 8.950 10.004 -1.054 1 1 290 . 19 1 1 A 46 46 GLY HA2 H 46 3.590 4.005 -0.415 1 1 291 . 19 1 1 A 46 46 GLY HA3 H 46 4.410 4.009 0.401 1 1 292 . 19 1 1 A 46 46 GLY C C 46 174.390 173.584 0.806 1 1 293 . 19 1 1 A 46 46 GLY CA C 46 44.730 44.894 -0.164 1 1 294 . 19 1 1 A 46 46 GLY N N 46 116.490 115.120 1.370 1 1 295 . 19 1 1 A 47 47 GLU H H 47 8.260 7.861 0.399 1 1 296 . 19 1 1 A 47 47 GLU HA H 47 4.460 4.702 -0.242 1 1 301 . 19 1 1 A 47 47 GLU C C 47 174.780 175.461 -0.681 1 1 302 . 19 1 1 A 47 47 GLU CA C 47 54.830 54.977 -0.147 1 1 303 . 19 1 1 A 47 47 GLU CB C 47 31.140 32.296 -1.156 1 1 305 . 19 1 1 A 47 47 GLU N N 47 120.520 121.426 -0.906 1 1 306 . 19 1 1 A 48 48 ASN H H 48 8.440 9.018 -0.578 1 1 307 . 19 1 1 A 48 48 ASN HA H 48 5.380 5.625 -0.245 1 1 312 . 19 1 1 A 48 48 ASN C C 48 174.770 174.448 0.322 1 1 313 . 19 1 1 A 48 48 ASN CA C 48 51.570 51.365 0.205 1 1 314 . 19 1 1 A 48 48 ASN CB C 48 39.010 42.191 -3.181 1 1 315 . 19 1 1 A 48 48 ASN N N 48 117.180 119.671 -2.491 1 1 317 . 19 1 1 A 49 49 LEU H H 49 9.810 8.827 0.983 1 1 318 . 19 1 1 A 49 49 LEU HA H 49 4.510 5.117 -0.607 1 1 328 . 19 1 1 A 49 49 LEU C C 49 174.560 175.492 -0.932 1 1 329 . 19 1 1 A 49 49 LEU CA C 49 53.460 52.629 0.831 1 1 330 . 19 1 1 A 49 49 LEU CB C 49 45.520 44.254 1.266 1 1 333 . 19 1 1 A 49 49 LEU N N 49 125.620 119.209 6.411 1 1 334 . 19 1 1 A 50 50 GLU H H 50 8.750 8.755 -0.005 1 1 335 . 19 1 1 A 50 50 GLU HA H 50 4.360 4.833 -0.473 1 1 340 . 19 1 1 A 50 50 GLU C C 50 175.340 174.696 0.644 1 1 341 . 19 1 1 A 50 50 GLU CA C 50 55.550 55.654 -0.104 1 1 342 . 19 1 1 A 50 50 GLU CB C 50 29.890 31.712 -1.822 1 1 344 . 19 1 1 A 50 50 GLU N N 50 125.420 119.672 5.748 1 1 345 . 19 1 1 A 51 51 VAL H H 51 9.230 8.961 0.269 1 1 346 . 19 1 1 A 51 51 VAL HA H 51 4.190 5.042 -0.852 1 1 354 . 19 1 1 A 51 51 VAL C C 51 175.310 174.819 0.491 1 1 355 . 19 1 1 A 51 51 VAL CA C 51 62.520 61.207 1.313 1 1 356 . 19 1 1 A 51 51 VAL CB C 51 31.470 33.501 -2.031 1 1 359 . 19 1 1 A 51 51 VAL N N 51 129.810 127.695 2.115 1 1 360 . 19 1 1 A 52 52 GLY H H 52 9.410 9.016 0.394 1 1 361 . 19 1 1 A 52 52 GLY HA2 H 52 3.460 3.957 -0.497 1 1 362 . 19 1 1 A 52 52 GLY HA3 H 52 4.680 3.993 0.687 1 1 363 . 19 1 1 A 52 52 GLY C C 52 173.000 173.089 -0.089 1 1 364 . 19 1 1 A 52 52 GLY CA C 52 46.470 46.919 -0.449 1 1 365 . 19 1 1 A 52 52 GLY N N 52 116.600 116.749 -0.149 1 1 366 . 19 1 1 A 53 53 VAL H H 53 9.130 8.535 0.595 1 1 367 . 19 1 1 A 53 53 VAL HA H 53 4.840 4.981 -0.141 1 1 375 . 19 1 1 A 53 53 VAL C C 53 175.470 175.633 -0.163 1 1 376 . 19 1 1 A 53 53 VAL CA C 53 61.350 61.444 -0.094 1 1 377 . 19 1 1 A 53 53 VAL CB C 53 34.300 31.711 2.589 1 1 380 . 19 1 1 A 53 53 VAL N N 53 129.050 125.694 3.356 1 1 381 . 19 1 1 A 54 54 GLY H H 54 8.420 8.358 0.062 1 1 382 . 19 1 1 A 54 54 GLY HA2 H 54 3.850 4.037 -0.187 1 1 383 . 19 1 1 A 54 54 GLY HA3 H 54 3.850 4.145 -0.295 1 1 384 . 19 1 1 A 54 54 GLY C C 54 173.310 173.054 0.256 1 1 385 . 19 1 1 A 54 54 GLY CA C 54 45.180 44.438 0.742 1 1 386 . 19 1 1 A 54 54 GLY N N 54 116.890 115.624 1.266 1 1 387 . 19 1 1 A 55 55 ILE H H 55 10.190 8.089 2.101 1 1 388 . 19 1 1 A 55 55 ILE HA H 55 4.010 4.693 -0.683 1 1 398 . 19 1 1 A 55 55 ILE C C 55 174.380 175.263 -0.883 1 1 399 . 19 1 1 A 55 55 ILE CA C 55 61.350 59.858 1.492 1 1 400 . 19 1 1 A 55 55 ILE CB C 55 40.840 39.971 0.869 1 1 404 . 19 1 1 A 55 55 ILE N N 55 129.330 121.681 7.649 1 1 405 . 19 1 1 A 56 56 ASP H H 56 8.810 9.697 -0.887 1 1 406 . 19 1 1 A 56 56 ASP HA H 56 4.440 4.705 -0.265 1 1 409 . 19 1 1 A 56 56 ASP C C 56 175.530 175.350 0.180 1 1 410 . 19 1 1 A 56 56 ASP CA C 56 56.460 55.295 1.165 1 1 411 . 19 1 1 A 56 56 ASP CB C 56 42.720 42.792 -0.072 1 1 412 . 19 1 1 A 56 56 ASP N N 56 128.310 127.685 0.625 1 1 413 . 19 1 1 A 57 57 GLU H H 57 7.270 7.844 -0.574 1 1 414 . 19 1 1 A 57 57 GLU HA H 57 4.290 4.811 -0.521 1 1 419 . 19 1 1 A 57 57 GLU C C 57 173.370 174.651 -1.281 1 1 420 . 19 1 1 A 57 57 GLU CA C 57 54.840 55.467 -0.627 1 1 421 . 19 1 1 A 57 57 GLU CB C 57 33.190 33.588 -0.398 1 1 423 . 19 1 1 A 57 57 GLU N N 57 112.810 115.900 -3.090 1 1 424 . 19 1 1 A 58 58 LEU H H 58 8.370 8.445 -0.075 1 1 425 . 19 1 1 A 58 58 LEU HA H 58 4.830 4.649 0.181 1 1 434 . 19 1 1 A 58 58 LEU C C 58 174.180 174.464 -0.284 1 1 435 . 19 1 1 A 58 58 LEU CA C 58 55.320 54.878 0.442 1 1 436 . 19 1 1 A 58 58 LEU CB C 58 44.300 43.271 1.029 1 1 439 . 19 1 1 A 58 58 LEU N N 58 123.130 124.981 -1.851 1 1 440 . 19 1 1 A 59 59 VAL H H 59 9.120 8.722 0.398 1 1 441 . 19 1 1 A 59 59 VAL HA H 59 4.240 4.881 -0.641 1 1 449 . 19 1 1 A 59 59 VAL C C 59 174.960 175.394 -0.434 1 1 450 . 19 1 1 A 59 59 VAL CA C 59 61.760 60.339 1.421 1 1 451 . 19 1 1 A 59 59 VAL CB C 59 33.760 33.190 0.570 1 1 454 . 19 1 1 A 59 59 VAL N N 59 127.930 122.427 5.503 1 1 455 . 19 1 1 A 60 60 ASN H H 60 8.770 8.493 0.277 1 1 456 . 19 1 1 A 60 60 ASN HA H 60 4.250 4.718 -0.468 1 1 461 . 19 1 1 A 60 60 ASN C C 60 172.810 173.733 -0.923 1 1 462 . 19 1 1 A 60 60 ASN CA C 60 54.830 54.736 0.094 1 1 463 . 19 1 1 A 60 60 ASN CB C 60 36.030 36.603 -0.573 1 1 464 . 19 1 1 A 60 60 ASN N N 60 115.500 120.047 -4.547 1 1 466 . 19 1 1 A 61 61 ALA H H 61 7.330 7.361 -0.031 1 1 467 . 19 1 1 A 61 61 ALA HA H 61 4.520 4.623 -0.103 1 1 471 . 19 1 1 A 61 61 ALA C C 61 174.580 175.095 -0.515 1 1 472 . 19 1 1 A 61 61 ALA CA C 61 51.560 51.133 0.427 1 1 473 . 19 1 1 A 61 61 ALA CB C 61 22.870 22.913 -0.043 1 1 474 . 19 1 1 A 61 61 ALA N N 61 115.640 118.807 -3.167 1 1 475 . 19 1 1 A 62 62 GLU H H 62 7.900 9.306 -1.406 1 1 476 . 19 1 1 A 62 62 GLU HA H 62 4.310 4.767 -0.457 1 1 481 . 19 1 1 A 62 62 GLU C C 62 173.790 175.338 -1.548 1 1 482 . 19 1 1 A 62 62 GLU CA C 62 55.080 54.858 0.222 1 1 483 . 19 1 1 A 62 62 GLU CB C 62 32.610 30.834 1.776 1 1 485 . 19 1 1 A 62 62 GLU N N 62 117.400 120.379 -2.979 1 1 486 . 19 1 1 A 63 63 ALA H H 63 8.910 8.718 0.192 1 1 487 . 19 1 1 A 63 63 ALA HA H 63 4.690 4.531 0.159 1 1 491 . 19 1 1 A 63 63 ALA C C 63 175.720 176.738 -1.018 1 1 492 . 19 1 1 A 63 63 ALA CA C 63 50.600 53.159 -2.559 1 1 493 . 19 1 1 A 63 63 ALA CB C 63 20.660 19.042 1.618 1 1 494 . 19 1 1 A 63 63 ALA N N 63 122.480 129.911 -7.431 1 1 495 . 19 1 1 A 64 64 PHE H H 64 9.220 9.419 -0.199 1 1 496 . 19 1 1 A 64 64 PHE HA H 64 4.320 4.717 -0.397 1 1 501 . 19 1 1 A 64 64 PHE C C 64 174.380 176.124 -1.744 1 1 502 . 19 1 1 A 64 64 PHE CA C 64 59.770 58.753 1.017 1 1 503 . 19 1 1 A 64 64 PHE CB C 64 40.830 41.203 -0.373 1 1 504 . 19 1 1 A 64 64 PHE N N 64 120.870 122.836 -1.966 1 1 505 . 19 1 1 A 65 65 ALA H H 65 8.150 7.897 0.253 1 1 506 . 19 1 1 A 65 65 ALA HA H 65 5.280 4.812 0.468 1 1 510 . 19 1 1 A 65 65 ALA C C 65 175.950 175.643 0.307 1 1 511 . 19 1 1 A 65 65 ALA CA C 65 51.120 51.351 -0.231 1 1 512 . 19 1 1 A 65 65 ALA CB C 65 22.850 21.396 1.454 1 1 513 . 19 1 1 A 65 65 ALA N N 65 122.350 120.244 2.106 1 1 514 . 19 1 1 A 66 66 TYR H H 66 9.260 9.268 -0.008 1 1 515 . 19 1 1 A 66 66 TYR HA H 66 5.710 4.942 0.768 1 1 520 . 19 1 1 A 66 66 TYR C C 66 175.690 174.303 1.387 1 1 521 . 19 1 1 A 66 66 TYR CA C 66 54.390 58.491 -4.101 1 1 522 . 19 1 1 A 66 66 TYR CB C 66 41.560 39.834 1.726 1 1 523 . 19 1 1 A 66 66 TYR N N 66 124.350 126.641 -2.291 1 1 524 . 19 1 1 A 67 67 ASP H H 67 9.070 8.418 0.652 1 1 525 . 19 1 1 A 67 67 ASP HA H 67 5.630 5.486 0.144 1 1 528 . 19 1 1 A 67 67 ASP C C 67 174.300 174.198 0.102 1 1 529 . 19 1 1 A 67 67 ASP CA C 67 51.590 53.203 -1.613 1 1 530 . 19 1 1 A 67 67 ASP CB C 67 44.380 43.187 1.193 1 1 531 . 19 1 1 A 67 67 ASP N N 67 130.490 126.306 4.184 1 1 532 . 19 1 1 A 68 68 PHE H H 68 8.670 8.104 0.566 1 1 533 . 19 1 1 A 68 68 PHE HA H 68 4.890 5.400 -0.510 1 1 538 . 19 1 1 A 68 68 PHE C C 68 172.220 173.219 -0.999 1 1 539 . 19 1 1 A 68 68 PHE CA C 68 57.360 55.048 2.312 1 1 540 . 19 1 1 A 68 68 PHE CB C 68 40.360 41.677 -1.317 1 1 541 . 19 1 1 A 68 68 PHE N N 68 118.200 119.028 -0.828 1 1 542 . 19 1 1 A 69 69 THR H H 69 8.390 8.558 -0.168 1 1 543 . 19 1 1 A 69 69 THR HA H 69 5.170 5.396 -0.226 1 1 548 . 19 1 1 A 69 69 THR C C 69 172.620 173.014 -0.394 1 1 549 . 19 1 1 A 69 69 THR CA C 69 61.370 61.585 -0.215 1 1 550 . 19 1 1 A 69 69 THR CB C 69 64.880 71.168 -6.288 1 1 552 . 19 1 1 A 69 69 THR N N 69 115.810 114.714 1.096 1 1 553 . 19 1 1 A 70 70 LEU H H 70 9.560 9.066 0.494 1 1 554 . 19 1 1 A 70 70 LEU HA H 70 5.270 5.182 0.088 1 1 564 . 19 1 1 A 70 70 LEU C C 70 173.800 174.943 -1.143 1 1 565 . 19 1 1 A 70 70 LEU CA C 70 53.460 54.345 -0.885 1 1 566 . 19 1 1 A 70 70 LEU CB C 70 45.040 44.490 0.550 1 1 570 . 19 1 1 A 70 70 LEU N N 70 129.220 130.505 -1.285 1 1 571 . 19 1 1 A 71 71 ASN H H 71 9.590 8.408 1.182 1 1 572 . 19 1 1 A 71 71 ASN HA H 71 5.880 5.608 0.272 1 1 577 . 19 1 1 A 71 71 ASN C C 71 177.970 174.432 3.538 1 1 578 . 19 1 1 A 71 71 ASN CA C 71 52.060 51.860 0.200 1 1 579 . 19 1 1 A 71 71 ASN CB C 71 41.020 42.258 -1.238 1 1 580 . 19 1 1 A 71 71 ASN N N 71 125.970 123.120 2.850 1 1 582 . 19 1 1 A 72 72 TYR H H 72 8.740 8.645 0.095 1 1 583 . 19 1 1 A 72 72 TYR HA H 72 5.110 5.343 -0.233 1 1 588 . 19 1 1 A 72 72 TYR C C 72 177.720 172.197 5.523 1 1 589 . 19 1 1 A 72 72 TYR CA C 72 55.310 55.566 -0.256 1 1 590 . 19 1 1 A 72 72 TYR CB C 72 41.510 40.976 0.534 1 1 591 . 19 1 1 A 72 72 TYR N N 72 119.640 119.119 0.521 1 1 592 . 19 1 1 A 73 73 ASP H H 73 9.780 9.013 0.767 1 1 593 . 19 1 1 A 73 73 ASP HA H 73 4.680 5.004 -0.324 1 1 596 . 19 1 1 A 73 73 ASP C C 73 177.290 177.152 0.138 1 1 597 . 19 1 1 A 73 73 ASP CA C 73 53.650 52.774 0.876 1 1 598 . 19 1 1 A 73 73 ASP CB C 73 40.900 42.094 -1.194 1 1 599 . 19 1 1 A 73 73 ASP N N 73 119.290 121.366 -2.076 1 1 600 . 19 1 1 A 74 74 GLU H H 74 9.430 9.094 0.336 1 1 601 . 19 1 1 A 74 74 GLU HA H 74 4.740 4.926 -0.186 1 1 606 . 19 1 1 A 74 74 GLU C C 74 176.320 177.817 -1.497 1 1 607 . 19 1 1 A 74 74 GLU CA C 74 57.410 57.943 -0.533 1 1 608 . 19 1 1 A 74 74 GLU CB C 74 29.490 29.765 -0.275 1 1 610 . 19 1 1 A 74 74 GLU N N 74 130.930 127.254 3.676 1 1 611 . 19 1 1 A 75 75 ASN H H 75 8.680 7.821 0.859 1 1 612 . 19 1 1 A 75 75 ASN HA H 75 4.600 4.763 -0.163 1 1 617 . 19 1 1 A 75 75 ASN C C 75 175.340 175.602 -0.262 1 1 618 . 19 1 1 A 75 75 ASN CA C 75 54.620 53.424 1.196 1 1 619 . 19 1 1 A 75 75 ASN CB C 75 38.770 39.278 -0.508 1 1 620 . 19 1 1 A 75 75 ASN N N 75 115.040 116.750 -1.710 1 1 622 . 19 1 1 A 76 76 ALA H H 76 7.740 8.022 -0.282 1 1 623 . 19 1 1 A 76 76 ALA HA H 76 4.310 4.376 -0.066 1 1 627 . 19 1 1 A 76 76 ALA C C 76 175.550 176.674 -1.124 1 1 628 . 19 1 1 A 76 76 ALA CA C 76 53.260 53.276 -0.016 1 1 629 . 19 1 1 A 76 76 ALA CB C 76 21.450 21.173 0.277 1 1 630 . 19 1 1 A 76 76 ALA N N 76 122.200 121.762 0.438 1 1 631 . 19 1 1 A 77 77 PHE H H 77 8.070 8.565 -0.495 1 1 632 . 19 1 1 A 77 77 PHE HA H 77 5.650 5.387 0.263 1 1 637 . 19 1 1 A 77 77 PHE C C 77 174.570 175.028 -0.458 1 1 638 . 19 1 1 A 77 77 PHE CA C 77 56.360 56.598 -0.238 1 1 639 . 19 1 1 A 77 77 PHE CB C 77 46.080 41.462 4.618 1 1 640 . 19 1 1 A 77 77 PHE N N 77 114.160 114.382 -0.222 1 1 641 . 19 1 1 A 78 78 GLU H H 78 8.800 8.461 0.339 1 1 642 . 19 1 1 A 78 78 GLU HA H 78 4.900 4.752 0.148 1 1 647 . 19 1 1 A 78 78 GLU C C 78 175.950 174.502 1.448 1 1 648 . 19 1 1 A 78 78 GLU CA C 78 53.670 55.430 -1.760 1 1 649 . 19 1 1 A 78 78 GLU CB C 78 33.600 33.467 0.133 1 1 651 . 19 1 1 A 78 78 GLU N N 78 117.590 120.922 -3.332 1 1 652 . 19 1 1 A 79 79 TYR H H 79 8.770 8.631 0.139 1 1 653 . 19 1 1 A 79 79 TYR HA H 79 4.250 4.158 0.092 1 1 658 . 19 1 1 A 79 79 TYR C C 79 174.580 174.895 -0.315 1 1 659 . 19 1 1 A 79 79 TYR CA C 79 59.250 59.457 -0.207 1 1 660 . 19 1 1 A 79 79 TYR CB C 79 38.310 39.190 -0.880 1 1 661 . 19 1 1 A 79 79 TYR N N 79 126.560 127.801 -1.241 1 1 662 . 19 1 1 A 80 80 VAL H H 80 8.220 8.315 -0.095 1 1 663 . 19 1 1 A 80 80 VAL HA H 80 3.690 3.859 -0.169 1 1 671 . 19 1 1 A 80 80 VAL C C 80 174.780 174.767 0.013 1 1 672 . 19 1 1 A 80 80 VAL CA C 80 64.400 62.844 1.556 1 1 673 . 19 1 1 A 80 80 VAL CB C 80 33.510 32.819 0.691 1 1 676 . 19 1 1 A 80 80 VAL N N 80 129.460 125.118 4.342 1 1 677 . 19 1 1 A 81 81 GLU H H 81 6.920 7.463 -0.543 1 1 678 . 19 1 1 A 81 81 GLU HA H 81 4.260 4.626 -0.366 1 1 683 . 19 1 1 A 81 81 GLU C C 81 171.840 175.359 -3.519 1 1 684 . 19 1 1 A 81 81 GLU CA C 81 55.310 55.239 0.071 1 1 685 . 19 1 1 A 81 81 GLU CB C 81 30.520 33.282 -2.762 1 1 687 . 19 1 1 A 81 81 GLU N N 81 112.430 117.073 -4.643 1 1 688 . 19 1 1 A 82 82 ALA H H 82 8.310 8.777 -0.467 1 1 689 . 19 1 1 A 82 82 ALA HA H 82 5.650 5.194 0.456 1 1 693 . 19 1 1 A 82 82 ALA C C 82 176.110 177.051 -0.941 1 1 694 . 19 1 1 A 82 82 ALA CA C 82 50.620 51.658 -1.038 1 1 695 . 19 1 1 A 82 82 ALA CB C 82 21.770 19.955 1.815 1 1 696 . 19 1 1 A 82 82 ALA N N 82 121.240 126.975 -5.735 1 1 697 . 19 1 1 A 83 83 ILE H H 83 9.150 9.275 -0.125 1 1 698 . 19 1 1 A 83 83 ILE HA H 83 4.600 4.899 -0.299 1 1 708 . 19 1 1 A 83 83 ILE C C 83 174.810 175.039 -0.229 1 1 709 . 19 1 1 A 83 83 ILE CA C 83 60.060 59.222 0.838 1 1 710 . 19 1 1 A 83 83 ILE CB C 83 42.440 41.922 0.518 1 1 714 . 19 1 1 A 83 83 ILE N N 83 119.720 120.334 -0.614 1 1 715 . 19 1 1 A 84 84 SER H H 84 8.350 8.909 -0.559 1 1 716 . 19 1 1 A 84 84 SER HA H 84 4.660 4.811 -0.151 1 1 719 . 19 1 1 A 84 84 SER C C 84 177.550 172.781 4.769 1 1 720 . 19 1 1 A 84 84 SER CA C 84 57.330 55.659 1.671 1 1 721 . 19 1 1 A 84 84 SER CB C 84 66.490 65.237 1.253 1 1 722 . 19 1 1 A 84 84 SER N N 84 116.740 119.046 -2.306 1 1 723 . 19 1 1 A 85 85 ASP H H 85 8.740 8.376 0.364 1 1 724 . 19 1 1 A 85 85 ASP HA H 85 4.820 4.953 -0.133 1 1 727 . 19 1 1 A 85 85 ASP C C 85 176.090 175.914 0.176 1 1 728 . 19 1 1 A 85 85 ASP CA C 85 53.480 53.452 0.028 1 1 729 . 19 1 1 A 85 85 ASP CB C 85 42.480 42.161 0.319 1 1 730 . 19 1 1 A 85 85 ASP N N 85 120.960 121.605 -0.645 1 1 731 . 19 1 1 A 86 86 ASP H H 86 8.380 8.816 -0.436 1 1 732 . 19 1 1 A 86 86 ASP HA H 86 4.450 4.873 -0.423 1 1 735 . 19 1 1 A 86 86 ASP C C 86 177.100 176.650 0.450 1 1 736 . 19 1 1 A 86 86 ASP CA C 86 56.240 54.114 2.126 1 1 737 . 19 1 1 A 86 86 ASP CB C 86 41.100 41.298 -0.198 1 1 738 . 19 1 1 A 86 86 ASP N N 86 117.710 119.944 -2.234 1 1 739 . 19 1 1 A 87 87 GLY H H 87 8.690 7.587 1.103 1 1 740 . 19 1 1 A 87 87 GLY HA2 H 87 3.870 4.091 -0.221 1 1 741 . 19 1 1 A 87 87 GLY HA3 H 87 4.090 4.100 -0.010 1 1 742 . 19 1 1 A 87 87 GLY C C 87 173.800 174.374 -0.574 1 1 743 . 19 1 1 A 87 87 GLY CA C 87 45.770 45.670 0.100 1 1 744 . 19 1 1 A 87 87 GLY N N 87 108.540 107.318 1.222 1 1 745 . 19 1 1 A 88 88 VAL H H 88 7.910 7.717 0.193 1 1 746 . 19 1 1 A 88 88 VAL HA H 88 4.780 4.241 0.539 1 1 754 . 19 1 1 A 88 88 VAL C C 88 173.970 175.311 -1.341 1 1 755 . 19 1 1 A 88 88 VAL CA C 88 60.900 62.221 -1.321 1 1 756 . 19 1 1 A 88 88 VAL CB C 88 35.460 32.936 2.524 1 1 759 . 19 1 1 A 88 88 VAL N N 88 119.790 120.608 -0.818 1 1 760 . 19 1 1 A 89 89 PHE H H 89 9.210 9.735 -0.525 1 1 761 . 19 1 1 A 89 89 PHE HA H 89 4.930 5.376 -0.446 1 1 766 . 19 1 1 A 89 89 PHE C C 89 173.970 173.837 0.133 1 1 767 . 19 1 1 A 89 89 PHE CA C 89 56.450 55.208 1.242 1 1 768 . 19 1 1 A 89 89 PHE CB C 89 41.120 41.440 -0.320 1 1 769 . 19 1 1 A 89 89 PHE N N 89 126.780 126.192 0.588 1 1 770 . 19 1 1 A 90 90 VAL H H 90 7.880 8.772 -0.892 1 1 771 . 19 1 1 A 90 90 VAL HA H 90 4.860 4.906 -0.046 1 1 779 . 19 1 1 A 90 90 VAL C C 90 173.190 175.093 -1.903 1 1 780 . 19 1 1 A 90 90 VAL CA C 90 59.750 61.057 -1.307 1 1 781 . 19 1 1 A 90 90 VAL CB C 90 34.770 33.901 0.869 1 1 784 . 19 1 1 A 90 90 VAL N N 90 124.990 127.938 -2.948 1 1 785 . 19 1 1 A 91 91 ASN H H 91 8.670 8.748 -0.078 1 1 786 . 19 1 1 A 91 91 ASN HA H 91 4.730 5.229 -0.499 1 1 791 . 19 1 1 A 91 91 ASN C C 91 173.200 173.825 -0.625 1 1 792 . 19 1 1 A 91 91 ASN CA C 91 51.970 53.395 -1.425 1 1 793 . 19 1 1 A 91 91 ASN CB C 91 41.340 40.996 0.344 1 1 794 . 19 1 1 A 91 91 ASN N N 91 124.860 123.637 1.223 1 1 796 . 19 1 1 A 92 92 ALA H H 92 8.840 9.116 -0.276 1 1 797 . 19 1 1 A 92 92 ALA HA H 92 5.290 5.428 -0.138 1 1 801 . 19 1 1 A 92 92 ALA C C 92 176.330 175.962 0.368 1 1 802 . 19 1 1 A 92 92 ALA CA C 92 50.170 50.550 -0.380 1 1 803 . 19 1 1 A 92 92 ALA CB C 92 23.610 21.197 2.413 1 1 804 . 19 1 1 A 92 92 ALA N N 92 128.510 129.415 -0.905 1 1 805 . 19 1 1 A 93 93 LYS H H 93 8.670 9.571 -0.901 1 1 806 . 19 1 1 A 93 93 LYS HA H 93 4.460 4.812 -0.352 1 1 815 . 19 1 1 A 93 93 LYS C C 93 174.170 175.408 -1.238 1 1 816 . 19 1 1 A 93 93 LYS CA C 93 55.010 54.610 0.400 1 1 817 . 19 1 1 A 93 93 LYS CB C 93 36.430 34.804 1.626 1 1 821 . 19 1 1 A 93 93 LYS N N 93 121.300 122.817 -1.517 1 1 822 . 19 1 1 A 94 94 LYS H H 94 8.960 8.490 0.470 1 1 823 . 19 1 1 A 94 94 LYS HA H 94 4.460 4.242 0.218 1 1 832 . 19 1 1 A 94 94 LYS C C 94 176.330 176.850 -0.520 1 1 833 . 19 1 1 A 94 94 LYS CA C 94 56.720 56.636 0.084 1 1 834 . 19 1 1 A 94 94 LYS CB C 94 31.930 32.751 -0.821 1 1 837 . 19 1 1 A 94 94 LYS N N 94 127.060 127.337 -0.277 1 1 838 . 19 1 1 A 95 95 ILE H H 95 8.290 8.221 0.069 1 1 839 . 19 1 1 A 95 95 ILE HA H 95 4.120 3.993 0.127 1 1 849 . 19 1 1 A 95 95 ILE C C 95 175.740 175.468 0.272 1 1 850 . 19 1 1 A 95 95 ILE CA C 95 62.760 62.904 -0.144 1 1 851 . 19 1 1 A 95 95 ILE CB C 95 38.890 38.978 -0.088 1 1 855 . 19 1 1 A 95 95 ILE N N 95 126.530 127.220 -0.690 1 1 856 . 19 1 1 A 96 96 GLU H H 96 8.030 7.470 0.560 1 1 857 . 19 1 1 A 96 96 GLU HA H 96 4.450 4.611 -0.161 1 1 862 . 19 1 1 A 96 96 GLU C C 96 174.380 174.353 0.027 1 1 863 . 19 1 1 A 96 96 GLU CA C 96 54.320 55.715 -1.395 1 1 864 . 19 1 1 A 96 96 GLU CB C 96 32.770 32.310 0.460 1 1 866 . 19 1 1 A 96 96 GLU N N 96 117.080 120.178 -3.098 1 1 867 . 19 1 1 A 97 97 ASP H H 97 8.730 8.547 0.183 1 1 868 . 19 1 1 A 97 97 ASP HA H 97 4.360 4.595 -0.235 1 1 871 . 19 1 1 A 97 97 ASP C C 97 177.100 176.412 0.688 1 1 872 . 19 1 1 A 97 97 ASP CA C 97 57.160 55.406 1.754 1 1 873 . 19 1 1 A 97 97 ASP CB C 97 39.920 40.394 -0.474 1 1 874 . 19 1 1 A 97 97 ASP N N 97 120.570 121.047 -0.477 1 1 875 . 19 1 1 A 98 98 GLY H H 98 8.760 8.252 0.508 1 1 876 . 19 1 1 A 98 98 GLY HA2 H 98 2.120 2.051 0.069 1 1 877 . 19 1 1 A 98 98 GLY HA3 H 98 3.910 3.474 0.436 1 1 878 . 19 1 1 A 98 98 GLY C C 98 174.000 172.887 1.113 1 1 879 . 19 1 1 A 98 98 GLY CA C 98 45.720 45.468 0.252 1 1 880 . 19 1 1 A 98 98 GLY N N 98 112.090 111.138 0.952 1 1 881 . 19 1 1 A 99 99 LYS H H 99 7.890 7.005 0.885 1 1 882 . 19 1 1 A 99 99 LYS HA H 99 5.330 4.893 0.437 1 1 891 . 19 1 1 A 99 99 LYS C C 99 174.750 174.301 0.449 1 1 892 . 19 1 1 A 99 99 LYS CA C 99 55.990 54.800 1.190 1 1 893 . 19 1 1 A 99 99 LYS CB C 99 37.840 35.648 2.192 1 1 897 . 19 1 1 A 99 99 LYS N N 99 118.050 114.497 3.553 1 1 898 . 19 1 1 A 100 100 VAL H H 100 8.980 9.104 -0.124 1 1 899 . 19 1 1 A 100 100 VAL HA H 100 4.510 4.755 -0.245 1 1 907 . 19 1 1 A 100 100 VAL C C 100 174.760 172.971 1.789 1 1 908 . 19 1 1 A 100 100 VAL CA C 100 60.130 59.680 0.450 1 1 909 . 19 1 1 A 100 100 VAL CB C 100 35.240 35.331 -0.091 1 1 912 . 19 1 1 A 100 100 VAL N N 100 123.850 120.178 3.672 1 1 913 . 19 1 1 A 101 101 ARG H H 101 8.810 8.638 0.172 1 1 914 . 19 1 1 A 101 101 ARG HA H 101 4.850 5.295 -0.445 1 1 921 . 19 1 1 A 101 101 ARG C C 101 174.770 174.216 0.554 1 1 922 . 19 1 1 A 101 101 ARG CA C 101 54.580 54.213 0.367 1 1 923 . 19 1 1 A 101 101 ARG CB C 101 32.400 32.952 -0.552 1 1 926 . 19 1 1 A 101 101 ARG N N 101 129.210 128.854 0.356 1 1 927 . 19 1 1 A 102 102 VAL H H 102 9.100 8.668 0.432 1 1 928 . 19 1 1 A 102 102 VAL HA H 102 4.120 4.897 -0.777 1 1 936 . 19 1 1 A 102 102 VAL C C 102 171.640 173.413 -1.773 1 1 937 . 19 1 1 A 102 102 VAL CA C 102 61.350 59.198 2.152 1 1 938 . 19 1 1 A 102 102 VAL CB C 102 32.530 35.264 -2.734 1 1 941 . 19 1 1 A 102 102 VAL N N 102 130.470 122.541 7.929 1 1 942 . 19 1 1 A 103 103 LEU H H 103 8.110 9.075 -0.965 1 1 943 . 19 1 1 A 103 103 LEU HA H 103 5.120 4.820 0.300 1 1 953 . 19 1 1 A 103 103 LEU C C 103 176.410 176.123 0.287 1 1 954 . 19 1 1 A 103 103 LEU CA C 103 53.380 54.048 -0.668 1 1 955 . 19 1 1 A 103 103 LEU CB C 103 43.680 43.913 -0.233 1 1 959 . 19 1 1 A 103 103 LEU N N 103 125.560 127.946 -2.386 1 1 960 . 19 1 1 A 104 104 VAL H H 104 9.580 9.007 0.573 1 1 961 . 19 1 1 A 104 104 VAL HA H 104 5.260 5.427 -0.167 1 1 969 . 19 1 1 A 104 104 VAL C C 104 176.030 175.077 0.953 1 1 970 . 19 1 1 A 104 104 VAL CA C 104 60.220 59.865 0.355 1 1 971 . 19 1 1 A 104 104 VAL CB C 104 34.310 33.668 0.642 1 1 974 . 19 1 1 A 104 104 VAL N N 104 125.790 121.311 4.479 1 1 975 . 19 1 1 A 105 105 SER H H 105 9.340 8.904 0.436 1 1 976 . 19 1 1 A 105 105 SER HA H 105 5.300 5.100 0.200 1 1 979 . 19 1 1 A 105 105 SER C C 105 173.600 172.944 0.656 1 1 980 . 19 1 1 A 105 105 SER CA C 105 57.450 57.428 0.022 1 1 981 . 19 1 1 A 105 105 SER CB C 105 65.600 66.751 -1.151 1 1 982 . 19 1 1 A 105 105 SER N N 105 119.220 116.296 2.924 1 1 983 . 19 1 1 A 106 106 SER H H 106 8.350 8.702 -0.352 1 1 984 . 19 1 1 A 106 106 SER HA H 106 4.720 4.740 -0.020 1 1 987 . 19 1 1 A 106 106 SER C C 106 176.930 173.882 3.048 1 1 988 . 19 1 1 A 106 106 SER CA C 106 58.170 57.719 0.451 1 1 989 . 19 1 1 A 106 106 SER CB C 106 64.170 63.434 0.736 1 1 990 . 19 1 1 A 106 106 SER N N 106 114.800 117.276 -2.476 1 1 991 . 19 1 1 A 107 107 LEU H H 107 8.770 8.561 0.209 1 1 992 . 19 1 1 A 107 107 LEU HA H 107 4.710 4.649 0.061 1 1 1001 . 19 1 1 A 107 107 LEU C C 107 178.280 177.214 1.066 1 1 1002 . 19 1 1 A 107 107 LEU CA C 107 55.280 53.981 1.299 1 1 1003 . 19 1 1 A 107 107 LEU CB C 107 43.410 42.352 1.058 1 1 1007 . 19 1 1 A 107 107 LEU N N 107 127.210 128.974 -1.764 1 1 1008 . 19 1 1 A 108 108 THR H H 108 8.210 7.825 0.385 1 1 1009 . 19 1 1 A 108 108 THR HA H 108 4.400 4.622 -0.222 1 1 1015 . 19 1 1 A 108 108 THR C C 108 176.130 175.680 0.450 1 1 1016 . 19 1 1 A 108 108 THR CA C 108 62.050 62.114 -0.064 1 1 1017 . 19 1 1 A 108 108 THR CB C 108 70.910 71.314 -0.404 1 1 1019 . 19 1 1 A 108 108 THR N N 108 108.810 111.499 -2.689 1 1 1020 . 19 1 1 A 109 109 GLY H H 109 8.250 8.112 0.138 1 1 1021 . 19 1 1 A 109 109 GLY HA2 H 109 3.780 4.068 -0.288 1 1 1022 . 19 1 1 A 109 109 GLY HA3 H 109 4.290 4.084 0.206 1 1 1023 . 19 1 1 A 109 109 GLY C C 109 173.180 174.178 -0.998 1 1 1024 . 19 1 1 A 109 109 GLY CA C 109 45.340 45.183 0.157 1 1 1025 . 19 1 1 A 109 109 GLY N N 109 110.160 111.004 -0.844 1 1 1026 . 19 1 1 A 110 110 GLU H H 110 7.960 7.527 0.433 1 1 1027 . 19 1 1 A 110 110 GLU HA H 110 4.760 4.818 -0.058 1 1 1032 . 19 1 1 A 110 110 GLU CA C 110 53.450 53.486 -0.036 1 1 1033 . 19 1 1 A 110 110 GLU CB C 110 30.020 30.214 -0.194 1 1 1035 . 19 1 1 A 110 110 GLU N N 110 119.720 120.501 -0.781 1 1 1036 . 19 1 1 A 111 111 PRO HA H 111 3.250 4.163 -0.913 1 1 1043 . 19 1 1 A 111 111 PRO C C 111 176.710 176.252 0.458 1 1 1044 . 19 1 1 A 111 111 PRO CA C 111 62.240 61.745 0.495 1 1 1045 . 19 1 1 A 111 111 PRO CB C 111 31.990 32.054 -0.064 1 1 1048 . 19 1 1 A 112 112 LEU H H 112 8.840 8.391 0.449 1 1 1049 . 19 1 1 A 112 112 LEU HA H 112 4.290 4.267 0.023 1 1 1059 . 19 1 1 A 112 112 LEU CA C 112 52.220 53.222 -1.002 1 1 1060 . 19 1 1 A 112 112 LEU CB C 112 41.090 42.945 -1.855 1 1 1063 . 19 1 1 A 112 112 LEU N N 112 122.420 123.216 -0.796 1 1 1064 . 19 1 1 A 113 113 PRO HA H 113 4.380 4.259 0.121 1 1 1071 . 19 1 1 A 113 113 PRO C C 113 176.100 177.462 -1.362 1 1 1072 . 19 1 1 A 113 113 PRO CA C 113 61.930 65.145 -3.215 1 1 1073 . 19 1 1 A 113 113 PRO CB C 113 32.470 31.726 0.744 1 1 1076 . 19 1 1 A 114 114 ALA H H 114 8.070 7.788 0.282 1 1 1077 . 19 1 1 A 114 114 ALA HA H 114 4.550 3.954 0.596 1 1 1081 . 19 1 1 A 114 114 ALA C C 114 177.490 177.100 0.390 1 1 1082 . 19 1 1 A 114 114 ALA CA C 114 51.340 53.788 -2.448 1 1 1083 . 19 1 1 A 114 114 ALA CB C 114 19.940 18.196 1.744 1 1 1084 . 19 1 1 A 114 114 ALA N N 114 121.460 120.906 0.554 1 1 1085 . 19 1 1 A 115 115 LYS H H 115 9.000 8.837 0.163 1 1 1086 . 19 1 1 A 115 115 LYS HA H 115 3.930 3.875 0.055 1 1 1095 . 19 1 1 A 115 115 LYS C C 115 175.740 175.298 0.442 1 1 1096 . 19 1 1 A 115 115 LYS CA C 115 57.580 57.703 -0.123 1 1 1097 . 19 1 1 A 115 115 LYS CB C 115 29.510 30.677 -1.167 1 1 1101 . 19 1 1 A 115 115 LYS N N 115 112.560 115.437 -2.877 1 1 1102 . 19 1 1 A 116 116 GLU H H 116 7.620 7.664 -0.044 1 1 1103 . 19 1 1 A 116 116 GLU HA H 116 4.550 4.948 -0.398 1 1 1108 . 19 1 1 A 116 116 GLU C C 116 176.110 175.264 0.846 1 1 1109 . 19 1 1 A 116 116 GLU CA C 116 54.570 54.311 0.259 1 1 1110 . 19 1 1 A 116 116 GLU CB C 116 33.680 33.618 0.062 1 1 1112 . 19 1 1 A 116 116 GLU N N 116 115.710 117.653 -1.943 1 1 1113 . 19 1 1 A 117 117 VAL H H 117 8.770 8.842 -0.072 1 1 1114 . 19 1 1 A 117 117 VAL HA H 117 3.200 4.064 -0.864 1 1 1122 . 19 1 1 A 117 117 VAL C C 117 175.740 176.159 -0.419 1 1 1123 . 19 1 1 A 117 117 VAL CA C 117 65.340 63.478 1.862 1 1 1124 . 19 1 1 A 117 117 VAL CB C 117 31.290 31.022 0.268 1 1 1127 . 19 1 1 A 117 117 VAL N N 117 124.450 120.206 4.244 1 1 1128 . 19 1 1 A 118 118 LEU H H 118 8.550 9.155 -0.605 1 1 1129 . 19 1 1 A 118 118 LEU HA H 118 4.540 4.442 0.098 1 1 1139 . 19 1 1 A 118 118 LEU C C 118 176.210 176.761 -0.551 1 1 1140 . 19 1 1 A 118 118 LEU CA C 118 55.510 56.029 -0.519 1 1 1141 . 19 1 1 A 118 118 LEU CB C 118 44.600 42.962 1.638 1 1 1145 . 19 1 1 A 118 118 LEU N N 118 128.440 129.138 -0.698 1 1 1146 . 19 1 1 A 119 119 ALA H H 119 7.970 7.668 0.302 1 1 1147 . 19 1 1 A 119 119 ALA HA H 119 4.740 4.864 -0.124 1 1 1151 . 19 1 1 A 119 119 ALA C C 119 174.570 175.259 -0.689 1 1 1152 . 19 1 1 A 119 119 ALA CA C 119 50.770 51.868 -1.098 1 1 1153 . 19 1 1 A 119 119 ALA CB C 119 22.450 22.568 -0.118 1 1 1154 . 19 1 1 A 119 119 ALA N N 119 118.100 118.443 -0.343 1 1 1155 . 19 1 1 A 120 120 LYS H H 120 8.760 9.404 -0.644 1 1 1156 . 19 1 1 A 120 120 LYS HA H 120 5.240 5.332 -0.092 1 1 1165 . 19 1 1 A 120 120 LYS C C 120 175.340 174.420 0.920 1 1 1166 . 19 1 1 A 120 120 LYS CA C 120 54.220 54.944 -0.724 1 1 1167 . 19 1 1 A 120 120 LYS CB C 120 34.340 34.527 -0.187 1 1 1171 . 19 1 1 A 120 120 LYS N N 120 120.010 122.610 -2.600 1 1 1172 . 19 1 1 A 121 121 VAL H H 121 9.410 8.703 0.707 1 1 1173 . 19 1 1 A 121 121 VAL HA H 121 4.230 4.696 -0.466 1 1 1181 . 19 1 1 A 121 121 VAL C C 121 173.980 174.948 -0.968 1 1 1182 . 19 1 1 A 121 121 VAL CA C 121 62.370 61.401 0.969 1 1 1183 . 19 1 1 A 121 121 VAL CB C 121 32.410 33.145 -0.735 1 1 1186 . 19 1 1 A 121 121 VAL N N 121 124.960 125.865 -0.905 1 1 1187 . 19 1 1 A 122 122 VAL H H 122 9.280 8.412 0.868 1 1 1188 . 19 1 1 A 122 122 VAL HA H 122 4.360 4.676 -0.316 1 1 1196 . 19 1 1 A 122 122 VAL C C 122 174.190 175.817 -1.627 1 1 1197 . 19 1 1 A 122 122 VAL CA C 122 62.760 61.755 1.005 1 1 1198 . 19 1 1 A 122 122 VAL CB C 122 32.020 31.961 0.059 1 1 1201 . 19 1 1 A 122 122 VAL N N 122 128.990 126.958 2.032 1 1 1202 . 19 1 1 A 123 123 LEU H H 123 8.610 8.703 -0.093 1 1 1203 . 19 1 1 A 123 123 LEU HA H 123 4.900 4.449 0.451 1 1 1213 . 19 1 1 A 123 123 LEU C C 123 174.950 176.445 -1.495 1 1 1214 . 19 1 1 A 123 123 LEU CA C 123 52.050 53.945 -1.895 1 1 1215 . 19 1 1 A 123 123 LEU CB C 123 45.210 42.068 3.142 1 1 1219 . 19 1 1 A 123 123 LEU N N 123 127.200 127.952 -0.752 1 1 1220 . 19 1 1 A 124 124 ARG H H 124 9.540 8.788 0.752 1 1 1221 . 19 1 1 A 124 124 ARG HA H 124 4.900 5.054 -0.154 1 1 1229 . 19 1 1 A 124 124 ARG C C 124 176.320 175.008 1.312 1 1 1230 . 19 1 1 A 124 124 ARG CA C 124 55.320 54.454 0.866 1 1 1231 . 19 1 1 A 124 124 ARG CB C 124 31.750 32.980 -1.230 1 1 1234 . 19 1 1 A 124 124 ARG N N 124 124.290 122.280 2.010 1 1 1236 . 19 1 1 A 125 125 ALA H H 125 8.880 8.287 0.593 1 1 1237 . 19 1 1 A 125 125 ALA HA H 125 4.380 4.115 0.265 1 1 1241 . 19 1 1 A 125 125 ALA C C 125 177.290 177.213 0.077 1 1 1242 . 19 1 1 A 125 125 ALA CA C 125 52.530 50.975 1.555 1 1 1243 . 19 1 1 A 125 125 ALA CB C 125 19.870 17.729 2.141 1 1 1244 . 19 1 1 A 125 125 ALA N N 125 130.790 129.012 1.778 1 1 1245 . 19 1 1 A 126 126 GLU H H 126 9.260 8.770 0.490 1 1 1246 . 19 1 1 A 126 126 GLU HA H 126 4.460 4.547 -0.087 1 1 1251 . 19 1 1 A 126 126 GLU C C 126 176.120 176.049 0.071 1 1 1252 . 19 1 1 A 126 126 GLU CA C 126 56.940 57.230 -0.290 1 1 1253 . 19 1 1 A 126 126 GLU CB C 126 32.450 30.467 1.983 1 1 1255 . 19 1 1 A 126 126 GLU N N 126 125.740 122.440 3.300 1 1 1256 . 19 1 1 A 127 127 ALA H H 127 7.460 7.462 -0.002 1 1 1257 . 19 1 1 A 127 127 ALA HA H 127 4.360 4.588 -0.228 1 1 1261 . 19 1 1 A 127 127 ALA C C 127 173.400 175.774 -2.374 1 1 1262 . 19 1 1 A 127 127 ALA CA C 127 51.360 51.663 -0.303 1 1 1263 . 19 1 1 A 127 127 ALA CB C 127 22.180 22.072 0.108 1 1 1264 . 19 1 1 A 127 127 ALA N N 127 120.910 120.263 0.647 1 1 1265 . 19 1 1 A 128 128 LYS H H 128 7.940 8.600 -0.660 1 1 1266 . 19 1 1 A 128 128 LYS HA H 128 3.580 4.126 -0.546 1 1 1275 . 19 1 1 A 128 128 LYS C C 128 176.080 176.019 0.061 1 1 1276 . 19 1 1 A 128 128 LYS CA C 128 56.860 57.322 -0.462 1 1 1277 . 19 1 1 A 128 128 LYS CB C 128 33.170 33.004 0.166 1 1 1281 . 19 1 1 A 128 128 LYS N N 128 116.520 124.680 -8.160 1 1 1282 . 19 1 1 A 129 129 ALA H H 129 8.590 8.625 -0.035 1 1 1283 . 19 1 1 A 129 129 ALA HA H 129 4.390 4.696 -0.306 1 1 1287 . 19 1 1 A 129 129 ALA C C 129 174.970 176.291 -1.321 1 1 1288 . 19 1 1 A 129 129 ALA CA C 129 52.970 50.997 1.973 1 1 1289 . 19 1 1 A 129 129 ALA CB C 129 21.500 19.366 2.134 1 1 1290 . 19 1 1 A 129 129 ALA N N 129 124.710 128.905 -4.195 1 1 1291 . 19 1 1 A 130 130 GLU H H 130 8.660 7.964 0.696 1 1 1292 . 19 1 1 A 130 130 GLU HA H 130 4.660 4.041 0.619 1 1 1297 . 19 1 1 A 130 130 GLU C C 130 177.390 177.419 -0.029 1 1 1298 . 19 1 1 A 130 130 GLU CA C 130 55.070 58.611 -3.541 1 1 1299 . 19 1 1 A 130 130 GLU CB C 130 30.860 29.500 1.360 1 1 1301 . 19 1 1 A 130 130 GLU N N 130 123.180 119.966 3.214 1 1 1302 . 19 1 1 A 131 131 GLY H H 131 9.170 9.086 0.084 1 1 1303 . 19 1 1 A 131 131 GLY HA2 H 131 3.560 3.990 -0.430 1 1 1304 . 19 1 1 A 131 131 GLY HA3 H 131 3.750 3.991 -0.241 1 1 1305 . 19 1 1 A 131 131 GLY C C 131 174.550 174.614 -0.064 1 1 1306 . 19 1 1 A 131 131 GLY CA C 131 47.660 44.984 2.676 1 1 1307 . 19 1 1 A 131 131 GLY N N 131 115.530 113.380 2.150 1 1 1308 . 19 1 1 A 132 132 SER H H 132 8.430 8.459 -0.029 1 1 1309 . 19 1 1 A 132 132 SER HA H 132 4.170 4.424 -0.254 1 1 1312 . 19 1 1 A 132 132 SER C C 132 175.350 173.720 1.630 1 1 1313 . 19 1 1 A 132 132 SER CA C 132 59.050 59.459 -0.409 1 1 1314 . 19 1 1 A 132 132 SER CB C 132 64.880 63.078 1.802 1 1 1315 . 19 1 1 A 132 132 SER N N 132 115.930 118.978 -3.048 1 1 1316 . 19 1 1 A 133 133 ASN H H 133 8.850 8.321 0.529 1 1 1317 . 19 1 1 A 133 133 ASN HA H 133 4.910 5.144 -0.234 1 1 1322 . 19 1 1 A 133 133 ASN C C 133 175.450 174.899 0.551 1 1 1323 . 19 1 1 A 133 133 ASN CA C 133 54.920 54.065 0.855 1 1 1324 . 19 1 1 A 133 133 ASN CB C 133 41.060 39.333 1.727 1 1 1325 . 19 1 1 A 133 133 ASN N N 133 125.590 123.671 1.919 1 1 1327 . 19 1 1 A 134 134 LEU H H 134 9.070 9.450 -0.380 1 1 1328 . 19 1 1 A 134 134 LEU HA H 134 5.230 5.214 0.016 1 1 1338 . 19 1 1 A 134 134 LEU C C 134 175.240 175.384 -0.144 1 1 1339 . 19 1 1 A 134 134 LEU CA C 134 53.470 54.039 -0.569 1 1 1340 . 19 1 1 A 134 134 LEU CB C 134 45.090 44.011 1.079 1 1 1344 . 19 1 1 A 134 134 LEU N N 134 129.210 121.150 8.060 1 1 1345 . 19 1 1 A 135 135 SER H H 135 8.690 8.962 -0.272 1 1 1346 . 19 1 1 A 135 135 SER HA H 135 5.280 5.409 -0.129 1 1 1349 . 19 1 1 A 135 135 SER C C 135 173.590 173.599 -0.009 1 1 1350 . 19 1 1 A 135 135 SER CA C 135 56.220 56.570 -0.350 1 1 1351 . 19 1 1 A 135 135 SER CB C 135 66.510 64.520 1.990 1 1 1352 . 19 1 1 A 135 135 SER N N 135 113.020 119.934 -6.914 1 1 1353 . 19 1 1 A 136 136 VAL H H 136 8.940 8.744 0.196 1 1 1354 . 19 1 1 A 136 136 VAL HA H 136 5.500 5.075 0.425 1 1 1362 . 19 1 1 A 136 136 VAL C C 136 175.730 175.103 0.627 1 1 1363 . 19 1 1 A 136 136 VAL CA C 136 60.960 60.782 0.178 1 1 1364 . 19 1 1 A 136 136 VAL CB C 136 33.630 32.826 0.804 1 1 1367 . 19 1 1 A 136 136 VAL N N 136 124.340 119.119 5.221 1 1 1368 . 19 1 1 A 137 137 THR H H 137 9.240 8.137 1.103 1 1 1369 . 19 1 1 A 137 137 THR HA H 137 4.920 4.758 0.162 1 1 1374 . 19 1 1 A 137 137 THR C C 137 173.500 174.108 -0.608 1 1 1375 . 19 1 1 A 137 137 THR CA C 137 59.120 60.310 -1.190 1 1 1376 . 19 1 1 A 137 137 THR CB C 137 72.500 70.426 2.074 1 1 1378 . 19 1 1 A 137 137 THR N N 137 117.010 118.070 -1.060 1 1 1379 . 19 1 1 A 138 138 ASN H H 138 9.190 8.839 0.351 1 1 1380 . 19 1 1 A 138 138 ASN HA H 138 4.420 4.328 0.092 1 1 1385 . 19 1 1 A 138 138 ASN C C 138 175.550 174.457 1.093 1 1 1386 . 19 1 1 A 138 138 ASN CA C 138 54.350 54.272 0.078 1 1 1387 . 19 1 1 A 138 138 ASN CB C 138 37.380 36.693 0.687 1 1 1388 . 19 1 1 A 138 138 ASN N N 138 115.270 118.070 -2.800 1 1 1390 . 19 1 1 A 139 139 SER H H 139 8.560 7.912 0.648 1 1 1391 . 19 1 1 A 139 139 SER HA H 139 5.800 4.327 1.473 1 1 1394 . 19 1 1 A 139 139 SER C C 139 175.750 174.153 1.597 1 1 1395 . 19 1 1 A 139 139 SER CA C 139 56.020 60.363 -4.343 1 1 1396 . 19 1 1 A 139 139 SER CB C 139 65.320 63.537 1.783 1 1 1397 . 19 1 1 A 139 139 SER N N 139 112.360 115.579 -3.219 1 1 1398 . 19 1 1 A 140 140 SER H H 140 9.900 8.585 1.315 1 1 1399 . 19 1 1 A 140 140 SER HA H 140 5.360 5.439 -0.079 1 1 1402 . 19 1 1 A 140 140 SER C C 140 172.620 172.863 -0.243 1 1 1403 . 19 1 1 A 140 140 SER CA C 140 57.400 57.023 0.377 1 1 1404 . 19 1 1 A 140 140 SER CB C 140 66.550 66.328 0.222 1 1 1405 . 19 1 1 A 140 140 SER N N 140 119.130 123.295 -4.165 1 1 1406 . 19 1 1 A 141 141 VAL H H 141 9.030 8.838 0.192 1 1 1407 . 19 1 1 A 141 141 VAL HA H 141 5.520 5.024 0.496 1 1 1415 . 19 1 1 A 141 141 VAL C C 141 174.750 174.814 -0.064 1 1 1416 . 19 1 1 A 141 141 VAL CA C 141 58.310 59.999 -1.689 1 1 1417 . 19 1 1 A 141 141 VAL CB C 141 35.030 35.641 -0.611 1 1 1420 . 19 1 1 A 141 141 VAL N N 141 111.410 117.041 -5.631 1 1 1421 . 19 1 1 A 142 142 GLY H H 142 8.790 8.907 -0.117 1 1 1422 . 19 1 1 A 142 142 GLY HA2 H 142 3.600 4.050 -0.450 1 1 1423 . 19 1 1 A 142 142 GLY HA3 H 142 5.310 4.083 1.227 1 1 1424 . 19 1 1 A 142 142 GLY C C 142 174.180 173.459 0.721 1 1 1425 . 19 1 1 A 142 142 GLY CA C 142 44.110 46.218 -2.108 1 1 1426 . 19 1 1 A 142 142 GLY N N 142 109.330 111.517 -2.187 1 1 1427 . 19 1 1 A 143 143 ASP H H 143 8.840 8.916 -0.076 1 1 1428 . 19 1 1 A 143 143 ASP HA H 143 5.790 5.124 0.666 1 1 1431 . 19 1 1 A 143 143 ASP C C 143 178.860 178.162 0.698 1 1 1432 . 19 1 1 A 143 143 ASP CA C 143 53.040 54.749 -1.709 1 1 1433 . 19 1 1 A 143 143 ASP CB C 143 43.660 42.602 1.058 1 1 1434 . 19 1 1 A 143 143 ASP N N 143 125.390 126.612 -1.222 1 1 1435 . 19 1 1 A 144 144 GLY H H 144 9.150 8.854 0.296 1 1 1436 . 19 1 1 A 144 144 GLY HA2 H 144 3.450 3.810 -0.360 1 1 1437 . 19 1 1 A 144 144 GLY HA3 H 144 3.720 4.012 -0.292 1 1 1438 . 19 1 1 A 144 144 GLY C C 144 174.770 176.219 -1.449 1 1 1439 . 19 1 1 A 144 144 GLY CA C 144 46.930 47.334 -0.404 1 1 1440 . 19 1 1 A 144 144 GLY N N 144 106.470 110.064 -3.594 1 1 1441 . 19 1 1 A 145 145 GLU H H 145 8.470 7.867 0.603 1 1 1442 . 19 1 1 A 145 145 GLU HA H 145 4.460 4.321 0.139 1 1 1447 . 19 1 1 A 145 145 GLU C C 145 176.520 176.267 0.253 1 1 1448 . 19 1 1 A 145 145 GLU CA C 145 55.330 56.893 -1.563 1 1 1449 . 19 1 1 A 145 145 GLU CB C 145 30.620 29.970 0.650 1 1 1451 . 19 1 1 A 145 145 GLU N N 145 119.170 120.034 -0.864 1 1 1452 . 19 1 1 A 146 146 GLY H H 146 7.950 7.881 0.069 1 1 1453 . 19 1 1 A 146 146 GLY HA2 H 146 3.630 4.002 -0.372 1 1 1454 . 19 1 1 A 146 146 GLY HA3 H 146 4.130 4.007 0.123 1 1 1455 . 19 1 1 A 146 146 GLY C C 146 174.350 174.805 -0.455 1 1 1456 . 19 1 1 A 146 146 GLY CA C 146 45.330 45.338 -0.008 1 1 1457 . 19 1 1 A 146 146 GLY N N 146 108.130 106.322 1.808 1 1 1458 . 19 1 1 A 147 147 LEU H H 147 8.440 7.939 0.501 1 1 1459 . 19 1 1 A 147 147 LEU HA H 147 4.340 4.442 -0.102 1 1 1469 . 19 1 1 A 147 147 LEU C C 147 175.950 175.415 0.535 1 1 1470 . 19 1 1 A 147 147 LEU CA C 147 54.860 54.650 0.210 1 1 1471 . 19 1 1 A 147 147 LEU CB C 147 41.590 42.362 -0.772 1 1 1475 . 19 1 1 A 147 147 LEU N N 147 124.000 122.254 1.746 1 1 1476 . 19 1 1 A 148 148 VAL H H 148 7.780 8.372 -0.592 1 1 1477 . 19 1 1 A 148 148 VAL HA H 148 4.830 5.297 -0.467 1 1 1485 . 19 1 1 A 148 148 VAL C C 148 175.740 173.434 2.306 1 1 1486 . 19 1 1 A 148 148 VAL CA C 148 61.140 59.466 1.674 1 1 1487 . 19 1 1 A 148 148 VAL CB C 148 33.640 35.119 -1.479 1 1 1490 . 19 1 1 A 148 148 VAL N N 148 120.440 119.658 0.782 1 1 1491 . 19 1 1 A 149 149 HIS H H 149 9.170 8.646 0.524 1 1 1492 . 19 1 1 A 149 149 HIS HA H 149 4.950 5.075 -0.125 1 1 1496 . 19 1 1 A 149 149 HIS C C 149 174.780 174.332 0.448 1 1 1497 . 19 1 1 A 149 149 HIS CA C 149 53.900 54.259 -0.359 1 1 1498 . 19 1 1 A 149 149 HIS CB C 149 32.200 30.776 1.424 1 1 1499 . 19 1 1 A 149 149 HIS N N 149 124.700 125.927 -1.227 1 1 1500 . 19 1 1 A 150 150 GLU H H 150 9.060 8.825 0.235 1 1 1501 . 19 1 1 A 150 150 GLU HA H 150 4.420 4.325 0.095 1 1 1506 . 19 1 1 A 150 150 GLU C C 150 176.520 176.144 0.376 1 1 1507 . 19 1 1 A 150 150 GLU CA C 150 57.630 57.424 0.206 1 1 1508 . 19 1 1 A 150 150 GLU CB C 150 30.370 30.102 0.268 1 1 1510 . 19 1 1 A 150 150 GLU N N 150 125.540 125.062 0.478 1 1 1511 . 19 1 1 A 151 151 ILE H H 151 8.150 8.382 -0.232 1 1 1512 . 19 1 1 A 151 151 ILE HA H 151 4.780 4.528 0.252 1 1 1522 . 19 1 1 A 151 151 ILE C C 151 174.570 176.204 -1.634 1 1 1523 . 19 1 1 A 151 151 ILE CA C 151 59.390 59.548 -0.158 1 1 1524 . 19 1 1 A 151 151 ILE CB C 151 42.040 39.191 2.849 1 1 1528 . 19 1 1 A 151 151 ILE N N 151 115.880 123.210 -7.330 1 1 1529 . 19 1 1 A 152 152 ALA H H 152 8.010 8.499 -0.489 1 1 1530 . 19 1 1 A 152 152 ALA HA H 152 4.310 4.410 -0.100 1 1 1534 . 19 1 1 A 152 152 ALA C C 152 177.500 176.767 0.733 1 1 1535 . 19 1 1 A 152 152 ALA CA C 152 53.680 51.896 1.784 1 1 1536 . 19 1 1 A 152 152 ALA CB C 152 20.050 19.831 0.219 1 1 1537 . 19 1 1 A 152 152 ALA N N 152 126.640 124.296 2.344 1 1 1538 . 19 1 1 A 153 153 GLY H H 153 8.340 8.325 0.015 1 1 1539 . 19 1 1 A 153 153 GLY HA2 H 153 4.050 4.299 -0.249 1 1 1540 . 19 1 1 A 153 153 GLY HA3 H 153 4.140 4.300 -0.160 1 1 1541 . 19 1 1 A 153 153 GLY C C 153 173.140 171.820 1.320 1 1 1542 . 19 1 1 A 153 153 GLY CA C 153 44.130 45.668 -1.538 1 1 1543 . 19 1 1 A 153 153 GLY N N 153 107.490 105.357 2.133 1 1 1544 . 19 1 1 A 154 154 THR H H 154 7.380 8.363 -0.983 1 1 1545 . 19 1 1 A 154 154 THR HA H 154 4.700 5.068 -0.368 1 1 1550 . 19 1 1 A 154 154 THR C C 154 171.120 173.546 -2.426 1 1 1551 . 19 1 1 A 154 154 THR CA C 154 60.830 60.867 -0.037 1 1 1552 . 19 1 1 A 154 154 THR CB C 154 68.850 72.775 -3.925 1 1 1554 . 19 1 1 A 154 154 THR N N 154 109.340 114.226 -4.886 1 1 1555 . 19 1 1 A 155 155 GLU H H 155 8.020 8.703 -0.683 1 1 1556 . 19 1 1 A 155 155 GLU HA H 155 5.370 5.517 -0.147 1 1 1561 . 19 1 1 A 155 155 GLU C C 155 174.240 174.304 -0.064 1 1 1562 . 19 1 1 A 155 155 GLU CA C 155 54.830 54.049 0.781 1 1 1563 . 19 1 1 A 155 155 GLU CB C 155 33.620 34.065 -0.445 1 1 1565 . 19 1 1 A 155 155 GLU N N 155 118.690 121.112 -2.422 1 1 1566 . 19 1 1 A 156 156 LYS H H 156 9.230 8.911 0.319 1 1 1567 . 19 1 1 A 156 156 LYS HA H 156 4.650 4.982 -0.332 1 1 1576 . 19 1 1 A 156 156 LYS C C 156 174.000 174.512 -0.512 1 1 1577 . 19 1 1 A 156 156 LYS CA C 156 55.840 55.175 0.665 1 1 1578 . 19 1 1 A 156 156 LYS CB C 156 37.550 36.579 0.971 1 1 1582 . 19 1 1 A 156 156 LYS N N 156 121.940 121.121 0.819 1 1 1583 . 19 1 1 A 157 157 THR H H 157 8.160 8.608 -0.448 1 1 1584 . 19 1 1 A 157 157 THR HA H 157 5.440 5.065 0.375 1 1 1589 . 19 1 1 A 157 157 THR C C 157 174.360 173.477 0.883 1 1 1590 . 19 1 1 A 157 157 THR CA C 157 60.410 60.682 -0.272 1 1 1591 . 19 1 1 A 157 157 THR CB C 157 71.500 71.200 0.300 1 1 1593 . 19 1 1 A 157 157 THR N N 157 113.240 112.891 0.349 1 1 1594 . 19 1 1 A 158 158 VAL H H 158 9.120 8.482 0.638 1 1 1595 . 19 1 1 A 158 158 VAL HA H 158 4.580 4.996 -0.416 1 1 1603 . 19 1 1 A 158 158 VAL C C 158 172.800 174.786 -1.986 1 1 1604 . 19 1 1 A 158 158 VAL CA C 158 59.980 60.208 -0.228 1 1 1605 . 19 1 1 A 158 158 VAL CB C 158 36.290 33.885 2.405 1 1 1608 . 19 1 1 A 158 158 VAL N N 158 121.710 122.595 -0.885 1 1 1609 . 19 1 1 A 159 159 ASN H H 159 8.240 8.700 -0.460 1 1 1610 . 19 1 1 A 159 159 ASN HA H 159 5.420 5.032 0.388 1 1 1615 . 19 1 1 A 159 159 ASN C C 159 173.800 174.220 -0.420 1 1 1616 . 19 1 1 A 159 159 ASN CA C 159 51.740 52.473 -0.733 1 1 1617 . 19 1 1 A 159 159 ASN CB C 159 40.380 39.262 1.118 1 1 1618 . 19 1 1 A 159 159 ASN N N 159 122.730 123.864 -1.134 1 1 1620 . 19 1 1 A 160 160 ILE H H 160 9.160 8.676 0.484 1 1 1621 . 19 1 1 A 160 160 ILE HA H 160 5.130 4.933 0.197 1 1 1631 . 19 1 1 A 160 160 ILE C C 160 177.320 175.658 1.662 1 1 1632 . 19 1 1 A 160 160 ILE CA C 160 60.640 61.195 -0.555 1 1 1633 . 19 1 1 A 160 160 ILE CB C 160 38.520 37.799 0.721 1 1 1637 . 19 1 1 A 160 160 ILE N N 160 123.690 125.829 -2.139 1 1 1638 . 19 1 1 A 161 161 ILE H H 161 8.780 9.007 -0.227 1 1 1639 . 19 1 1 A 161 161 ILE HA H 161 4.590 4.591 -0.001 1 1 1649 . 19 1 1 A 161 161 ILE C C 161 174.960 175.883 -0.923 1 1 1650 . 19 1 1 A 161 161 ILE CA C 161 59.320 60.339 -1.019 1 1 1651 . 19 1 1 A 161 161 ILE CB C 161 41.030 39.818 1.212 1 1 1655 . 19 1 1 A 161 161 ILE N N 161 122.490 129.080 -6.590 1 1 1656 . 19 1 1 A 162 162 GLU H H 162 8.620 8.403 0.217 1 1 1657 . 19 1 1 A 162 162 GLU HA H 162 4.290 4.305 -0.015 1 1 1662 . 19 1 1 A 162 162 GLU C C 162 176.660 177.133 -0.473 1 1 1663 . 19 1 1 A 162 162 GLU CA C 162 56.470 57.272 -0.802 1 1 1664 . 19 1 1 A 162 162 GLU CB C 162 31.150 30.333 0.817 1 1 1666 . 19 1 1 A 162 162 GLU N N 162 120.520 126.076 -5.556 1 1 1667 . 19 1 1 A 163 163 GLY H H 163 8.480 8.600 -0.120 1 1 1668 . 19 1 1 A 163 163 GLY HA2 H 163 3.910 4.171 -0.261 1 1 1669 . 19 1 1 A 163 163 GLY HA3 H 163 4.150 4.174 -0.024 1 1 1670 . 19 1 1 A 163 163 GLY C C 163 174.000 173.013 0.987 1 1 1671 . 19 1 1 A 163 163 GLY CA C 163 45.270 44.475 0.795 1 1 1672 . 19 1 1 A 163 163 GLY N N 163 110.210 110.677 -0.467 1 1 1673 . 19 1 1 A 164 164 THR H H 164 8.170 8.734 -0.564 1 1 1674 . 19 1 1 A 164 164 THR HA H 164 4.410 4.918 -0.508 1 1 1679 . 19 1 1 A 164 164 THR C C 164 174.100 174.178 -0.078 1 1 1680 . 19 1 1 A 164 164 THR CA C 164 61.620 60.830 0.790 1 1 1681 . 19 1 1 A 164 164 THR CB C 164 70.060 72.508 -2.448 1 1 1683 . 19 1 1 A 164 164 THR N N 164 113.480 118.230 -4.750 1 1 1 . 20 1 1 A 13 13 GLY H H 13 8.350 8.786 -0.436 1 1 2 . 20 1 1 A 13 13 GLY HA2 H 13 3.920 3.863 0.057 1 1 3 . 20 1 1 A 13 13 GLY HA3 H 13 3.920 3.864 0.056 1 1 4 . 20 1 1 A 13 13 GLY CA C 13 45.290 47.120 -1.830 1 1 5 . 20 1 1 A 13 13 GLY N N 13 110.450 110.166 0.284 1 1 6 . 20 1 1 A 14 14 LEU H H 14 8.050 7.956 0.094 1 1 7 . 20 1 1 A 14 14 LEU N N 14 121.500 119.611 1.889 1 1 8 . 20 1 1 A 15 15 VAL H H 15 8.070 7.742 0.328 1 1 9 . 20 1 1 A 15 15 VAL N N 15 122.390 117.172 5.218 1 1 10 . 20 1 1 A 16 16 PRO HA H 16 4.360 4.435 -0.075 1 1 17 . 20 1 1 A 16 16 PRO CA C 16 62.770 63.359 -0.589 1 1 18 . 20 1 1 A 16 16 PRO CB C 16 32.020 32.255 -0.235 1 1 21 . 20 1 1 A 21 21 MET H H 21 8.180 8.848 -0.668 1 1 22 . 20 1 1 A 21 21 MET N N 21 121.310 119.911 1.399 1 1 23 . 20 1 1 A 22 22 ALA H H 22 8.290 8.365 -0.075 1 1 24 . 20 1 1 A 22 22 ALA N N 22 124.800 126.654 -1.854 1 1 25 . 20 1 1 A 23 23 SER H H 23 8.210 8.833 -0.623 1 1 26 . 20 1 1 A 23 23 SER N N 23 114.830 117.285 -2.455 1 1 27 . 20 1 1 A 24 24 LYS H H 24 8.250 8.895 -0.645 1 1 28 . 20 1 1 A 24 24 LYS N N 24 122.980 128.862 -5.882 1 1 29 . 20 1 1 A 25 25 LEU H H 25 8.140 7.429 0.711 1 1 30 . 20 1 1 A 25 25 LEU HA H 25 4.290 4.585 -0.295 1 1 40 . 20 1 1 A 25 25 LEU C C 25 177.410 176.416 0.994 1 1 41 . 20 1 1 A 25 25 LEU CA C 25 55.430 54.175 1.255 1 1 42 . 20 1 1 A 25 25 LEU CB C 25 42.350 43.270 -0.920 1 1 46 . 20 1 1 A 25 25 LEU N N 25 122.580 120.881 1.699 1 1 47 . 20 1 1 A 26 26 LYS H H 26 8.200 8.685 -0.485 1 1 48 . 20 1 1 A 26 26 LYS HA H 26 4.260 4.172 0.088 1 1 57 . 20 1 1 A 26 26 LYS C C 26 176.520 176.903 -0.383 1 1 58 . 20 1 1 A 26 26 LYS CA C 26 56.700 56.539 0.161 1 1 59 . 20 1 1 A 26 26 LYS CB C 26 33.060 33.163 -0.103 1 1 63 . 20 1 1 A 26 26 LYS N N 26 121.800 127.376 -5.576 1 1 64 . 20 1 1 A 27 27 GLU H H 27 8.380 8.856 -0.476 1 1 65 . 20 1 1 A 27 27 GLU HA H 27 4.240 4.135 0.105 1 1 70 . 20 1 1 A 27 27 GLU C C 27 176.130 174.876 1.254 1 1 71 . 20 1 1 A 27 27 GLU CA C 27 56.700 58.607 -1.907 1 1 72 . 20 1 1 A 27 27 GLU CB C 27 30.370 28.400 1.970 1 1 74 . 20 1 1 A 27 27 GLU N N 27 121.700 117.596 4.104 1 1 75 . 20 1 1 A 28 28 ALA H H 28 8.230 8.480 -0.250 1 1 76 . 20 1 1 A 28 28 ALA HA H 28 4.280 5.045 -0.765 1 1 80 . 20 1 1 A 28 28 ALA C C 28 177.090 176.146 0.944 1 1 81 . 20 1 1 A 28 28 ALA CA C 28 52.530 51.674 0.856 1 1 82 . 20 1 1 A 28 28 ALA CB C 28 19.360 22.050 -2.690 1 1 83 . 20 1 1 A 28 28 ALA N N 28 124.640 121.524 3.116 1 1 84 . 20 1 1 A 29 29 ALA H H 29 8.150 8.573 -0.423 1 1 85 . 20 1 1 A 29 29 ALA HA H 29 4.320 4.764 -0.444 1 1 89 . 20 1 1 A 29 29 ALA C C 29 177.120 176.934 0.186 1 1 90 . 20 1 1 A 29 29 ALA CA C 29 52.040 50.889 1.151 1 1 91 . 20 1 1 A 29 29 ALA CB C 29 19.430 19.652 -0.222 1 1 92 . 20 1 1 A 29 29 ALA N N 29 123.430 125.829 -2.399 1 1 93 . 20 1 1 A 30 30 GLU H H 30 8.310 7.463 0.847 1 1 94 . 20 1 1 A 30 30 GLU HA H 30 4.220 4.503 -0.283 1 1 99 . 20 1 1 A 30 30 GLU C C 30 176.310 176.393 -0.083 1 1 100 . 20 1 1 A 30 30 GLU CA C 30 56.630 56.557 0.073 1 1 101 . 20 1 1 A 30 30 GLU CB C 30 30.320 29.980 0.340 1 1 103 . 20 1 1 A 30 30 GLU N N 30 120.630 117.468 3.162 1 1 104 . 20 1 1 A 31 31 VAL H H 31 8.630 8.880 -0.250 1 1 105 . 20 1 1 A 31 31 VAL HA H 31 4.430 4.922 -0.492 1 1 113 . 20 1 1 A 31 31 VAL C C 31 176.510 177.237 -0.727 1 1 114 . 20 1 1 A 31 31 VAL CA C 31 62.360 62.128 0.232 1 1 115 . 20 1 1 A 31 31 VAL CB C 31 32.370 32.173 0.197 1 1 118 . 20 1 1 A 31 31 VAL N N 31 127.110 123.854 3.256 1 1 119 . 20 1 1 A 32 32 THR H H 32 7.640 8.720 -1.080 1 1 120 . 20 1 1 A 32 32 THR HA H 32 4.870 3.922 0.948 1 1 125 . 20 1 1 A 32 32 THR C C 32 172.220 174.829 -2.609 1 1 126 . 20 1 1 A 32 32 THR CA C 32 59.510 65.095 -5.585 1 1 127 . 20 1 1 A 32 32 THR CB C 32 71.630 69.640 1.990 1 1 129 . 20 1 1 A 32 32 THR N N 32 118.860 121.666 -2.806 1 1 130 . 20 1 1 A 33 33 GLY H H 33 8.350 7.951 0.399 1 1 131 . 20 1 1 A 33 33 GLY HA2 H 33 4.160 3.944 0.216 1 1 132 . 20 1 1 A 33 33 GLY HA3 H 33 4.250 3.966 0.284 1 1 133 . 20 1 1 A 33 33 GLY C C 33 172.820 173.066 -0.246 1 1 134 . 20 1 1 A 33 33 GLY CA C 33 46.680 45.679 1.001 1 1 135 . 20 1 1 A 33 33 GLY N N 33 106.720 108.944 -2.224 1 1 136 . 20 1 1 A 34 34 SER H H 34 8.810 8.145 0.665 1 1 137 . 20 1 1 A 34 34 SER HA H 34 5.390 4.984 0.406 1 1 140 . 20 1 1 A 34 34 SER C C 34 173.780 172.906 0.874 1 1 141 . 20 1 1 A 34 34 SER CA C 34 57.380 57.281 0.099 1 1 142 . 20 1 1 A 34 34 SER CB C 34 65.730 65.547 0.183 1 1 143 . 20 1 1 A 34 34 SER N N 34 112.690 119.930 -7.240 1 1 144 . 20 1 1 A 35 35 VAL H H 35 8.470 8.749 -0.279 1 1 145 . 20 1 1 A 35 35 VAL HA H 35 4.120 4.861 -0.741 1 1 153 . 20 1 1 A 35 35 VAL C C 35 174.750 174.874 -0.124 1 1 154 . 20 1 1 A 35 35 VAL CA C 35 62.310 60.535 1.775 1 1 155 . 20 1 1 A 35 35 VAL CB C 35 34.550 33.200 1.350 1 1 158 . 20 1 1 A 35 35 VAL N N 35 123.150 121.242 1.908 1 1 159 . 20 1 1 A 36 36 SER H H 36 8.240 9.105 -0.865 1 1 160 . 20 1 1 A 36 36 SER HA H 36 4.690 4.983 -0.293 1 1 163 . 20 1 1 A 36 36 SER C C 36 171.860 173.442 -1.582 1 1 164 . 20 1 1 A 36 36 SER CA C 36 56.020 57.793 -1.773 1 1 165 . 20 1 1 A 36 36 SER CB C 36 66.050 63.739 2.311 1 1 166 . 20 1 1 A 36 36 SER N N 36 118.760 121.447 -2.687 1 1 167 . 20 1 1 A 37 37 LEU H H 37 8.310 8.902 -0.592 1 1 168 . 20 1 1 A 37 37 LEU HA H 37 4.870 4.845 0.025 1 1 178 . 20 1 1 A 37 37 LEU C C 37 174.190 175.314 -1.124 1 1 179 . 20 1 1 A 37 37 LEU CA C 37 53.870 53.845 0.025 1 1 180 . 20 1 1 A 37 37 LEU CB C 37 47.000 42.201 4.799 1 1 184 . 20 1 1 A 37 37 LEU N N 37 124.790 127.196 -2.406 1 1 185 . 20 1 1 A 38 38 GLU H H 38 9.270 8.929 0.341 1 1 186 . 20 1 1 A 38 38 GLU HA H 38 4.650 5.295 -0.645 1 1 191 . 20 1 1 A 38 38 GLU C C 38 173.970 175.261 -1.291 1 1 192 . 20 1 1 A 38 38 GLU CA C 38 54.410 55.051 -0.641 1 1 193 . 20 1 1 A 38 38 GLU CB C 38 32.460 32.355 0.105 1 1 195 . 20 1 1 A 38 38 GLU N N 38 126.550 127.005 -0.455 1 1 196 . 20 1 1 A 39 39 ALA H H 39 8.120 8.245 -0.125 1 1 197 . 20 1 1 A 39 39 ALA HA H 39 4.600 4.723 -0.123 1 1 201 . 20 1 1 A 39 39 ALA C C 39 175.930 177.225 -1.295 1 1 202 . 20 1 1 A 39 39 ALA CA C 39 51.570 51.130 0.440 1 1 203 . 20 1 1 A 39 39 ALA CB C 39 21.780 22.581 -0.801 1 1 204 . 20 1 1 A 39 39 ALA N N 39 124.410 127.714 -3.304 1 1 205 . 20 1 1 A 40 40 LEU H H 40 7.860 8.796 -0.936 1 1 206 . 20 1 1 A 40 40 LEU HA H 40 4.230 4.013 0.217 1 1 216 . 20 1 1 A 40 40 LEU C C 40 175.940 176.501 -0.561 1 1 217 . 20 1 1 A 40 40 LEU CA C 40 55.360 57.810 -2.450 1 1 218 . 20 1 1 A 40 40 LEU CB C 40 42.990 42.816 0.174 1 1 222 . 20 1 1 A 40 40 LEU N N 40 120.640 121.386 -0.746 1 1 223 . 20 1 1 A 41 41 GLU H H 41 8.210 7.878 0.332 1 1 224 . 20 1 1 A 41 41 GLU HA H 41 4.240 3.938 0.302 1 1 229 . 20 1 1 A 41 41 GLU C C 41 176.920 174.819 2.101 1 1 230 . 20 1 1 A 41 41 GLU CA C 41 58.090 57.543 0.547 1 1 231 . 20 1 1 A 41 41 GLU CB C 41 30.530 27.111 3.419 1 1 233 . 20 1 1 A 41 41 GLU N N 41 114.680 117.606 -2.926 1 1 234 . 20 1 1 A 42 42 GLU H H 42 7.490 7.741 -0.251 1 1 235 . 20 1 1 A 42 42 GLU HA H 42 5.680 4.773 0.907 1 1 240 . 20 1 1 A 42 42 GLU C C 42 173.790 174.036 -0.246 1 1 241 . 20 1 1 A 42 42 GLU CA C 42 54.360 56.225 -1.865 1 1 242 . 20 1 1 A 42 42 GLU CB C 42 33.850 32.834 1.016 1 1 244 . 20 1 1 A 42 42 GLU N N 42 116.670 118.104 -1.434 1 1 245 . 20 1 1 A 43 43 VAL H H 43 8.550 9.125 -0.575 1 1 246 . 20 1 1 A 43 43 VAL HA H 43 4.550 5.047 -0.497 1 1 254 . 20 1 1 A 43 43 VAL C C 43 172.220 173.194 -0.974 1 1 255 . 20 1 1 A 43 43 VAL CA C 43 59.470 59.428 0.042 1 1 256 . 20 1 1 A 43 43 VAL CB C 43 35.470 35.868 -0.398 1 1 259 . 20 1 1 A 43 43 VAL N N 43 120.030 126.032 -6.002 1 1 260 . 20 1 1 A 44 44 GLN H H 44 8.470 8.919 -0.449 1 1 261 . 20 1 1 A 44 44 GLN HA H 44 4.890 5.152 -0.262 1 1 268 . 20 1 1 A 44 44 GLN C C 44 176.130 174.951 1.179 1 1 269 . 20 1 1 A 44 44 GLN CA C 44 54.360 54.034 0.326 1 1 270 . 20 1 1 A 44 44 GLN CB C 44 30.610 32.327 -1.717 1 1 272 . 20 1 1 A 44 44 GLN N N 44 124.690 125.754 -1.064 1 1 274 . 20 1 1 A 45 45 VAL H H 45 8.130 8.636 -0.506 1 1 275 . 20 1 1 A 45 45 VAL HA H 45 3.030 4.047 -1.017 1 1 283 . 20 1 1 A 45 45 VAL C C 45 176.710 177.320 -0.610 1 1 284 . 20 1 1 A 45 45 VAL CA C 45 65.810 64.697 1.113 1 1 285 . 20 1 1 A 45 45 VAL CB C 45 31.960 31.496 0.464 1 1 288 . 20 1 1 A 45 45 VAL N N 45 120.450 126.991 -6.541 1 1 289 . 20 1 1 A 46 46 GLY H H 46 8.950 10.012 -1.062 1 1 290 . 20 1 1 A 46 46 GLY HA2 H 46 3.590 3.928 -0.338 1 1 291 . 20 1 1 A 46 46 GLY HA3 H 46 4.410 3.932 0.478 1 1 292 . 20 1 1 A 46 46 GLY C C 46 174.390 173.412 0.978 1 1 293 . 20 1 1 A 46 46 GLY CA C 46 44.730 45.514 -0.784 1 1 294 . 20 1 1 A 46 46 GLY N N 46 116.490 114.732 1.758 1 1 295 . 20 1 1 A 47 47 GLU H H 47 8.260 7.688 0.572 1 1 296 . 20 1 1 A 47 47 GLU HA H 47 4.460 4.932 -0.472 1 1 301 . 20 1 1 A 47 47 GLU C C 47 174.780 174.766 0.014 1 1 302 . 20 1 1 A 47 47 GLU CA C 47 54.830 54.822 0.008 1 1 303 . 20 1 1 A 47 47 GLU CB C 47 31.140 33.544 -2.404 1 1 305 . 20 1 1 A 47 47 GLU N N 47 120.520 119.771 0.749 1 1 306 . 20 1 1 A 48 48 ASN H H 48 8.440 8.842 -0.402 1 1 307 . 20 1 1 A 48 48 ASN HA H 48 5.380 5.668 -0.288 1 1 312 . 20 1 1 A 48 48 ASN C C 48 174.770 172.848 1.922 1 1 313 . 20 1 1 A 48 48 ASN CA C 48 51.570 51.369 0.201 1 1 314 . 20 1 1 A 48 48 ASN CB C 48 39.010 42.192 -3.182 1 1 315 . 20 1 1 A 48 48 ASN N N 48 117.180 119.636 -2.456 1 1 317 . 20 1 1 A 49 49 LEU H H 49 9.810 8.709 1.101 1 1 318 . 20 1 1 A 49 49 LEU HA H 49 4.510 5.233 -0.723 1 1 328 . 20 1 1 A 49 49 LEU C C 49 174.560 174.475 0.085 1 1 329 . 20 1 1 A 49 49 LEU CA C 49 53.460 53.460 0.000 1 1 330 . 20 1 1 A 49 49 LEU CB C 49 45.520 46.357 -0.837 1 1 333 . 20 1 1 A 49 49 LEU N N 49 125.620 124.145 1.475 1 1 334 . 20 1 1 A 50 50 GLU H H 50 8.750 8.851 -0.101 1 1 335 . 20 1 1 A 50 50 GLU HA H 50 4.360 4.866 -0.506 1 1 340 . 20 1 1 A 50 50 GLU C C 50 175.340 174.752 0.588 1 1 341 . 20 1 1 A 50 50 GLU CA C 50 55.550 55.258 0.292 1 1 342 . 20 1 1 A 50 50 GLU CB C 50 29.890 30.988 -1.098 1 1 344 . 20 1 1 A 50 50 GLU N N 50 125.420 124.778 0.642 1 1 345 . 20 1 1 A 51 51 VAL H H 51 9.230 8.951 0.279 1 1 346 . 20 1 1 A 51 51 VAL HA H 51 4.190 4.768 -0.578 1 1 354 . 20 1 1 A 51 51 VAL C C 51 175.310 174.949 0.361 1 1 355 . 20 1 1 A 51 51 VAL CA C 51 62.520 61.289 1.231 1 1 356 . 20 1 1 A 51 51 VAL CB C 51 31.470 33.342 -1.872 1 1 359 . 20 1 1 A 51 51 VAL N N 51 129.810 125.880 3.930 1 1 360 . 20 1 1 A 52 52 GLY H H 52 9.410 8.906 0.504 1 1 361 . 20 1 1 A 52 52 GLY HA2 H 52 3.460 3.954 -0.494 1 1 362 . 20 1 1 A 52 52 GLY HA3 H 52 4.680 3.977 0.703 1 1 363 . 20 1 1 A 52 52 GLY C C 52 173.000 172.820 0.180 1 1 364 . 20 1 1 A 52 52 GLY CA C 52 46.470 46.092 0.378 1 1 365 . 20 1 1 A 52 52 GLY N N 52 116.600 116.789 -0.189 1 1 366 . 20 1 1 A 53 53 VAL H H 53 9.130 8.800 0.330 1 1 367 . 20 1 1 A 53 53 VAL HA H 53 4.840 4.819 0.021 1 1 375 . 20 1 1 A 53 53 VAL C C 53 175.470 175.472 -0.002 1 1 376 . 20 1 1 A 53 53 VAL CA C 53 61.350 61.199 0.151 1 1 377 . 20 1 1 A 53 53 VAL CB C 53 34.300 32.058 2.242 1 1 380 . 20 1 1 A 53 53 VAL N N 53 129.050 125.531 3.519 1 1 381 . 20 1 1 A 54 54 GLY H H 54 8.420 8.646 -0.226 1 1 382 . 20 1 1 A 54 54 GLY HA2 H 54 3.850 3.865 -0.015 1 1 383 . 20 1 1 A 54 54 GLY HA3 H 54 3.850 3.939 -0.089 1 1 384 . 20 1 1 A 54 54 GLY C C 54 173.310 173.150 0.160 1 1 385 . 20 1 1 A 54 54 GLY CA C 54 45.180 44.211 0.969 1 1 386 . 20 1 1 A 54 54 GLY N N 54 116.890 115.430 1.460 1 1 387 . 20 1 1 A 55 55 ILE H H 55 10.190 8.088 2.102 1 1 388 . 20 1 1 A 55 55 ILE HA H 55 4.010 4.664 -0.654 1 1 398 . 20 1 1 A 55 55 ILE C C 55 174.380 175.028 -0.648 1 1 399 . 20 1 1 A 55 55 ILE CA C 55 61.350 59.722 1.628 1 1 400 . 20 1 1 A 55 55 ILE CB C 55 40.840 39.853 0.987 1 1 404 . 20 1 1 A 55 55 ILE N N 55 129.330 121.066 8.264 1 1 405 . 20 1 1 A 56 56 ASP H H 56 8.810 9.451 -0.641 1 1 406 . 20 1 1 A 56 56 ASP HA H 56 4.440 5.175 -0.735 1 1 409 . 20 1 1 A 56 56 ASP C C 56 175.530 176.064 -0.534 1 1 410 . 20 1 1 A 56 56 ASP CA C 56 56.460 55.688 0.772 1 1 411 . 20 1 1 A 56 56 ASP CB C 56 42.720 43.221 -0.501 1 1 412 . 20 1 1 A 56 56 ASP N N 56 128.310 127.047 1.263 1 1 413 . 20 1 1 A 57 57 GLU H H 57 7.270 7.377 -0.107 1 1 414 . 20 1 1 A 57 57 GLU HA H 57 4.290 4.831 -0.541 1 1 419 . 20 1 1 A 57 57 GLU C C 57 173.370 174.295 -0.925 1 1 420 . 20 1 1 A 57 57 GLU CA C 57 54.840 55.382 -0.542 1 1 421 . 20 1 1 A 57 57 GLU CB C 57 33.190 33.635 -0.445 1 1 423 . 20 1 1 A 57 57 GLU N N 57 112.810 116.208 -3.398 1 1 424 . 20 1 1 A 58 58 LEU H H 58 8.370 8.574 -0.204 1 1 425 . 20 1 1 A 58 58 LEU HA H 58 4.830 4.651 0.179 1 1 434 . 20 1 1 A 58 58 LEU C C 58 174.180 174.484 -0.304 1 1 435 . 20 1 1 A 58 58 LEU CA C 58 55.320 54.816 0.504 1 1 436 . 20 1 1 A 58 58 LEU CB C 58 44.300 43.037 1.263 1 1 439 . 20 1 1 A 58 58 LEU N N 58 123.130 124.841 -1.711 1 1 440 . 20 1 1 A 59 59 VAL H H 59 9.120 8.832 0.288 1 1 441 . 20 1 1 A 59 59 VAL HA H 59 4.240 4.519 -0.279 1 1 449 . 20 1 1 A 59 59 VAL C C 59 174.960 175.506 -0.546 1 1 450 . 20 1 1 A 59 59 VAL CA C 59 61.760 59.665 2.095 1 1 451 . 20 1 1 A 59 59 VAL CB C 59 33.760 33.659 0.101 1 1 454 . 20 1 1 A 59 59 VAL N N 59 127.930 126.092 1.838 1 1 455 . 20 1 1 A 60 60 ASN H H 60 8.770 8.688 0.082 1 1 456 . 20 1 1 A 60 60 ASN HA H 60 4.250 4.364 -0.114 1 1 461 . 20 1 1 A 60 60 ASN C C 60 172.810 173.790 -0.980 1 1 462 . 20 1 1 A 60 60 ASN CA C 60 54.830 54.490 0.340 1 1 463 . 20 1 1 A 60 60 ASN CB C 60 36.030 36.654 -0.624 1 1 464 . 20 1 1 A 60 60 ASN N N 60 115.500 123.171 -7.671 1 1 466 . 20 1 1 A 61 61 ALA H H 61 7.330 7.269 0.061 1 1 467 . 20 1 1 A 61 61 ALA HA H 61 4.520 4.486 0.034 1 1 471 . 20 1 1 A 61 61 ALA C C 61 174.580 174.904 -0.324 1 1 472 . 20 1 1 A 61 61 ALA CA C 61 51.560 51.294 0.266 1 1 473 . 20 1 1 A 61 61 ALA CB C 61 22.870 22.295 0.575 1 1 474 . 20 1 1 A 61 61 ALA N N 61 115.640 117.132 -1.492 1 1 475 . 20 1 1 A 62 62 GLU H H 62 7.900 9.727 -1.827 1 1 476 . 20 1 1 A 62 62 GLU HA H 62 4.310 4.572 -0.262 1 1 481 . 20 1 1 A 62 62 GLU C C 62 173.790 175.079 -1.289 1 1 482 . 20 1 1 A 62 62 GLU CA C 62 55.080 54.789 0.291 1 1 483 . 20 1 1 A 62 62 GLU CB C 62 32.610 30.021 2.589 1 1 485 . 20 1 1 A 62 62 GLU N N 62 117.400 122.594 -5.194 1 1 486 . 20 1 1 A 63 63 ALA H H 63 8.910 8.605 0.305 1 1 487 . 20 1 1 A 63 63 ALA HA H 63 4.690 4.499 0.191 1 1 491 . 20 1 1 A 63 63 ALA C C 63 175.720 176.592 -0.872 1 1 492 . 20 1 1 A 63 63 ALA CA C 63 50.600 53.034 -2.434 1 1 493 . 20 1 1 A 63 63 ALA CB C 63 20.660 19.112 1.548 1 1 494 . 20 1 1 A 63 63 ALA N N 63 122.480 129.733 -7.253 1 1 495 . 20 1 1 A 64 64 PHE H H 64 9.220 9.805 -0.585 1 1 496 . 20 1 1 A 64 64 PHE HA H 64 4.320 4.675 -0.355 1 1 501 . 20 1 1 A 64 64 PHE C C 64 174.380 176.309 -1.929 1 1 502 . 20 1 1 A 64 64 PHE CA C 64 59.770 58.767 1.003 1 1 503 . 20 1 1 A 64 64 PHE CB C 64 40.830 40.876 -0.046 1 1 504 . 20 1 1 A 64 64 PHE N N 64 120.870 123.076 -2.206 1 1 505 . 20 1 1 A 65 65 ALA H H 65 8.150 7.871 0.279 1 1 506 . 20 1 1 A 65 65 ALA HA H 65 5.280 4.861 0.419 1 1 510 . 20 1 1 A 65 65 ALA C C 65 175.950 174.971 0.979 1 1 511 . 20 1 1 A 65 65 ALA CA C 65 51.120 51.149 -0.029 1 1 512 . 20 1 1 A 65 65 ALA CB C 65 22.850 21.413 1.437 1 1 513 . 20 1 1 A 65 65 ALA N N 65 122.350 120.363 1.987 1 1 514 . 20 1 1 A 66 66 TYR H H 66 9.260 9.242 0.018 1 1 515 . 20 1 1 A 66 66 TYR HA H 66 5.710 5.319 0.391 1 1 520 . 20 1 1 A 66 66 TYR C C 66 175.690 173.817 1.873 1 1 521 . 20 1 1 A 66 66 TYR CA C 66 54.390 56.348 -1.958 1 1 522 . 20 1 1 A 66 66 TYR CB C 66 41.560 40.087 1.473 1 1 523 . 20 1 1 A 66 66 TYR N N 66 124.350 126.879 -2.529 1 1 524 . 20 1 1 A 67 67 ASP H H 67 9.070 8.879 0.191 1 1 525 . 20 1 1 A 67 67 ASP HA H 67 5.630 5.083 0.547 1 1 528 . 20 1 1 A 67 67 ASP C C 67 174.300 175.132 -0.832 1 1 529 . 20 1 1 A 67 67 ASP CA C 67 51.590 52.392 -0.802 1 1 530 . 20 1 1 A 67 67 ASP CB C 67 44.380 42.175 2.205 1 1 531 . 20 1 1 A 67 67 ASP N N 67 130.490 126.138 4.352 1 1 532 . 20 1 1 A 68 68 PHE H H 68 8.670 8.408 0.262 1 1 533 . 20 1 1 A 68 68 PHE HA H 68 4.890 5.301 -0.411 1 1 538 . 20 1 1 A 68 68 PHE C C 68 172.220 174.234 -2.014 1 1 539 . 20 1 1 A 68 68 PHE CA C 68 57.360 54.787 2.573 1 1 540 . 20 1 1 A 68 68 PHE CB C 68 40.360 42.123 -1.763 1 1 541 . 20 1 1 A 68 68 PHE N N 68 118.200 119.384 -1.184 1 1 542 . 20 1 1 A 69 69 THR H H 69 8.390 8.983 -0.593 1 1 543 . 20 1 1 A 69 69 THR HA H 69 5.170 4.936 0.234 1 1 548 . 20 1 1 A 69 69 THR C C 69 172.620 173.392 -0.772 1 1 549 . 20 1 1 A 69 69 THR CA C 69 61.370 61.512 -0.142 1 1 550 . 20 1 1 A 69 69 THR CB C 69 64.880 71.232 -6.352 1 1 552 . 20 1 1 A 69 69 THR N N 69 115.810 114.119 1.691 1 1 553 . 20 1 1 A 70 70 LEU H H 70 9.560 9.017 0.543 1 1 554 . 20 1 1 A 70 70 LEU HA H 70 5.270 4.854 0.416 1 1 564 . 20 1 1 A 70 70 LEU C C 70 173.800 175.208 -1.408 1 1 565 . 20 1 1 A 70 70 LEU CA C 70 53.460 55.570 -2.110 1 1 566 . 20 1 1 A 70 70 LEU CB C 70 45.040 43.141 1.899 1 1 570 . 20 1 1 A 70 70 LEU N N 70 129.220 130.092 -0.872 1 1 571 . 20 1 1 A 71 71 ASN H H 71 9.590 8.765 0.825 1 1 572 . 20 1 1 A 71 71 ASN HA H 71 5.880 5.630 0.250 1 1 577 . 20 1 1 A 71 71 ASN C C 71 177.970 174.407 3.563 1 1 578 . 20 1 1 A 71 71 ASN CA C 71 52.060 52.287 -0.227 1 1 579 . 20 1 1 A 71 71 ASN CB C 71 41.020 40.473 0.547 1 1 580 . 20 1 1 A 71 71 ASN N N 71 125.970 123.532 2.438 1 1 582 . 20 1 1 A 72 72 TYR H H 72 8.740 9.276 -0.536 1 1 583 . 20 1 1 A 72 72 TYR HA H 72 5.110 5.417 -0.307 1 1 588 . 20 1 1 A 72 72 TYR C C 72 177.720 173.715 4.005 1 1 589 . 20 1 1 A 72 72 TYR CA C 72 55.310 55.368 -0.058 1 1 590 . 20 1 1 A 72 72 TYR CB C 72 41.510 41.331 0.179 1 1 591 . 20 1 1 A 72 72 TYR N N 72 119.640 121.366 -1.726 1 1 592 . 20 1 1 A 73 73 ASP H H 73 9.780 9.177 0.603 1 1 593 . 20 1 1 A 73 73 ASP HA H 73 4.680 5.268 -0.588 1 1 596 . 20 1 1 A 73 73 ASP C C 73 177.290 176.237 1.053 1 1 597 . 20 1 1 A 73 73 ASP CA C 73 53.650 53.124 0.526 1 1 598 . 20 1 1 A 73 73 ASP CB C 73 40.900 43.511 -2.611 1 1 599 . 20 1 1 A 73 73 ASP N N 73 119.290 119.136 0.154 1 1 600 . 20 1 1 A 74 74 GLU H H 74 9.430 8.843 0.587 1 1 601 . 20 1 1 A 74 74 GLU HA H 74 4.740 4.186 0.554 1 1 606 . 20 1 1 A 74 74 GLU C C 74 176.320 178.081 -1.761 1 1 607 . 20 1 1 A 74 74 GLU CA C 74 57.410 59.096 -1.686 1 1 608 . 20 1 1 A 74 74 GLU CB C 74 29.490 29.293 0.197 1 1 610 . 20 1 1 A 74 74 GLU N N 74 130.930 125.384 5.546 1 1 611 . 20 1 1 A 75 75 ASN H H 75 8.680 8.256 0.424 1 1 612 . 20 1 1 A 75 75 ASN HA H 75 4.600 4.462 0.138 1 1 617 . 20 1 1 A 75 75 ASN C C 75 175.340 176.636 -1.296 1 1 618 . 20 1 1 A 75 75 ASN CA C 75 54.620 56.049 -1.429 1 1 619 . 20 1 1 A 75 75 ASN CB C 75 38.770 38.594 0.176 1 1 620 . 20 1 1 A 75 75 ASN N N 75 115.040 117.832 -2.792 1 1 622 . 20 1 1 A 76 76 ALA H H 76 7.740 7.715 0.025 1 1 623 . 20 1 1 A 76 76 ALA HA H 76 4.310 4.433 -0.123 1 1 627 . 20 1 1 A 76 76 ALA C C 76 175.550 176.739 -1.189 1 1 628 . 20 1 1 A 76 76 ALA CA C 76 53.260 53.499 -0.239 1 1 629 . 20 1 1 A 76 76 ALA CB C 76 21.450 20.640 0.810 1 1 630 . 20 1 1 A 76 76 ALA N N 76 122.200 120.075 2.125 1 1 631 . 20 1 1 A 77 77 PHE H H 77 8.070 8.315 -0.245 1 1 632 . 20 1 1 A 77 77 PHE HA H 77 5.650 4.881 0.769 1 1 637 . 20 1 1 A 77 77 PHE C C 77 174.570 175.409 -0.839 1 1 638 . 20 1 1 A 77 77 PHE CA C 77 56.360 57.479 -1.119 1 1 639 . 20 1 1 A 77 77 PHE CB C 77 46.080 40.818 5.262 1 1 640 . 20 1 1 A 77 77 PHE N N 77 114.160 114.008 0.152 1 1 641 . 20 1 1 A 78 78 GLU H H 78 8.800 8.944 -0.144 1 1 642 . 20 1 1 A 78 78 GLU HA H 78 4.900 4.987 -0.087 1 1 647 . 20 1 1 A 78 78 GLU C C 78 175.950 174.764 1.186 1 1 648 . 20 1 1 A 78 78 GLU CA C 78 53.670 56.139 -2.469 1 1 649 . 20 1 1 A 78 78 GLU CB C 78 33.600 32.561 1.039 1 1 651 . 20 1 1 A 78 78 GLU N N 78 117.590 120.214 -2.624 1 1 652 . 20 1 1 A 79 79 TYR H H 79 8.770 9.178 -0.408 1 1 653 . 20 1 1 A 79 79 TYR HA H 79 4.250 4.135 0.115 1 1 658 . 20 1 1 A 79 79 TYR C C 79 174.580 174.934 -0.354 1 1 659 . 20 1 1 A 79 79 TYR CA C 79 59.250 59.638 -0.388 1 1 660 . 20 1 1 A 79 79 TYR CB C 79 38.310 39.189 -0.879 1 1 661 . 20 1 1 A 79 79 TYR N N 79 126.560 129.808 -3.248 1 1 662 . 20 1 1 A 80 80 VAL H H 80 8.220 7.996 0.224 1 1 663 . 20 1 1 A 80 80 VAL HA H 80 3.690 3.882 -0.192 1 1 671 . 20 1 1 A 80 80 VAL C C 80 174.780 174.887 -0.107 1 1 672 . 20 1 1 A 80 80 VAL CA C 80 64.400 62.858 1.542 1 1 673 . 20 1 1 A 80 80 VAL CB C 80 33.510 33.169 0.341 1 1 676 . 20 1 1 A 80 80 VAL N N 80 129.460 125.670 3.790 1 1 677 . 20 1 1 A 81 81 GLU H H 81 6.920 7.595 -0.675 1 1 678 . 20 1 1 A 81 81 GLU HA H 81 4.260 4.689 -0.429 1 1 683 . 20 1 1 A 81 81 GLU C C 81 171.840 175.318 -3.478 1 1 684 . 20 1 1 A 81 81 GLU CA C 81 55.310 55.190 0.120 1 1 685 . 20 1 1 A 81 81 GLU CB C 81 30.520 33.354 -2.834 1 1 687 . 20 1 1 A 81 81 GLU N N 81 112.430 117.618 -5.188 1 1 688 . 20 1 1 A 82 82 ALA H H 82 8.310 8.624 -0.314 1 1 689 . 20 1 1 A 82 82 ALA HA H 82 5.650 4.834 0.816 1 1 693 . 20 1 1 A 82 82 ALA C C 82 176.110 177.253 -1.143 1 1 694 . 20 1 1 A 82 82 ALA CA C 82 50.620 51.755 -1.135 1 1 695 . 20 1 1 A 82 82 ALA CB C 82 21.770 20.054 1.716 1 1 696 . 20 1 1 A 82 82 ALA N N 82 121.240 125.669 -4.429 1 1 697 . 20 1 1 A 83 83 ILE H H 83 9.150 9.311 -0.161 1 1 698 . 20 1 1 A 83 83 ILE HA H 83 4.600 4.986 -0.386 1 1 708 . 20 1 1 A 83 83 ILE C C 83 174.810 174.847 -0.037 1 1 709 . 20 1 1 A 83 83 ILE CA C 83 60.060 59.238 0.822 1 1 710 . 20 1 1 A 83 83 ILE CB C 83 42.440 42.433 0.007 1 1 714 . 20 1 1 A 83 83 ILE N N 83 119.720 118.742 0.978 1 1 715 . 20 1 1 A 84 84 SER H H 84 8.350 8.704 -0.354 1 1 716 . 20 1 1 A 84 84 SER HA H 84 4.660 4.816 -0.156 1 1 719 . 20 1 1 A 84 84 SER C C 84 177.550 172.032 5.518 1 1 720 . 20 1 1 A 84 84 SER CA C 84 57.330 55.748 1.582 1 1 721 . 20 1 1 A 84 84 SER CB C 84 66.490 65.121 1.369 1 1 722 . 20 1 1 A 84 84 SER N N 84 116.740 117.155 -0.415 1 1 723 . 20 1 1 A 85 85 ASP H H 85 8.740 8.645 0.095 1 1 724 . 20 1 1 A 85 85 ASP HA H 85 4.820 4.764 0.056 1 1 727 . 20 1 1 A 85 85 ASP C C 85 176.090 175.885 0.205 1 1 728 . 20 1 1 A 85 85 ASP CA C 85 53.480 52.187 1.293 1 1 729 . 20 1 1 A 85 85 ASP CB C 85 42.480 43.288 -0.808 1 1 730 . 20 1 1 A 85 85 ASP N N 85 120.960 121.622 -0.662 1 1 731 . 20 1 1 A 86 86 ASP H H 86 8.380 8.732 -0.352 1 1 732 . 20 1 1 A 86 86 ASP HA H 86 4.450 4.874 -0.424 1 1 735 . 20 1 1 A 86 86 ASP C C 86 177.100 176.902 0.198 1 1 736 . 20 1 1 A 86 86 ASP CA C 86 56.240 54.110 2.130 1 1 737 . 20 1 1 A 86 86 ASP CB C 86 41.100 41.290 -0.190 1 1 738 . 20 1 1 A 86 86 ASP N N 86 117.710 121.003 -3.293 1 1 739 . 20 1 1 A 87 87 GLY H H 87 8.690 7.599 1.091 1 1 740 . 20 1 1 A 87 87 GLY HA2 H 87 3.870 4.095 -0.225 1 1 741 . 20 1 1 A 87 87 GLY HA3 H 87 4.090 4.104 -0.014 1 1 742 . 20 1 1 A 87 87 GLY C C 87 173.800 174.129 -0.329 1 1 743 . 20 1 1 A 87 87 GLY CA C 87 45.770 45.729 0.041 1 1 744 . 20 1 1 A 87 87 GLY N N 87 108.540 107.470 1.070 1 1 745 . 20 1 1 A 88 88 VAL H H 88 7.910 7.717 0.193 1 1 746 . 20 1 1 A 88 88 VAL HA H 88 4.780 4.284 0.496 1 1 754 . 20 1 1 A 88 88 VAL C C 88 173.970 175.486 -1.516 1 1 755 . 20 1 1 A 88 88 VAL CA C 88 60.900 62.254 -1.354 1 1 756 . 20 1 1 A 88 88 VAL CB C 88 35.460 32.939 2.521 1 1 759 . 20 1 1 A 88 88 VAL N N 88 119.790 120.133 -0.343 1 1 760 . 20 1 1 A 89 89 PHE H H 89 9.210 9.763 -0.553 1 1 761 . 20 1 1 A 89 89 PHE HA H 89 4.930 5.276 -0.346 1 1 766 . 20 1 1 A 89 89 PHE C C 89 173.970 173.917 0.053 1 1 767 . 20 1 1 A 89 89 PHE CA C 89 56.450 56.148 0.302 1 1 768 . 20 1 1 A 89 89 PHE CB C 89 41.120 42.350 -1.230 1 1 769 . 20 1 1 A 89 89 PHE N N 89 126.780 127.251 -0.471 1 1 770 . 20 1 1 A 90 90 VAL H H 90 7.880 8.289 -0.409 1 1 771 . 20 1 1 A 90 90 VAL HA H 90 4.860 5.268 -0.408 1 1 779 . 20 1 1 A 90 90 VAL C C 90 173.190 174.787 -1.597 1 1 780 . 20 1 1 A 90 90 VAL CA C 90 59.750 60.388 -0.638 1 1 781 . 20 1 1 A 90 90 VAL CB C 90 34.770 35.288 -0.518 1 1 784 . 20 1 1 A 90 90 VAL N N 90 124.990 126.619 -1.629 1 1 785 . 20 1 1 A 91 91 ASN H H 91 8.670 8.583 0.087 1 1 786 . 20 1 1 A 91 91 ASN HA H 91 4.730 5.175 -0.445 1 1 791 . 20 1 1 A 91 91 ASN C C 91 173.200 174.086 -0.886 1 1 792 . 20 1 1 A 91 91 ASN CA C 91 51.970 53.218 -1.248 1 1 793 . 20 1 1 A 91 91 ASN CB C 91 41.340 41.814 -0.474 1 1 794 . 20 1 1 A 91 91 ASN N N 91 124.860 124.470 0.390 1 1 796 . 20 1 1 A 92 92 ALA H H 92 8.840 9.125 -0.285 1 1 797 . 20 1 1 A 92 92 ALA HA H 92 5.290 5.468 -0.178 1 1 801 . 20 1 1 A 92 92 ALA C C 92 176.330 176.250 0.080 1 1 802 . 20 1 1 A 92 92 ALA CA C 92 50.170 51.005 -0.835 1 1 803 . 20 1 1 A 92 92 ALA CB C 92 23.610 21.140 2.470 1 1 804 . 20 1 1 A 92 92 ALA N N 92 128.510 128.849 -0.339 1 1 805 . 20 1 1 A 93 93 LYS H H 93 8.670 9.340 -0.670 1 1 806 . 20 1 1 A 93 93 LYS HA H 93 4.460 4.886 -0.426 1 1 815 . 20 1 1 A 93 93 LYS C C 93 174.170 175.182 -1.012 1 1 816 . 20 1 1 A 93 93 LYS CA C 93 55.010 54.928 0.082 1 1 817 . 20 1 1 A 93 93 LYS CB C 93 36.430 35.815 0.615 1 1 821 . 20 1 1 A 93 93 LYS N N 93 121.300 120.804 0.496 1 1 822 . 20 1 1 A 94 94 LYS H H 94 8.960 8.849 0.111 1 1 823 . 20 1 1 A 94 94 LYS HA H 94 4.460 4.179 0.281 1 1 832 . 20 1 1 A 94 94 LYS C C 94 176.330 176.598 -0.268 1 1 833 . 20 1 1 A 94 94 LYS CA C 94 56.720 57.017 -0.297 1 1 834 . 20 1 1 A 94 94 LYS CB C 94 31.930 32.628 -0.698 1 1 837 . 20 1 1 A 94 94 LYS N N 94 127.060 127.346 -0.286 1 1 838 . 20 1 1 A 95 95 ILE H H 95 8.290 8.958 -0.668 1 1 839 . 20 1 1 A 95 95 ILE HA H 95 4.120 4.305 -0.185 1 1 849 . 20 1 1 A 95 95 ILE C C 95 175.740 174.677 1.063 1 1 850 . 20 1 1 A 95 95 ILE CA C 95 62.760 61.931 0.829 1 1 851 . 20 1 1 A 95 95 ILE CB C 95 38.890 40.283 -1.393 1 1 855 . 20 1 1 A 95 95 ILE N N 95 126.530 128.892 -2.362 1 1 856 . 20 1 1 A 96 96 GLU H H 96 8.030 7.380 0.650 1 1 857 . 20 1 1 A 96 96 GLU HA H 96 4.450 4.779 -0.329 1 1 862 . 20 1 1 A 96 96 GLU C C 96 174.380 175.054 -0.674 1 1 863 . 20 1 1 A 96 96 GLU CA C 96 54.320 54.913 -0.593 1 1 864 . 20 1 1 A 96 96 GLU CB C 96 32.770 33.972 -1.202 1 1 866 . 20 1 1 A 96 96 GLU N N 96 117.080 119.117 -2.037 1 1 867 . 20 1 1 A 97 97 ASP H H 97 8.730 8.690 0.040 1 1 868 . 20 1 1 A 97 97 ASP HA H 97 4.360 4.569 -0.209 1 1 871 . 20 1 1 A 97 97 ASP C C 97 177.100 176.420 0.680 1 1 872 . 20 1 1 A 97 97 ASP CA C 97 57.160 55.395 1.765 1 1 873 . 20 1 1 A 97 97 ASP CB C 97 39.920 40.250 -0.330 1 1 874 . 20 1 1 A 97 97 ASP N N 97 120.570 122.114 -1.544 1 1 875 . 20 1 1 A 98 98 GLY H H 98 8.760 8.115 0.645 1 1 876 . 20 1 1 A 98 98 GLY HA2 H 98 2.120 1.363 0.757 1 1 877 . 20 1 1 A 98 98 GLY HA3 H 98 3.910 3.350 0.560 1 1 878 . 20 1 1 A 98 98 GLY C C 98 174.000 172.919 1.081 1 1 879 . 20 1 1 A 98 98 GLY CA C 98 45.720 45.138 0.582 1 1 880 . 20 1 1 A 98 98 GLY N N 98 112.090 111.162 0.928 1 1 881 . 20 1 1 A 99 99 LYS H H 99 7.890 6.901 0.989 1 1 882 . 20 1 1 A 99 99 LYS HA H 99 5.330 5.009 0.321 1 1 891 . 20 1 1 A 99 99 LYS C C 99 174.750 174.371 0.379 1 1 892 . 20 1 1 A 99 99 LYS CA C 99 55.990 54.912 1.078 1 1 893 . 20 1 1 A 99 99 LYS CB C 99 37.840 35.541 2.299 1 1 897 . 20 1 1 A 99 99 LYS N N 99 118.050 114.904 3.146 1 1 898 . 20 1 1 A 100 100 VAL H H 100 8.980 8.321 0.659 1 1 899 . 20 1 1 A 100 100 VAL HA H 100 4.510 4.738 -0.228 1 1 907 . 20 1 1 A 100 100 VAL C C 100 174.760 173.711 1.049 1 1 908 . 20 1 1 A 100 100 VAL CA C 100 60.130 59.027 1.103 1 1 909 . 20 1 1 A 100 100 VAL CB C 100 35.240 35.742 -0.502 1 1 912 . 20 1 1 A 100 100 VAL N N 100 123.850 119.544 4.306 1 1 913 . 20 1 1 A 101 101 ARG H H 101 8.810 8.135 0.675 1 1 914 . 20 1 1 A 101 101 ARG HA H 101 4.850 4.642 0.208 1 1 921 . 20 1 1 A 101 101 ARG C C 101 174.770 174.428 0.342 1 1 922 . 20 1 1 A 101 101 ARG CA C 101 54.580 54.996 -0.416 1 1 923 . 20 1 1 A 101 101 ARG CB C 101 32.400 31.323 1.077 1 1 926 . 20 1 1 A 101 101 ARG N N 101 129.210 123.685 5.525 1 1 927 . 20 1 1 A 102 102 VAL H H 102 9.100 8.207 0.893 1 1 928 . 20 1 1 A 102 102 VAL HA H 102 4.120 4.786 -0.666 1 1 936 . 20 1 1 A 102 102 VAL C C 102 171.640 173.496 -1.856 1 1 937 . 20 1 1 A 102 102 VAL CA C 102 61.350 59.293 2.057 1 1 938 . 20 1 1 A 102 102 VAL CB C 102 32.530 34.778 -2.248 1 1 941 . 20 1 1 A 102 102 VAL N N 102 130.470 122.910 7.560 1 1 942 . 20 1 1 A 103 103 LEU H H 103 8.110 9.626 -1.516 1 1 943 . 20 1 1 A 103 103 LEU HA H 103 5.120 4.950 0.170 1 1 953 . 20 1 1 A 103 103 LEU C C 103 176.410 175.650 0.760 1 1 954 . 20 1 1 A 103 103 LEU CA C 103 53.380 53.485 -0.105 1 1 955 . 20 1 1 A 103 103 LEU CB C 103 43.680 43.100 0.580 1 1 959 . 20 1 1 A 103 103 LEU N N 103 125.560 128.881 -3.321 1 1 960 . 20 1 1 A 104 104 VAL H H 104 9.580 9.022 0.558 1 1 961 . 20 1 1 A 104 104 VAL HA H 104 5.260 5.283 -0.023 1 1 969 . 20 1 1 A 104 104 VAL C C 104 176.030 174.814 1.216 1 1 970 . 20 1 1 A 104 104 VAL CA C 104 60.220 61.255 -1.035 1 1 971 . 20 1 1 A 104 104 VAL CB C 104 34.310 33.819 0.491 1 1 974 . 20 1 1 A 104 104 VAL N N 104 125.790 127.068 -1.278 1 1 975 . 20 1 1 A 105 105 SER H H 105 9.340 8.899 0.441 1 1 976 . 20 1 1 A 105 105 SER HA H 105 5.300 5.127 0.173 1 1 979 . 20 1 1 A 105 105 SER C C 105 173.600 172.884 0.716 1 1 980 . 20 1 1 A 105 105 SER CA C 105 57.450 57.409 0.041 1 1 981 . 20 1 1 A 105 105 SER CB C 105 65.600 66.815 -1.215 1 1 982 . 20 1 1 A 105 105 SER N N 105 119.220 119.796 -0.576 1 1 983 . 20 1 1 A 106 106 SER H H 106 8.350 8.598 -0.248 1 1 984 . 20 1 1 A 106 106 SER HA H 106 4.720 4.948 -0.228 1 1 987 . 20 1 1 A 106 106 SER C C 106 176.930 173.601 3.329 1 1 988 . 20 1 1 A 106 106 SER CA C 106 58.170 57.349 0.821 1 1 989 . 20 1 1 A 106 106 SER CB C 106 64.170 63.451 0.719 1 1 990 . 20 1 1 A 106 106 SER N N 106 114.800 117.175 -2.375 1 1 991 . 20 1 1 A 107 107 LEU H H 107 8.770 8.522 0.248 1 1 992 . 20 1 1 A 107 107 LEU HA H 107 4.710 4.663 0.047 1 1 1001 . 20 1 1 A 107 107 LEU C C 107 178.280 177.176 1.104 1 1 1002 . 20 1 1 A 107 107 LEU CA C 107 55.280 54.196 1.084 1 1 1003 . 20 1 1 A 107 107 LEU CB C 107 43.410 42.377 1.033 1 1 1007 . 20 1 1 A 107 107 LEU N N 107 127.210 129.366 -2.156 1 1 1008 . 20 1 1 A 108 108 THR H H 108 8.210 7.819 0.391 1 1 1009 . 20 1 1 A 108 108 THR HA H 108 4.400 4.581 -0.181 1 1 1015 . 20 1 1 A 108 108 THR C C 108 176.130 175.652 0.478 1 1 1016 . 20 1 1 A 108 108 THR CA C 108 62.050 62.373 -0.323 1 1 1017 . 20 1 1 A 108 108 THR CB C 108 70.910 70.976 -0.066 1 1 1019 . 20 1 1 A 108 108 THR N N 108 108.810 111.710 -2.900 1 1 1020 . 20 1 1 A 109 109 GLY H H 109 8.250 8.061 0.189 1 1 1021 . 20 1 1 A 109 109 GLY HA2 H 109 3.780 4.065 -0.285 1 1 1022 . 20 1 1 A 109 109 GLY HA3 H 109 4.290 4.083 0.207 1 1 1023 . 20 1 1 A 109 109 GLY C C 109 173.180 174.215 -1.035 1 1 1024 . 20 1 1 A 109 109 GLY CA C 109 45.340 45.326 0.014 1 1 1025 . 20 1 1 A 109 109 GLY N N 109 110.160 110.730 -0.570 1 1 1026 . 20 1 1 A 110 110 GLU H H 110 7.960 7.570 0.390 1 1 1027 . 20 1 1 A 110 110 GLU HA H 110 4.760 4.876 -0.116 1 1 1032 . 20 1 1 A 110 110 GLU CA C 110 53.450 54.005 -0.555 1 1 1033 . 20 1 1 A 110 110 GLU CB C 110 30.020 31.091 -1.071 1 1 1035 . 20 1 1 A 110 110 GLU N N 110 119.720 117.762 1.958 1 1 1036 . 20 1 1 A 111 111 PRO HA H 111 3.250 4.088 -0.838 1 1 1043 . 20 1 1 A 111 111 PRO C C 111 176.710 176.170 0.540 1 1 1044 . 20 1 1 A 111 111 PRO CA C 111 62.240 62.190 0.050 1 1 1045 . 20 1 1 A 111 111 PRO CB C 111 31.990 32.392 -0.402 1 1 1048 . 20 1 1 A 112 112 LEU H H 112 8.840 7.837 1.003 1 1 1049 . 20 1 1 A 112 112 LEU HA H 112 4.290 4.205 0.085 1 1 1059 . 20 1 1 A 112 112 LEU CA C 112 52.220 53.610 -1.390 1 1 1060 . 20 1 1 A 112 112 LEU CB C 112 41.090 41.653 -0.563 1 1 1063 . 20 1 1 A 112 112 LEU N N 112 122.420 122.090 0.330 1 1 1064 . 20 1 1 A 113 113 PRO HA H 113 4.380 4.252 0.128 1 1 1071 . 20 1 1 A 113 113 PRO C C 113 176.100 177.502 -1.402 1 1 1072 . 20 1 1 A 113 113 PRO CA C 113 61.930 64.803 -2.873 1 1 1073 . 20 1 1 A 113 113 PRO CB C 113 32.470 31.765 0.705 1 1 1076 . 20 1 1 A 114 114 ALA H H 114 8.070 7.818 0.252 1 1 1077 . 20 1 1 A 114 114 ALA HA H 114 4.550 3.964 0.586 1 1 1081 . 20 1 1 A 114 114 ALA C C 114 177.490 177.502 -0.012 1 1 1082 . 20 1 1 A 114 114 ALA CA C 114 51.340 53.849 -2.509 1 1 1083 . 20 1 1 A 114 114 ALA CB C 114 19.940 18.153 1.787 1 1 1084 . 20 1 1 A 114 114 ALA N N 114 121.460 121.096 0.364 1 1 1085 . 20 1 1 A 115 115 LYS H H 115 9.000 8.611 0.389 1 1 1086 . 20 1 1 A 115 115 LYS HA H 115 3.930 3.885 0.045 1 1 1095 . 20 1 1 A 115 115 LYS C C 115 175.740 175.081 0.659 1 1 1096 . 20 1 1 A 115 115 LYS CA C 115 57.580 57.728 -0.148 1 1 1097 . 20 1 1 A 115 115 LYS CB C 115 29.510 30.523 -1.013 1 1 1101 . 20 1 1 A 115 115 LYS N N 115 112.560 115.198 -2.638 1 1 1102 . 20 1 1 A 116 116 GLU H H 116 7.620 7.635 -0.015 1 1 1103 . 20 1 1 A 116 116 GLU HA H 116 4.550 4.915 -0.365 1 1 1108 . 20 1 1 A 116 116 GLU C C 116 176.110 175.138 0.972 1 1 1109 . 20 1 1 A 116 116 GLU CA C 116 54.570 54.357 0.213 1 1 1110 . 20 1 1 A 116 116 GLU CB C 116 33.680 33.465 0.215 1 1 1112 . 20 1 1 A 116 116 GLU N N 116 115.710 117.747 -2.037 1 1 1113 . 20 1 1 A 117 117 VAL H H 117 8.770 8.815 -0.045 1 1 1114 . 20 1 1 A 117 117 VAL HA H 117 3.200 4.032 -0.832 1 1 1122 . 20 1 1 A 117 117 VAL C C 117 175.740 175.779 -0.039 1 1 1123 . 20 1 1 A 117 117 VAL CA C 117 65.340 63.065 2.275 1 1 1124 . 20 1 1 A 117 117 VAL CB C 117 31.290 30.971 0.319 1 1 1127 . 20 1 1 A 117 117 VAL N N 117 124.450 120.276 4.174 1 1 1128 . 20 1 1 A 118 118 LEU H H 118 8.550 9.081 -0.531 1 1 1129 . 20 1 1 A 118 118 LEU HA H 118 4.540 4.529 0.011 1 1 1139 . 20 1 1 A 118 118 LEU C C 118 176.210 176.259 -0.049 1 1 1140 . 20 1 1 A 118 118 LEU CA C 118 55.510 55.827 -0.317 1 1 1141 . 20 1 1 A 118 118 LEU CB C 118 44.600 43.120 1.480 1 1 1145 . 20 1 1 A 118 118 LEU N N 118 128.440 128.753 -0.313 1 1 1146 . 20 1 1 A 119 119 ALA H H 119 7.970 7.555 0.415 1 1 1147 . 20 1 1 A 119 119 ALA HA H 119 4.740 4.893 -0.153 1 1 1151 . 20 1 1 A 119 119 ALA C C 119 174.570 175.466 -0.896 1 1 1152 . 20 1 1 A 119 119 ALA CA C 119 50.770 51.849 -1.079 1 1 1153 . 20 1 1 A 119 119 ALA CB C 119 22.450 22.342 0.108 1 1 1154 . 20 1 1 A 119 119 ALA N N 119 118.100 118.584 -0.484 1 1 1155 . 20 1 1 A 120 120 LYS H H 120 8.760 9.054 -0.294 1 1 1156 . 20 1 1 A 120 120 LYS HA H 120 5.240 5.575 -0.335 1 1 1165 . 20 1 1 A 120 120 LYS C C 120 175.340 174.811 0.529 1 1 1166 . 20 1 1 A 120 120 LYS CA C 120 54.220 54.581 -0.361 1 1 1167 . 20 1 1 A 120 120 LYS CB C 120 34.340 35.676 -1.336 1 1 1171 . 20 1 1 A 120 120 LYS N N 120 120.010 120.680 -0.670 1 1 1172 . 20 1 1 A 121 121 VAL H H 121 9.410 8.744 0.666 1 1 1173 . 20 1 1 A 121 121 VAL HA H 121 4.230 4.833 -0.603 1 1 1181 . 20 1 1 A 121 121 VAL C C 121 173.980 174.506 -0.526 1 1 1182 . 20 1 1 A 121 121 VAL CA C 121 62.370 60.417 1.953 1 1 1183 . 20 1 1 A 121 121 VAL CB C 121 32.410 34.219 -1.809 1 1 1186 . 20 1 1 A 121 121 VAL N N 121 124.960 123.660 1.300 1 1 1187 . 20 1 1 A 122 122 VAL H H 122 9.280 8.722 0.558 1 1 1188 . 20 1 1 A 122 122 VAL HA H 122 4.360 4.995 -0.635 1 1 1196 . 20 1 1 A 122 122 VAL C C 122 174.190 174.757 -0.567 1 1 1197 . 20 1 1 A 122 122 VAL CA C 122 62.760 61.074 1.686 1 1 1198 . 20 1 1 A 122 122 VAL CB C 122 32.020 33.053 -1.033 1 1 1201 . 20 1 1 A 122 122 VAL N N 122 128.990 126.224 2.766 1 1 1202 . 20 1 1 A 123 123 LEU H H 123 8.610 8.725 -0.115 1 1 1203 . 20 1 1 A 123 123 LEU HA H 123 4.900 4.778 0.122 1 1 1213 . 20 1 1 A 123 123 LEU C C 123 174.950 176.445 -1.495 1 1 1214 . 20 1 1 A 123 123 LEU CA C 123 52.050 53.538 -1.488 1 1 1215 . 20 1 1 A 123 123 LEU CB C 123 45.210 42.093 3.117 1 1 1219 . 20 1 1 A 123 123 LEU N N 123 127.200 128.071 -0.871 1 1 1220 . 20 1 1 A 124 124 ARG H H 124 9.540 8.891 0.649 1 1 1221 . 20 1 1 A 124 124 ARG HA H 124 4.900 4.319 0.581 1 1 1229 . 20 1 1 A 124 124 ARG C C 124 176.320 175.791 0.529 1 1 1230 . 20 1 1 A 124 124 ARG CA C 124 55.320 57.165 -1.845 1 1 1231 . 20 1 1 A 124 124 ARG CB C 124 31.750 30.581 1.169 1 1 1234 . 20 1 1 A 124 124 ARG N N 124 124.290 125.915 -1.625 1 1 1236 . 20 1 1 A 125 125 ALA H H 125 8.880 8.818 0.062 1 1 1237 . 20 1 1 A 125 125 ALA HA H 125 4.380 4.346 0.034 1 1 1241 . 20 1 1 A 125 125 ALA C C 125 177.290 177.715 -0.425 1 1 1242 . 20 1 1 A 125 125 ALA CA C 125 52.530 51.608 0.922 1 1 1243 . 20 1 1 A 125 125 ALA CB C 125 19.870 17.329 2.541 1 1 1244 . 20 1 1 A 125 125 ALA N N 125 130.790 129.952 0.838 1 1 1245 . 20 1 1 A 126 126 GLU H H 126 9.260 8.618 0.642 1 1 1246 . 20 1 1 A 126 126 GLU HA H 126 4.460 4.389 0.071 1 1 1251 . 20 1 1 A 126 126 GLU C C 126 176.120 176.125 -0.005 1 1 1252 . 20 1 1 A 126 126 GLU CA C 126 56.940 57.063 -0.123 1 1 1253 . 20 1 1 A 126 126 GLU CB C 126 32.450 30.200 2.250 1 1 1255 . 20 1 1 A 126 126 GLU N N 126 125.740 123.173 2.567 1 1 1256 . 20 1 1 A 127 127 ALA H H 127 7.460 7.542 -0.082 1 1 1257 . 20 1 1 A 127 127 ALA HA H 127 4.360 4.617 -0.257 1 1 1261 . 20 1 1 A 127 127 ALA C C 127 173.400 175.807 -2.407 1 1 1262 . 20 1 1 A 127 127 ALA CA C 127 51.360 51.711 -0.351 1 1 1263 . 20 1 1 A 127 127 ALA CB C 127 22.180 22.082 0.098 1 1 1264 . 20 1 1 A 127 127 ALA N N 127 120.910 119.681 1.229 1 1 1265 . 20 1 1 A 128 128 LYS H H 128 7.940 8.695 -0.755 1 1 1266 . 20 1 1 A 128 128 LYS HA H 128 3.580 4.110 -0.530 1 1 1275 . 20 1 1 A 128 128 LYS C C 128 176.080 175.667 0.413 1 1 1276 . 20 1 1 A 128 128 LYS CA C 128 56.860 56.934 -0.074 1 1 1277 . 20 1 1 A 128 128 LYS CB C 128 33.170 33.139 0.031 1 1 1281 . 20 1 1 A 128 128 LYS N N 128 116.520 124.593 -8.073 1 1 1282 . 20 1 1 A 129 129 ALA H H 129 8.590 8.646 -0.056 1 1 1283 . 20 1 1 A 129 129 ALA HA H 129 4.390 4.610 -0.220 1 1 1287 . 20 1 1 A 129 129 ALA C C 129 174.970 175.437 -0.467 1 1 1288 . 20 1 1 A 129 129 ALA CA C 129 52.970 51.363 1.607 1 1 1289 . 20 1 1 A 129 129 ALA CB C 129 21.500 18.745 2.755 1 1 1290 . 20 1 1 A 129 129 ALA N N 129 124.710 127.713 -3.003 1 1 1291 . 20 1 1 A 130 130 GLU H H 130 8.660 8.164 0.496 1 1 1292 . 20 1 1 A 130 130 GLU HA H 130 4.660 4.176 0.484 1 1 1297 . 20 1 1 A 130 130 GLU C C 130 177.390 177.074 0.316 1 1 1298 . 20 1 1 A 130 130 GLU CA C 130 55.070 57.596 -2.526 1 1 1299 . 20 1 1 A 130 130 GLU CB C 130 30.860 29.167 1.693 1 1 1301 . 20 1 1 A 130 130 GLU N N 130 123.180 118.209 4.971 1 1 1302 . 20 1 1 A 131 131 GLY H H 131 9.170 9.087 0.083 1 1 1303 . 20 1 1 A 131 131 GLY HA2 H 131 3.560 3.982 -0.422 1 1 1304 . 20 1 1 A 131 131 GLY HA3 H 131 3.750 3.994 -0.244 1 1 1305 . 20 1 1 A 131 131 GLY C C 131 174.550 174.668 -0.118 1 1 1306 . 20 1 1 A 131 131 GLY CA C 131 47.660 45.788 1.872 1 1 1307 . 20 1 1 A 131 131 GLY N N 131 115.530 113.386 2.144 1 1 1308 . 20 1 1 A 132 132 SER H H 132 8.430 8.053 0.377 1 1 1309 . 20 1 1 A 132 132 SER HA H 132 4.170 4.609 -0.439 1 1 1312 . 20 1 1 A 132 132 SER C C 132 175.350 174.390 0.960 1 1 1313 . 20 1 1 A 132 132 SER CA C 132 59.050 57.914 1.136 1 1 1314 . 20 1 1 A 132 132 SER CB C 132 64.880 62.029 2.851 1 1 1315 . 20 1 1 A 132 132 SER N N 132 115.930 118.487 -2.557 1 1 1316 . 20 1 1 A 133 133 ASN H H 133 8.850 9.203 -0.353 1 1 1317 . 20 1 1 A 133 133 ASN HA H 133 4.910 4.716 0.194 1 1 1322 . 20 1 1 A 133 133 ASN C C 133 175.450 174.516 0.934 1 1 1323 . 20 1 1 A 133 133 ASN CA C 133 54.920 54.075 0.845 1 1 1324 . 20 1 1 A 133 133 ASN CB C 133 41.060 38.832 2.228 1 1 1325 . 20 1 1 A 133 133 ASN N N 133 125.590 123.862 1.728 1 1 1327 . 20 1 1 A 134 134 LEU H H 134 9.070 10.015 -0.945 1 1 1328 . 20 1 1 A 134 134 LEU HA H 134 5.230 5.361 -0.131 1 1 1338 . 20 1 1 A 134 134 LEU C C 134 175.240 175.502 -0.262 1 1 1339 . 20 1 1 A 134 134 LEU CA C 134 53.470 53.289 0.181 1 1 1340 . 20 1 1 A 134 134 LEU CB C 134 45.090 45.963 -0.873 1 1 1344 . 20 1 1 A 134 134 LEU N N 134 129.210 127.694 1.516 1 1 1345 . 20 1 1 A 135 135 SER H H 135 8.690 8.275 0.415 1 1 1346 . 20 1 1 A 135 135 SER HA H 135 5.280 5.143 0.137 1 1 1349 . 20 1 1 A 135 135 SER C C 135 173.590 172.782 0.808 1 1 1350 . 20 1 1 A 135 135 SER CA C 135 56.220 57.305 -1.085 1 1 1351 . 20 1 1 A 135 135 SER CB C 135 66.510 66.309 0.201 1 1 1352 . 20 1 1 A 135 135 SER N N 135 113.020 115.243 -2.223 1 1 1353 . 20 1 1 A 136 136 VAL H H 136 8.940 8.302 0.638 1 1 1354 . 20 1 1 A 136 136 VAL HA H 136 5.500 4.622 0.878 1 1 1362 . 20 1 1 A 136 136 VAL C C 136 175.730 175.760 -0.030 1 1 1363 . 20 1 1 A 136 136 VAL CA C 136 60.960 61.717 -0.757 1 1 1364 . 20 1 1 A 136 136 VAL CB C 136 33.630 33.137 0.493 1 1 1367 . 20 1 1 A 136 136 VAL N N 136 124.340 121.807 2.533 1 1 1368 . 20 1 1 A 137 137 THR H H 137 9.240 8.619 0.621 1 1 1369 . 20 1 1 A 137 137 THR HA H 137 4.920 4.812 0.108 1 1 1374 . 20 1 1 A 137 137 THR C C 137 173.500 174.528 -1.028 1 1 1375 . 20 1 1 A 137 137 THR CA C 137 59.120 60.289 -1.169 1 1 1376 . 20 1 1 A 137 137 THR CB C 137 72.500 70.722 1.778 1 1 1378 . 20 1 1 A 137 137 THR N N 137 117.010 118.783 -1.773 1 1 1379 . 20 1 1 A 138 138 ASN H H 138 9.190 8.755 0.435 1 1 1380 . 20 1 1 A 138 138 ASN HA H 138 4.420 4.390 0.030 1 1 1385 . 20 1 1 A 138 138 ASN C C 138 175.550 174.504 1.046 1 1 1386 . 20 1 1 A 138 138 ASN CA C 138 54.350 53.922 0.428 1 1 1387 . 20 1 1 A 138 138 ASN CB C 138 37.380 36.383 0.997 1 1 1388 . 20 1 1 A 138 138 ASN N N 138 115.270 120.627 -5.357 1 1 1390 . 20 1 1 A 139 139 SER H H 139 8.560 7.911 0.649 1 1 1391 . 20 1 1 A 139 139 SER HA H 139 5.800 4.380 1.420 1 1 1394 . 20 1 1 A 139 139 SER C C 139 175.750 173.947 1.803 1 1 1395 . 20 1 1 A 139 139 SER CA C 139 56.020 59.709 -3.689 1 1 1396 . 20 1 1 A 139 139 SER CB C 139 65.320 63.676 1.644 1 1 1397 . 20 1 1 A 139 139 SER N N 139 112.360 115.684 -3.324 1 1 1398 . 20 1 1 A 140 140 SER H H 140 9.900 8.734 1.166 1 1 1399 . 20 1 1 A 140 140 SER HA H 140 5.360 5.286 0.074 1 1 1402 . 20 1 1 A 140 140 SER C C 140 172.620 173.363 -0.743 1 1 1403 . 20 1 1 A 140 140 SER CA C 140 57.400 57.064 0.336 1 1 1404 . 20 1 1 A 140 140 SER CB C 140 66.550 65.920 0.630 1 1 1405 . 20 1 1 A 140 140 SER N N 140 119.130 124.156 -5.026 1 1 1406 . 20 1 1 A 141 141 VAL H H 141 9.030 8.770 0.260 1 1 1407 . 20 1 1 A 141 141 VAL HA H 141 5.520 4.981 0.539 1 1 1415 . 20 1 1 A 141 141 VAL C C 141 174.750 174.537 0.213 1 1 1416 . 20 1 1 A 141 141 VAL CA C 141 58.310 59.923 -1.613 1 1 1417 . 20 1 1 A 141 141 VAL CB C 141 35.030 35.632 -0.602 1 1 1420 . 20 1 1 A 141 141 VAL N N 141 111.410 117.403 -5.993 1 1 1421 . 20 1 1 A 142 142 GLY H H 142 8.790 9.119 -0.329 1 1 1422 . 20 1 1 A 142 142 GLY HA2 H 142 3.600 4.043 -0.443 1 1 1423 . 20 1 1 A 142 142 GLY HA3 H 142 5.310 4.060 1.250 1 1 1424 . 20 1 1 A 142 142 GLY C C 142 174.180 173.597 0.583 1 1 1425 . 20 1 1 A 142 142 GLY CA C 142 44.110 46.046 -1.936 1 1 1426 . 20 1 1 A 142 142 GLY N N 142 109.330 111.201 -1.871 1 1 1427 . 20 1 1 A 143 143 ASP H H 143 8.840 8.693 0.147 1 1 1428 . 20 1 1 A 143 143 ASP HA H 143 5.790 5.082 0.708 1 1 1431 . 20 1 1 A 143 143 ASP C C 143 178.860 178.110 0.750 1 1 1432 . 20 1 1 A 143 143 ASP CA C 143 53.040 54.747 -1.707 1 1 1433 . 20 1 1 A 143 143 ASP CB C 143 43.660 42.587 1.073 1 1 1434 . 20 1 1 A 143 143 ASP N N 143 125.390 126.317 -0.927 1 1 1435 . 20 1 1 A 144 144 GLY H H 144 9.150 8.852 0.298 1 1 1436 . 20 1 1 A 144 144 GLY HA2 H 144 3.450 3.967 -0.517 1 1 1437 . 20 1 1 A 144 144 GLY HA3 H 144 3.720 4.102 -0.382 1 1 1438 . 20 1 1 A 144 144 GLY C C 144 174.770 176.258 -1.488 1 1 1439 . 20 1 1 A 144 144 GLY CA C 144 46.930 47.140 -0.210 1 1 1440 . 20 1 1 A 144 144 GLY N N 144 106.470 110.233 -3.763 1 1 1441 . 20 1 1 A 145 145 GLU H H 145 8.470 7.847 0.623 1 1 1442 . 20 1 1 A 145 145 GLU HA H 145 4.460 4.142 0.318 1 1 1447 . 20 1 1 A 145 145 GLU C C 145 176.520 176.369 0.151 1 1 1448 . 20 1 1 A 145 145 GLU CA C 145 55.330 58.066 -2.736 1 1 1449 . 20 1 1 A 145 145 GLU CB C 145 30.620 30.170 0.450 1 1 1451 . 20 1 1 A 145 145 GLU N N 145 119.170 120.455 -1.285 1 1 1452 . 20 1 1 A 146 146 GLY H H 146 7.950 7.820 0.130 1 1 1453 . 20 1 1 A 146 146 GLY HA2 H 146 3.630 4.017 -0.387 1 1 1454 . 20 1 1 A 146 146 GLY HA3 H 146 4.130 4.024 0.106 1 1 1455 . 20 1 1 A 146 146 GLY C C 146 174.350 174.807 -0.457 1 1 1456 . 20 1 1 A 146 146 GLY CA C 146 45.330 45.417 -0.087 1 1 1457 . 20 1 1 A 146 146 GLY N N 146 108.130 106.968 1.162 1 1 1458 . 20 1 1 A 147 147 LEU H H 147 8.440 7.907 0.533 1 1 1459 . 20 1 1 A 147 147 LEU HA H 147 4.340 4.435 -0.095 1 1 1469 . 20 1 1 A 147 147 LEU C C 147 175.950 175.838 0.112 1 1 1470 . 20 1 1 A 147 147 LEU CA C 147 54.860 54.652 0.208 1 1 1471 . 20 1 1 A 147 147 LEU CB C 147 41.590 42.316 -0.726 1 1 1475 . 20 1 1 A 147 147 LEU N N 147 124.000 122.334 1.666 1 1 1476 . 20 1 1 A 148 148 VAL H H 148 7.780 8.622 -0.842 1 1 1477 . 20 1 1 A 148 148 VAL HA H 148 4.830 5.325 -0.495 1 1 1485 . 20 1 1 A 148 148 VAL C C 148 175.740 174.048 1.692 1 1 1486 . 20 1 1 A 148 148 VAL CA C 148 61.140 60.181 0.959 1 1 1487 . 20 1 1 A 148 148 VAL CB C 148 33.640 34.605 -0.965 1 1 1490 . 20 1 1 A 148 148 VAL N N 148 120.440 120.922 -0.482 1 1 1491 . 20 1 1 A 149 149 HIS H H 149 9.170 8.592 0.578 1 1 1492 . 20 1 1 A 149 149 HIS HA H 149 4.950 4.841 0.109 1 1 1496 . 20 1 1 A 149 149 HIS C C 149 174.780 174.875 -0.095 1 1 1497 . 20 1 1 A 149 149 HIS CA C 149 53.900 55.263 -1.363 1 1 1498 . 20 1 1 A 149 149 HIS CB C 149 32.200 28.646 3.554 1 1 1499 . 20 1 1 A 149 149 HIS N N 149 124.700 128.710 -4.010 1 1 1500 . 20 1 1 A 150 150 GLU H H 150 9.060 8.616 0.444 1 1 1501 . 20 1 1 A 150 150 GLU HA H 150 4.420 4.273 0.147 1 1 1506 . 20 1 1 A 150 150 GLU C C 150 176.520 176.612 -0.092 1 1 1507 . 20 1 1 A 150 150 GLU CA C 150 57.630 56.832 0.798 1 1 1508 . 20 1 1 A 150 150 GLU CB C 150 30.370 29.797 0.573 1 1 1510 . 20 1 1 A 150 150 GLU N N 150 125.540 123.811 1.729 1 1 1511 . 20 1 1 A 151 151 ILE H H 151 8.150 8.181 -0.031 1 1 1512 . 20 1 1 A 151 151 ILE HA H 151 4.780 4.462 0.318 1 1 1522 . 20 1 1 A 151 151 ILE C C 151 174.570 176.229 -1.659 1 1 1523 . 20 1 1 A 151 151 ILE CA C 151 59.390 59.755 -0.365 1 1 1524 . 20 1 1 A 151 151 ILE CB C 151 42.040 39.979 2.061 1 1 1528 . 20 1 1 A 151 151 ILE N N 151 115.880 122.025 -6.145 1 1 1529 . 20 1 1 A 152 152 ALA H H 152 8.010 8.693 -0.683 1 1 1530 . 20 1 1 A 152 152 ALA HA H 152 4.310 4.410 -0.100 1 1 1534 . 20 1 1 A 152 152 ALA C C 152 177.500 176.801 0.699 1 1 1535 . 20 1 1 A 152 152 ALA CA C 152 53.680 51.720 1.960 1 1 1536 . 20 1 1 A 152 152 ALA CB C 152 20.050 19.646 0.404 1 1 1537 . 20 1 1 A 152 152 ALA N N 152 126.640 124.771 1.869 1 1 1538 . 20 1 1 A 153 153 GLY H H 153 8.340 8.326 0.014 1 1 1539 . 20 1 1 A 153 153 GLY HA2 H 153 4.050 4.362 -0.312 1 1 1540 . 20 1 1 A 153 153 GLY HA3 H 153 4.140 4.364 -0.224 1 1 1541 . 20 1 1 A 153 153 GLY C C 153 173.140 171.485 1.655 1 1 1542 . 20 1 1 A 153 153 GLY CA C 153 44.130 46.364 -2.234 1 1 1543 . 20 1 1 A 153 153 GLY N N 153 107.490 105.495 1.995 1 1 1544 . 20 1 1 A 154 154 THR H H 154 7.380 8.355 -0.975 1 1 1545 . 20 1 1 A 154 154 THR HA H 154 4.700 5.104 -0.404 1 1 1550 . 20 1 1 A 154 154 THR C C 154 171.120 172.826 -1.706 1 1 1551 . 20 1 1 A 154 154 THR CA C 154 60.830 61.051 -0.221 1 1 1552 . 20 1 1 A 154 154 THR CB C 154 68.850 72.371 -3.521 1 1 1554 . 20 1 1 A 154 154 THR N N 154 109.340 113.857 -4.517 1 1 1555 . 20 1 1 A 155 155 GLU H H 155 8.020 8.876 -0.856 1 1 1556 . 20 1 1 A 155 155 GLU HA H 155 5.370 5.092 0.278 1 1 1561 . 20 1 1 A 155 155 GLU C C 155 174.240 174.961 -0.721 1 1 1562 . 20 1 1 A 155 155 GLU CA C 155 54.830 55.061 -0.231 1 1 1563 . 20 1 1 A 155 155 GLU CB C 155 33.620 32.357 1.263 1 1 1565 . 20 1 1 A 155 155 GLU N N 155 118.690 126.239 -7.549 1 1 1566 . 20 1 1 A 156 156 LYS H H 156 9.230 9.255 -0.025 1 1 1567 . 20 1 1 A 156 156 LYS HA H 156 4.650 4.833 -0.183 1 1 1576 . 20 1 1 A 156 156 LYS C C 156 174.000 174.375 -0.375 1 1 1577 . 20 1 1 A 156 156 LYS CA C 156 55.840 55.420 0.420 1 1 1578 . 20 1 1 A 156 156 LYS CB C 156 37.550 36.498 1.052 1 1 1582 . 20 1 1 A 156 156 LYS N N 156 121.940 124.508 -2.568 1 1 1583 . 20 1 1 A 157 157 THR H H 157 8.160 8.620 -0.460 1 1 1584 . 20 1 1 A 157 157 THR HA H 157 5.440 5.318 0.122 1 1 1589 . 20 1 1 A 157 157 THR C C 157 174.360 173.235 1.125 1 1 1590 . 20 1 1 A 157 157 THR CA C 157 60.410 59.995 0.415 1 1 1591 . 20 1 1 A 157 157 THR CB C 157 71.500 72.494 -0.994 1 1 1593 . 20 1 1 A 157 157 THR N N 157 113.240 112.996 0.244 1 1 1594 . 20 1 1 A 158 158 VAL H H 158 9.120 8.902 0.218 1 1 1595 . 20 1 1 A 158 158 VAL HA H 158 4.580 4.966 -0.386 1 1 1603 . 20 1 1 A 158 158 VAL C C 158 172.800 174.212 -1.412 1 1 1604 . 20 1 1 A 158 158 VAL CA C 158 59.980 59.712 0.268 1 1 1605 . 20 1 1 A 158 158 VAL CB C 158 36.290 35.593 0.697 1 1 1608 . 20 1 1 A 158 158 VAL N N 158 121.710 118.148 3.562 1 1 1609 . 20 1 1 A 159 159 ASN H H 159 8.240 8.598 -0.358 1 1 1610 . 20 1 1 A 159 159 ASN HA H 159 5.420 5.159 0.261 1 1 1615 . 20 1 1 A 159 159 ASN C C 159 173.800 174.198 -0.398 1 1 1616 . 20 1 1 A 159 159 ASN CA C 159 51.740 52.487 -0.747 1 1 1617 . 20 1 1 A 159 159 ASN CB C 159 40.380 39.785 0.595 1 1 1618 . 20 1 1 A 159 159 ASN N N 159 122.730 122.822 -0.092 1 1 1620 . 20 1 1 A 160 160 ILE H H 160 9.160 8.834 0.326 1 1 1621 . 20 1 1 A 160 160 ILE HA H 160 5.130 5.348 -0.218 1 1 1631 . 20 1 1 A 160 160 ILE C C 160 177.320 175.605 1.715 1 1 1632 . 20 1 1 A 160 160 ILE CA C 160 60.640 60.419 0.221 1 1 1633 . 20 1 1 A 160 160 ILE CB C 160 38.520 37.594 0.926 1 1 1637 . 20 1 1 A 160 160 ILE N N 160 123.690 125.492 -1.802 1 1 1638 . 20 1 1 A 161 161 ILE H H 161 8.780 9.702 -0.922 1 1 1639 . 20 1 1 A 161 161 ILE HA H 161 4.590 4.582 0.008 1 1 1649 . 20 1 1 A 161 161 ILE C C 161 174.960 175.794 -0.834 1 1 1650 . 20 1 1 A 161 161 ILE CA C 161 59.320 60.335 -1.015 1 1 1651 . 20 1 1 A 161 161 ILE CB C 161 41.030 39.132 1.898 1 1 1655 . 20 1 1 A 161 161 ILE N N 161 122.490 129.079 -6.589 1 1 1656 . 20 1 1 A 162 162 GLU H H 162 8.620 8.668 -0.048 1 1 1657 . 20 1 1 A 162 162 GLU HA H 162 4.290 4.166 0.124 1 1 1662 . 20 1 1 A 162 162 GLU C C 162 176.660 177.478 -0.818 1 1 1663 . 20 1 1 A 162 162 GLU CA C 162 56.470 57.761 -1.291 1 1 1664 . 20 1 1 A 162 162 GLU CB C 162 31.150 30.460 0.690 1 1 1666 . 20 1 1 A 162 162 GLU N N 162 120.520 126.651 -6.131 1 1 1667 . 20 1 1 A 163 163 GLY H H 163 8.480 8.575 -0.095 1 1 1668 . 20 1 1 A 163 163 GLY HA2 H 163 3.910 3.888 0.022 1 1 1669 . 20 1 1 A 163 163 GLY HA3 H 163 4.150 3.889 0.261 1 1 1670 . 20 1 1 A 163 163 GLY C C 163 174.000 175.591 -1.591 1 1 1671 . 20 1 1 A 163 163 GLY CA C 163 45.270 47.062 -1.792 1 1 1672 . 20 1 1 A 163 163 GLY N N 163 110.210 111.207 -0.997 1 1 1673 . 20 1 1 A 164 164 THR H H 164 8.170 8.009 0.161 1 1 1674 . 20 1 1 A 164 164 THR HA H 164 4.410 4.422 -0.012 1 1 1679 . 20 1 1 A 164 164 THR C C 164 174.100 173.474 0.626 1 1 1680 . 20 1 1 A 164 164 THR CA C 164 61.620 60.388 1.232 1 1 1681 . 20 1 1 A 164 164 THR CB C 164 70.060 69.847 0.213 1 1 1683 . 20 1 1 A 164 164 THR N N 164 113.480 117.037 -3.557 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 138 1.215 1 2 1 1 1 "RMS(OBS, PRED)" CA 142 1.217 1 3 1 1 1 "RMS(OBS, PRED)" CB 128 1.588 1 4 1 1 1 "RMS(OBS, PRED)" H 145 0.581 1 5 1 1 1 "RMS(OBS, PRED)" HA 156 0.431 1 6 1 1 1 "RMS(OBS, PRED)" N 145 3.432 1 7 1 2 1 "RMS(OBS, PRED)" C 138 1.309 1 8 1 2 1 "RMS(OBS, PRED)" CA 142 1.362 1 9 1 2 1 "RMS(OBS, PRED)" CB 128 1.542 1 10 1 2 1 "RMS(OBS, PRED)" H 145 0.565 1 11 1 2 1 "RMS(OBS, PRED)" HA 156 0.403 1 12 1 2 1 "RMS(OBS, PRED)" N 145 3.557 1 13 1 3 1 "RMS(OBS, PRED)" C 138 1.279 1 14 1 3 1 "RMS(OBS, PRED)" CA 142 1.250 1 15 1 3 1 "RMS(OBS, PRED)" CB 128 1.565 1 16 1 3 1 "RMS(OBS, PRED)" H 145 0.560 1 17 1 3 1 "RMS(OBS, PRED)" HA 156 0.420 1 18 1 3 1 "RMS(OBS, PRED)" N 145 3.462 1 19 1 4 1 "RMS(OBS, PRED)" C 138 1.238 1 20 1 4 1 "RMS(OBS, PRED)" CA 142 1.354 1 21 1 4 1 "RMS(OBS, PRED)" CB 128 1.722 1 22 1 4 1 "RMS(OBS, PRED)" H 145 0.539 1 23 1 4 1 "RMS(OBS, PRED)" HA 156 0.441 1 24 1 4 1 "RMS(OBS, PRED)" N 145 3.420 1 25 1 5 1 "RMS(OBS, PRED)" C 138 1.204 1 26 1 5 1 "RMS(OBS, PRED)" CA 142 1.311 1 27 1 5 1 "RMS(OBS, PRED)" CB 128 1.660 1 28 1 5 1 "RMS(OBS, PRED)" H 145 0.582 1 29 1 5 1 "RMS(OBS, PRED)" HA 156 0.435 1 30 1 5 1 "RMS(OBS, PRED)" N 145 3.151 1 31 1 6 1 "RMS(OBS, PRED)" C 138 1.250 1 32 1 6 1 "RMS(OBS, PRED)" CA 142 1.342 1 33 1 6 1 "RMS(OBS, PRED)" CB 128 1.614 1 34 1 6 1 "RMS(OBS, PRED)" H 145 0.571 1 35 1 6 1 "RMS(OBS, PRED)" HA 156 0.410 1 36 1 6 1 "RMS(OBS, PRED)" N 145 3.270 1 37 1 7 1 "RMS(OBS, PRED)" C 138 1.318 1 38 1 7 1 "RMS(OBS, PRED)" CA 142 1.260 1 39 1 7 1 "RMS(OBS, PRED)" CB 128 1.598 1 40 1 7 1 "RMS(OBS, PRED)" H 145 0.584 1 41 1 7 1 "RMS(OBS, PRED)" HA 156 0.409 1 42 1 7 1 "RMS(OBS, PRED)" N 145 3.333 1 43 1 8 1 "RMS(OBS, PRED)" C 138 1.306 1 44 1 8 1 "RMS(OBS, PRED)" CA 142 1.291 1 45 1 8 1 "RMS(OBS, PRED)" CB 128 1.580 1 46 1 8 1 "RMS(OBS, PRED)" H 145 0.569 1 47 1 8 1 "RMS(OBS, PRED)" HA 156 0.420 1 48 1 8 1 "RMS(OBS, PRED)" N 145 3.416 1 49 1 9 1 "RMS(OBS, PRED)" C 138 1.268 1 50 1 9 1 "RMS(OBS, PRED)" CA 142 1.313 1 51 1 9 1 "RMS(OBS, PRED)" CB 128 1.660 1 52 1 9 1 "RMS(OBS, PRED)" H 145 0.542 1 53 1 9 1 "RMS(OBS, PRED)" HA 156 0.406 1 54 1 9 1 "RMS(OBS, PRED)" N 145 3.602 1 55 1 10 1 "RMS(OBS, PRED)" C 138 1.226 1 56 1 10 1 "RMS(OBS, PRED)" CA 142 1.317 1 57 1 10 1 "RMS(OBS, PRED)" CB 128 1.621 1 58 1 10 1 "RMS(OBS, PRED)" H 145 0.565 1 59 1 10 1 "RMS(OBS, PRED)" HA 156 0.408 1 60 1 10 1 "RMS(OBS, PRED)" N 145 3.513 1 61 1 11 1 "RMS(OBS, PRED)" C 138 1.200 1 62 1 11 1 "RMS(OBS, PRED)" CA 142 1.329 1 63 1 11 1 "RMS(OBS, PRED)" CB 128 1.519 1 64 1 11 1 "RMS(OBS, PRED)" H 145 0.601 1 65 1 11 1 "RMS(OBS, PRED)" HA 156 0.443 1 66 1 11 1 "RMS(OBS, PRED)" N 145 3.364 1 67 1 12 1 "RMS(OBS, PRED)" C 138 1.197 1 68 1 12 1 "RMS(OBS, PRED)" CA 142 1.351 1 69 1 12 1 "RMS(OBS, PRED)" CB 128 1.622 1 70 1 12 1 "RMS(OBS, PRED)" H 145 0.567 1 71 1 12 1 "RMS(OBS, PRED)" HA 156 0.407 1 72 1 12 1 "RMS(OBS, PRED)" N 145 3.453 1 73 1 13 1 "RMS(OBS, PRED)" C 138 1.255 1 74 1 13 1 "RMS(OBS, PRED)" CA 142 1.310 1 75 1 13 1 "RMS(OBS, PRED)" CB 128 1.612 1 76 1 13 1 "RMS(OBS, PRED)" H 145 0.552 1 77 1 13 1 "RMS(OBS, PRED)" HA 156 0.413 1 78 1 13 1 "RMS(OBS, PRED)" N 145 3.551 1 79 1 14 1 "RMS(OBS, PRED)" C 138 1.265 1 80 1 14 1 "RMS(OBS, PRED)" CA 142 1.331 1 81 1 14 1 "RMS(OBS, PRED)" CB 128 1.628 1 82 1 14 1 "RMS(OBS, PRED)" H 145 0.591 1 83 1 14 1 "RMS(OBS, PRED)" HA 156 0.404 1 84 1 14 1 "RMS(OBS, PRED)" N 145 3.306 1 85 1 15 1 "RMS(OBS, PRED)" C 138 1.262 1 86 1 15 1 "RMS(OBS, PRED)" CA 142 1.314 1 87 1 15 1 "RMS(OBS, PRED)" CB 128 1.608 1 88 1 15 1 "RMS(OBS, PRED)" H 145 0.563 1 89 1 15 1 "RMS(OBS, PRED)" HA 156 0.423 1 90 1 15 1 "RMS(OBS, PRED)" N 145 3.407 1 91 1 16 1 "RMS(OBS, PRED)" C 138 1.257 1 92 1 16 1 "RMS(OBS, PRED)" CA 142 1.310 1 93 1 16 1 "RMS(OBS, PRED)" CB 128 1.605 1 94 1 16 1 "RMS(OBS, PRED)" H 145 0.554 1 95 1 16 1 "RMS(OBS, PRED)" HA 156 0.394 1 96 1 16 1 "RMS(OBS, PRED)" N 145 3.444 1 97 1 17 1 "RMS(OBS, PRED)" C 138 1.253 1 98 1 17 1 "RMS(OBS, PRED)" CA 142 1.266 1 99 1 17 1 "RMS(OBS, PRED)" CB 128 1.635 1 100 1 17 1 "RMS(OBS, PRED)" H 145 0.561 1 101 1 17 1 "RMS(OBS, PRED)" HA 156 0.404 1 102 1 17 1 "RMS(OBS, PRED)" N 145 3.404 1 103 1 18 1 "RMS(OBS, PRED)" C 138 1.278 1 104 1 18 1 "RMS(OBS, PRED)" CA 142 1.343 1 105 1 18 1 "RMS(OBS, PRED)" CB 128 1.678 1 106 1 18 1 "RMS(OBS, PRED)" H 145 0.549 1 107 1 18 1 "RMS(OBS, PRED)" HA 156 0.428 1 108 1 18 1 "RMS(OBS, PRED)" N 145 3.405 1 109 1 19 1 "RMS(OBS, PRED)" C 138 1.280 1 110 1 19 1 "RMS(OBS, PRED)" CA 142 1.337 1 111 1 19 1 "RMS(OBS, PRED)" CB 128 1.649 1 112 1 19 1 "RMS(OBS, PRED)" H 145 0.556 1 113 1 19 1 "RMS(OBS, PRED)" HA 156 0.405 1 114 1 19 1 "RMS(OBS, PRED)" N 145 3.274 1 115 1 20 1 "RMS(OBS, PRED)" C 138 1.253 1 116 1 20 1 "RMS(OBS, PRED)" CA 142 1.322 1 117 1 20 1 "RMS(OBS, PRED)" CB 128 1.673 1 118 1 20 1 "RMS(OBS, PRED)" H 145 0.577 1 119 1 20 1 "RMS(OBS, PRED)" HA 156 0.427 1 120 1 20 1 "RMS(OBS, PRED)" N 145 3.265 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 13 13 GLY H H 13 8.350 8.272 0.078 2 1 2 . 1 1 A 13 13 GLY HA2 H 13 3.920 4.055 -0.135 2 1 3 . 1 1 A 13 13 GLY HA3 H 13 3.920 4.067 -0.147 2 1 4 . 1 1 A 13 13 GLY CA C 13 45.290 45.809 -0.520 2 1 5 . 1 1 A 13 13 GLY N N 13 110.450 109.506 0.944 2 1 6 . 1 1 A 14 14 LEU H H 14 8.050 8.351 -0.301 2 1 7 . 1 1 A 14 14 LEU N N 14 121.500 121.517 -0.017 2 1 8 . 1 1 A 15 15 VAL H H 15 8.070 8.015 0.055 2 1 9 . 1 1 A 15 15 VAL N N 15 122.390 118.609 3.781 2 1 10 . 1 1 A 16 16 PRO HA H 16 4.360 4.377 -0.017 2 1 17 . 1 1 A 16 16 PRO CA C 16 62.770 64.172 -1.402 2 1 18 . 1 1 A 16 16 PRO CB C 16 32.020 31.998 0.022 2 1 21 . 1 1 A 21 21 MET H H 21 8.180 8.380 -0.200 2 1 22 . 1 1 A 21 21 MET N N 21 121.310 119.373 1.937 2 1 23 . 1 1 A 22 22 ALA H H 22 8.290 8.195 0.095 2 1 24 . 1 1 A 22 22 ALA N N 22 124.800 123.545 1.255 2 1 25 . 1 1 A 23 23 SER H H 23 8.210 8.630 -0.420 2 1 26 . 1 1 A 23 23 SER N N 23 114.830 116.294 -1.464 2 1 27 . 1 1 A 24 24 LYS H H 24 8.250 8.314 -0.064 2 1 28 . 1 1 A 24 24 LYS N N 24 122.980 122.130 0.850 2 1 29 . 1 1 A 25 25 LEU H H 25 8.140 8.306 -0.166 2 1 30 . 1 1 A 25 25 LEU HA H 25 4.290 4.593 -0.303 2 1 40 . 1 1 A 25 25 LEU C C 25 177.410 176.342 1.068 2 1 41 . 1 1 A 25 25 LEU CA C 25 55.430 55.004 0.426 2 1 42 . 1 1 A 25 25 LEU CB C 25 42.350 43.621 -1.271 2 1 46 . 1 1 A 25 25 LEU N N 25 122.580 122.389 0.191 2 1 47 . 1 1 A 26 26 LYS H H 26 8.200 8.366 -0.166 2 1 48 . 1 1 A 26 26 LYS HA H 26 4.260 4.439 -0.179 2 1 57 . 1 1 A 26 26 LYS C C 26 176.520 175.841 0.679 2 1 58 . 1 1 A 26 26 LYS CA C 26 56.700 56.642 0.058 2 1 59 . 1 1 A 26 26 LYS CB C 26 33.060 33.419 -0.359 2 1 63 . 1 1 A 26 26 LYS N N 26 121.800 120.447 1.353 2 1 64 . 1 1 A 27 27 GLU H H 27 8.380 8.224 0.156 2 1 65 . 1 1 A 27 27 GLU HA H 27 4.240 4.553 -0.313 2 1 70 . 1 1 A 27 27 GLU C C 27 176.130 175.324 0.806 2 1 71 . 1 1 A 27 27 GLU CA C 27 56.700 56.285 0.415 2 1 72 . 1 1 A 27 27 GLU CB C 27 30.370 31.162 -0.792 2 1 74 . 1 1 A 27 27 GLU N N 27 121.700 119.370 2.330 2 1 75 . 1 1 A 28 28 ALA H H 28 8.230 8.584 -0.354 2 1 76 . 1 1 A 28 28 ALA HA H 28 4.280 4.803 -0.523 2 1 80 . 1 1 A 28 28 ALA C C 28 177.090 176.217 0.873 2 1 81 . 1 1 A 28 28 ALA CA C 28 52.530 51.484 1.046 2 1 82 . 1 1 A 28 28 ALA CB C 28 19.360 21.231 -1.871 2 1 83 . 1 1 A 28 28 ALA N N 28 124.640 122.705 1.935 2 1 84 . 1 1 A 29 29 ALA H H 29 8.150 8.413 -0.263 2 1 85 . 1 1 A 29 29 ALA HA H 29 4.320 4.666 -0.346 2 1 89 . 1 1 A 29 29 ALA C C 29 177.120 176.182 0.938 2 1 90 . 1 1 A 29 29 ALA CA C 29 52.040 52.001 0.039 2 1 91 . 1 1 A 29 29 ALA CB C 29 19.430 18.869 0.561 2 1 92 . 1 1 A 29 29 ALA N N 29 123.430 121.833 1.597 2 1 93 . 1 1 A 30 30 GLU H H 30 8.310 8.394 -0.084 2 1 94 . 1 1 A 30 30 GLU HA H 30 4.220 4.693 -0.473 2 1 99 . 1 1 A 30 30 GLU C C 30 176.310 175.984 0.326 2 1 100 . 1 1 A 30 30 GLU CA C 30 56.630 55.835 0.795 2 1 101 . 1 1 A 30 30 GLU CB C 30 30.320 30.462 -0.142 2 1 103 . 1 1 A 30 30 GLU N N 30 120.630 119.889 0.741 2 1 104 . 1 1 A 31 31 VAL H H 31 8.630 8.819 -0.189 2 1 105 . 1 1 A 31 31 VAL HA H 31 4.430 4.799 -0.369 2 1 113 . 1 1 A 31 31 VAL C C 31 176.510 176.502 0.008 2 1 114 . 1 1 A 31 31 VAL CA C 31 62.360 62.958 -0.598 2 1 115 . 1 1 A 31 31 VAL CB C 31 32.370 31.992 0.378 2 1 118 . 1 1 A 31 31 VAL N N 31 127.110 125.129 1.981 2 1 119 . 1 1 A 32 32 THR H H 32 7.640 8.713 -1.073 2 1 120 . 1 1 A 32 32 THR HA H 32 4.870 3.984 0.886 2 1 125 . 1 1 A 32 32 THR C C 32 172.220 174.765 -2.545 2 1 126 . 1 1 A 32 32 THR CA C 32 59.510 64.763 -5.253 2 1 127 . 1 1 A 32 32 THR CB C 32 71.630 69.914 1.716 2 1 129 . 1 1 A 32 32 THR N N 32 118.860 121.199 -2.339 2 1 130 . 1 1 A 33 33 GLY H H 33 8.350 7.944 0.406 2 1 131 . 1 1 A 33 33 GLY HA2 H 33 4.160 4.017 0.143 2 1 132 . 1 1 A 33 33 GLY HA3 H 33 4.250 4.026 0.224 2 1 133 . 1 1 A 33 33 GLY C C 33 172.820 173.105 -0.285 2 1 134 . 1 1 A 33 33 GLY CA C 33 46.680 45.281 1.399 2 1 135 . 1 1 A 33 33 GLY N N 33 106.720 108.974 -2.254 2 1 136 . 1 1 A 34 34 SER H H 34 8.810 8.335 0.475 2 1 137 . 1 1 A 34 34 SER HA H 34 5.390 5.022 0.368 2 1 140 . 1 1 A 34 34 SER C C 34 173.780 172.839 0.941 2 1 141 . 1 1 A 34 34 SER CA C 34 57.380 57.460 -0.080 2 1 142 . 1 1 A 34 34 SER CB C 34 65.730 66.188 -0.458 2 1 143 . 1 1 A 34 34 SER N N 34 112.690 119.258 -6.568 2 1 144 . 1 1 A 35 35 VAL H H 35 8.470 8.727 -0.257 2 1 145 . 1 1 A 35 35 VAL HA H 35 4.120 4.892 -0.772 2 1 153 . 1 1 A 35 35 VAL C C 35 174.750 174.554 0.196 2 1 154 . 1 1 A 35 35 VAL CA C 35 62.310 60.443 1.867 2 1 155 . 1 1 A 35 35 VAL CB C 35 34.550 33.399 1.151 2 1 158 . 1 1 A 35 35 VAL N N 35 123.150 121.071 2.079 2 1 159 . 1 1 A 36 36 SER H H 36 8.240 8.800 -0.560 2 1 160 . 1 1 A 36 36 SER HA H 36 4.690 4.945 -0.255 2 1 163 . 1 1 A 36 36 SER C C 36 171.860 173.192 -1.332 2 1 164 . 1 1 A 36 36 SER CA C 36 56.020 57.085 -1.065 2 1 165 . 1 1 A 36 36 SER CB C 36 66.050 63.963 2.087 2 1 166 . 1 1 A 36 36 SER N N 36 118.760 121.066 -2.306 2 1 167 . 1 1 A 37 37 LEU H H 37 8.310 8.967 -0.657 2 1 168 . 1 1 A 37 37 LEU HA H 37 4.870 4.942 -0.072 2 1 178 . 1 1 A 37 37 LEU C C 37 174.190 175.447 -1.257 2 1 179 . 1 1 A 37 37 LEU CA C 37 53.870 53.689 0.181 2 1 180 . 1 1 A 37 37 LEU CB C 37 47.000 43.470 3.530 2 1 184 . 1 1 A 37 37 LEU N N 37 124.790 128.597 -3.807 2 1 185 . 1 1 A 38 38 GLU H H 38 9.270 8.845 0.425 2 1 186 . 1 1 A 38 38 GLU HA H 38 4.650 5.094 -0.444 2 1 191 . 1 1 A 38 38 GLU C C 38 173.970 175.113 -1.143 2 1 192 . 1 1 A 38 38 GLU CA C 38 54.410 55.441 -1.031 2 1 193 . 1 1 A 38 38 GLU CB C 38 32.460 32.190 0.270 2 1 195 . 1 1 A 38 38 GLU N N 38 126.550 126.477 0.073 2 1 196 . 1 1 A 39 39 ALA H H 39 8.120 8.479 -0.359 2 1 197 . 1 1 A 39 39 ALA HA H 39 4.600 4.753 -0.153 2 1 201 . 1 1 A 39 39 ALA C C 39 175.930 177.228 -1.298 2 1 202 . 1 1 A 39 39 ALA CA C 39 51.570 50.926 0.644 2 1 203 . 1 1 A 39 39 ALA CB C 39 21.780 22.748 -0.968 2 1 204 . 1 1 A 39 39 ALA N N 39 124.410 128.221 -3.811 2 1 205 . 1 1 A 40 40 LEU H H 40 7.860 8.974 -1.114 2 1 206 . 1 1 A 40 40 LEU HA H 40 4.230 3.999 0.231 2 1 216 . 1 1 A 40 40 LEU C C 40 175.940 176.604 -0.664 2 1 217 . 1 1 A 40 40 LEU CA C 40 55.360 57.422 -2.062 2 1 218 . 1 1 A 40 40 LEU CB C 40 42.990 42.499 0.491 2 1 222 . 1 1 A 40 40 LEU N N 40 120.640 121.936 -1.296 2 1 223 . 1 1 A 41 41 GLU H H 41 8.210 7.884 0.326 2 1 224 . 1 1 A 41 41 GLU HA H 41 4.240 4.052 0.188 2 1 229 . 1 1 A 41 41 GLU C C 41 176.920 174.870 2.050 2 1 230 . 1 1 A 41 41 GLU CA C 41 58.090 57.696 0.394 2 1 231 . 1 1 A 41 41 GLU CB C 41 30.530 27.137 3.393 2 1 233 . 1 1 A 41 41 GLU N N 41 114.680 117.037 -2.357 2 1 234 . 1 1 A 42 42 GLU H H 42 7.490 7.754 -0.264 2 1 235 . 1 1 A 42 42 GLU HA H 42 5.680 4.799 0.881 2 1 240 . 1 1 A 42 42 GLU C C 42 173.790 174.143 -0.353 2 1 241 . 1 1 A 42 42 GLU CA C 42 54.360 56.195 -1.835 2 1 242 . 1 1 A 42 42 GLU CB C 42 33.850 33.212 0.638 2 1 244 . 1 1 A 42 42 GLU N N 42 116.670 118.212 -1.542 2 1 245 . 1 1 A 43 43 VAL H H 43 8.550 8.850 -0.300 2 1 246 . 1 1 A 43 43 VAL HA H 43 4.550 4.742 -0.192 2 1 254 . 1 1 A 43 43 VAL C C 43 172.220 173.643 -1.423 2 1 255 . 1 1 A 43 43 VAL CA C 43 59.470 60.214 -0.744 2 1 256 . 1 1 A 43 43 VAL CB C 43 35.470 34.946 0.524 2 1 259 . 1 1 A 43 43 VAL N N 43 120.030 125.105 -5.075 2 1 260 . 1 1 A 44 44 GLN H H 44 8.470 8.676 -0.206 2 1 261 . 1 1 A 44 44 GLN HA H 44 4.890 4.705 0.185 2 1 268 . 1 1 A 44 44 GLN C C 44 176.130 175.714 0.416 2 1 269 . 1 1 A 44 44 GLN CA C 44 54.360 55.333 -0.973 2 1 270 . 1 1 A 44 44 GLN CB C 44 30.610 29.847 0.763 2 1 272 . 1 1 A 44 44 GLN N N 44 124.690 128.954 -4.264 2 1 274 . 1 1 A 45 45 VAL H H 45 8.130 8.447 -0.317 2 1 275 . 1 1 A 45 45 VAL HA H 45 3.030 3.943 -0.913 2 1 283 . 1 1 A 45 45 VAL C C 45 176.710 177.199 -0.489 2 1 284 . 1 1 A 45 45 VAL CA C 45 65.810 64.764 1.046 2 1 285 . 1 1 A 45 45 VAL CB C 45 31.960 31.473 0.487 2 1 288 . 1 1 A 45 45 VAL N N 45 120.450 127.046 -6.597 2 1 289 . 1 1 A 46 46 GLY H H 46 8.950 9.915 -0.965 2 1 290 . 1 1 A 46 46 GLY HA2 H 46 3.590 3.996 -0.406 2 1 291 . 1 1 A 46 46 GLY HA3 H 46 4.410 3.998 0.412 2 1 292 . 1 1 A 46 46 GLY C C 46 174.390 173.898 0.492 2 1 293 . 1 1 A 46 46 GLY CA C 46 44.730 45.041 -0.311 2 1 294 . 1 1 A 46 46 GLY N N 46 116.490 115.133 1.357 2 1 295 . 1 1 A 47 47 GLU H H 47 8.260 7.809 0.451 2 1 296 . 1 1 A 47 47 GLU HA H 47 4.460 4.725 -0.265 2 1 301 . 1 1 A 47 47 GLU C C 47 174.780 175.221 -0.441 2 1 302 . 1 1 A 47 47 GLU CA C 47 54.830 55.093 -0.263 2 1 303 . 1 1 A 47 47 GLU CB C 47 31.140 32.115 -0.975 2 1 305 . 1 1 A 47 47 GLU N N 47 120.520 121.082 -0.562 2 1 306 . 1 1 A 48 48 ASN H H 48 8.440 8.802 -0.362 2 1 307 . 1 1 A 48 48 ASN HA H 48 5.380 5.549 -0.169 2 1 312 . 1 1 A 48 48 ASN C C 48 174.770 173.967 0.803 2 1 313 . 1 1 A 48 48 ASN CA C 48 51.570 51.723 -0.153 2 1 314 . 1 1 A 48 48 ASN CB C 48 39.010 41.750 -2.740 2 1 315 . 1 1 A 48 48 ASN N N 48 117.180 119.645 -2.465 2 1 317 . 1 1 A 49 49 LEU H H 49 9.810 8.551 1.259 2 1 318 . 1 1 A 49 49 LEU HA H 49 4.510 5.109 -0.599 2 1 328 . 1 1 A 49 49 LEU C C 49 174.560 175.069 -0.509 2 1 329 . 1 1 A 49 49 LEU CA C 49 53.460 53.497 -0.037 2 1 330 . 1 1 A 49 49 LEU CB C 49 45.520 45.410 0.110 2 1 333 . 1 1 A 49 49 LEU N N 49 125.620 122.508 3.112 2 1 334 . 1 1 A 50 50 GLU H H 50 8.750 8.872 -0.122 2 1 335 . 1 1 A 50 50 GLU HA H 50 4.360 4.950 -0.590 2 1 340 . 1 1 A 50 50 GLU C C 50 175.340 174.877 0.463 2 1 341 . 1 1 A 50 50 GLU CA C 50 55.550 55.289 0.261 2 1 342 . 1 1 A 50 50 GLU CB C 50 29.890 31.413 -1.523 2 1 344 . 1 1 A 50 50 GLU N N 50 125.420 123.315 2.105 2 1 345 . 1 1 A 51 51 VAL H H 51 9.230 8.823 0.407 2 1 346 . 1 1 A 51 51 VAL HA H 51 4.190 4.734 -0.544 2 1 354 . 1 1 A 51 51 VAL C C 51 175.310 174.858 0.452 2 1 355 . 1 1 A 51 51 VAL CA C 51 62.520 61.101 1.419 2 1 356 . 1 1 A 51 51 VAL CB C 51 31.470 32.957 -1.487 2 1 359 . 1 1 A 51 51 VAL N N 51 129.810 124.328 5.482 2 1 360 . 1 1 A 52 52 GLY H H 52 9.410 8.734 0.676 2 1 361 . 1 1 A 52 52 GLY HA2 H 52 3.460 3.916 -0.456 2 1 362 . 1 1 A 52 52 GLY HA3 H 52 4.680 3.947 0.733 2 1 363 . 1 1 A 52 52 GLY C C 52 173.000 173.088 -0.088 2 1 364 . 1 1 A 52 52 GLY CA C 52 46.470 47.058 -0.588 2 1 365 . 1 1 A 52 52 GLY N N 52 116.600 115.146 1.454 2 1 366 . 1 1 A 53 53 VAL H H 53 9.130 8.603 0.527 2 1 367 . 1 1 A 53 53 VAL HA H 53 4.840 4.815 0.025 2 1 375 . 1 1 A 53 53 VAL C C 53 175.470 175.303 0.167 2 1 376 . 1 1 A 53 53 VAL CA C 53 61.350 61.395 -0.045 2 1 377 . 1 1 A 53 53 VAL CB C 53 34.300 31.646 2.654 2 1 380 . 1 1 A 53 53 VAL N N 53 129.050 124.139 4.911 2 1 381 . 1 1 A 54 54 GLY H H 54 8.420 8.589 -0.169 2 1 382 . 1 1 A 54 54 GLY HA2 H 54 3.850 3.789 0.061 2 1 383 . 1 1 A 54 54 GLY HA3 H 54 3.850 3.928 -0.078 2 1 384 . 1 1 A 54 54 GLY C C 54 173.310 172.974 0.336 2 1 385 . 1 1 A 54 54 GLY CA C 54 45.180 44.342 0.838 2 1 386 . 1 1 A 54 54 GLY N N 54 116.890 115.363 1.527 2 1 387 . 1 1 A 55 55 ILE H H 55 10.190 8.099 2.091 2 1 388 . 1 1 A 55 55 ILE HA H 55 4.010 4.731 -0.721 2 1 398 . 1 1 A 55 55 ILE C C 55 174.380 175.167 -0.787 2 1 399 . 1 1 A 55 55 ILE CA C 55 61.350 59.901 1.449 2 1 400 . 1 1 A 55 55 ILE CB C 55 40.840 40.203 0.637 2 1 404 . 1 1 A 55 55 ILE N N 55 129.330 121.417 7.913 2 1 405 . 1 1 A 56 56 ASP H H 56 8.810 9.526 -0.716 2 1 406 . 1 1 A 56 56 ASP HA H 56 4.440 4.880 -0.440 2 1 409 . 1 1 A 56 56 ASP C C 56 175.530 175.640 -0.110 2 1 410 . 1 1 A 56 56 ASP CA C 56 56.460 55.398 1.062 2 1 411 . 1 1 A 56 56 ASP CB C 56 42.720 42.973 -0.253 2 1 412 . 1 1 A 56 56 ASP N N 56 128.310 127.508 0.802 2 1 413 . 1 1 A 57 57 GLU H H 57 7.270 7.594 -0.324 2 1 414 . 1 1 A 57 57 GLU HA H 57 4.290 4.796 -0.506 2 1 419 . 1 1 A 57 57 GLU C C 57 173.370 174.420 -1.050 2 1 420 . 1 1 A 57 57 GLU CA C 57 54.840 55.478 -0.638 2 1 421 . 1 1 A 57 57 GLU CB C 57 33.190 33.439 -0.249 2 1 423 . 1 1 A 57 57 GLU N N 57 112.810 115.851 -3.041 2 1 424 . 1 1 A 58 58 LEU H H 58 8.370 8.582 -0.212 2 1 425 . 1 1 A 58 58 LEU HA H 58 4.830 4.777 0.053 2 1 434 . 1 1 A 58 58 LEU C C 58 174.180 174.729 -0.549 2 1 435 . 1 1 A 58 58 LEU CA C 58 55.320 54.457 0.863 2 1 436 . 1 1 A 58 58 LEU CB C 58 44.300 43.370 0.930 2 1 439 . 1 1 A 58 58 LEU N N 58 123.130 124.034 -0.904 2 1 440 . 1 1 A 59 59 VAL H H 59 9.120 8.780 0.340 2 1 441 . 1 1 A 59 59 VAL HA H 59 4.240 4.641 -0.401 2 1 449 . 1 1 A 59 59 VAL C C 59 174.960 175.584 -0.624 2 1 450 . 1 1 A 59 59 VAL CA C 59 61.760 60.126 1.634 2 1 451 . 1 1 A 59 59 VAL CB C 59 33.760 33.352 0.408 2 1 454 . 1 1 A 59 59 VAL N N 59 127.930 124.880 3.050 2 1 455 . 1 1 A 60 60 ASN H H 60 8.770 8.613 0.157 2 1 456 . 1 1 A 60 60 ASN HA H 60 4.250 4.549 -0.299 2 1 461 . 1 1 A 60 60 ASN C C 60 172.810 173.830 -1.020 2 1 462 . 1 1 A 60 60 ASN CA C 60 54.830 54.579 0.251 2 1 463 . 1 1 A 60 60 ASN CB C 60 36.030 36.710 -0.680 2 1 464 . 1 1 A 60 60 ASN N N 60 115.500 121.847 -6.347 2 1 466 . 1 1 A 61 61 ALA H H 61 7.330 7.332 -0.002 2 1 467 . 1 1 A 61 61 ALA HA H 61 4.520 4.638 -0.118 2 1 471 . 1 1 A 61 61 ALA C C 61 174.580 175.186 -0.606 2 1 472 . 1 1 A 61 61 ALA CA C 61 51.560 51.050 0.510 2 1 473 . 1 1 A 61 61 ALA CB C 61 22.870 22.621 0.249 2 1 474 . 1 1 A 61 61 ALA N N 61 115.640 118.317 -2.677 2 1 475 . 1 1 A 62 62 GLU H H 62 7.900 9.068 -1.168 2 1 476 . 1 1 A 62 62 GLU HA H 62 4.310 4.754 -0.444 2 1 481 . 1 1 A 62 62 GLU C C 62 173.790 175.316 -1.526 2 1 482 . 1 1 A 62 62 GLU CA C 62 55.080 55.067 0.013 2 1 483 . 1 1 A 62 62 GLU CB C 62 32.610 30.282 2.328 2 1 485 . 1 1 A 62 62 GLU N N 62 117.400 120.394 -2.994 2 1 486 . 1 1 A 63 63 ALA H H 63 8.910 8.645 0.265 2 1 487 . 1 1 A 63 63 ALA HA H 63 4.690 4.528 0.162 2 1 491 . 1 1 A 63 63 ALA C C 63 175.720 176.694 -0.974 2 1 492 . 1 1 A 63 63 ALA CA C 63 50.600 53.166 -2.566 2 1 493 . 1 1 A 63 63 ALA CB C 63 20.660 19.092 1.568 2 1 494 . 1 1 A 63 63 ALA N N 63 122.480 128.674 -6.194 2 1 495 . 1 1 A 64 64 PHE H H 64 9.220 9.357 -0.137 2 1 496 . 1 1 A 64 64 PHE HA H 64 4.320 4.719 -0.399 2 1 501 . 1 1 A 64 64 PHE C C 64 174.380 176.091 -1.711 2 1 502 . 1 1 A 64 64 PHE CA C 64 59.770 58.874 0.896 2 1 503 . 1 1 A 64 64 PHE CB C 64 40.830 41.054 -0.224 2 1 504 . 1 1 A 64 64 PHE N N 64 120.870 122.933 -2.063 2 1 505 . 1 1 A 65 65 ALA H H 65 8.150 7.944 0.206 2 1 506 . 1 1 A 65 65 ALA HA H 65 5.280 4.853 0.427 2 1 510 . 1 1 A 65 65 ALA C C 65 175.950 175.346 0.604 2 1 511 . 1 1 A 65 65 ALA CA C 65 51.120 51.078 0.042 2 1 512 . 1 1 A 65 65 ALA CB C 65 22.850 21.344 1.506 2 1 513 . 1 1 A 65 65 ALA N N 65 122.350 120.014 2.336 2 1 514 . 1 1 A 66 66 TYR H H 66 9.260 9.284 -0.024 2 1 515 . 1 1 A 66 66 TYR HA H 66 5.710 5.112 0.598 2 1 520 . 1 1 A 66 66 TYR C C 66 175.690 174.189 1.501 2 1 521 . 1 1 A 66 66 TYR CA C 66 54.390 57.566 -3.176 2 1 522 . 1 1 A 66 66 TYR CB C 66 41.560 40.054 1.506 2 1 523 . 1 1 A 66 66 TYR N N 66 124.350 126.751 -2.401 2 1 524 . 1 1 A 67 67 ASP H H 67 9.070 8.577 0.493 2 1 525 . 1 1 A 67 67 ASP HA H 67 5.630 5.331 0.299 2 1 528 . 1 1 A 67 67 ASP C C 67 174.300 174.703 -0.403 2 1 529 . 1 1 A 67 67 ASP CA C 67 51.590 53.006 -1.416 2 1 530 . 1 1 A 67 67 ASP CB C 67 44.380 43.154 1.226 2 1 531 . 1 1 A 67 67 ASP N N 67 130.490 126.585 3.905 2 1 532 . 1 1 A 68 68 PHE H H 68 8.670 8.354 0.316 2 1 533 . 1 1 A 68 68 PHE HA H 68 4.890 5.374 -0.484 2 1 538 . 1 1 A 68 68 PHE C C 68 172.220 173.253 -1.033 2 1 539 . 1 1 A 68 68 PHE CA C 68 57.360 55.188 2.172 2 1 540 . 1 1 A 68 68 PHE CB C 68 40.360 42.061 -1.701 2 1 541 . 1 1 A 68 68 PHE N N 68 118.200 119.346 -1.146 2 1 542 . 1 1 A 69 69 THR H H 69 8.390 8.752 -0.362 2 1 543 . 1 1 A 69 69 THR HA H 69 5.170 5.018 0.152 2 1 548 . 1 1 A 69 69 THR C C 69 172.620 173.768 -1.148 2 1 549 . 1 1 A 69 69 THR CA C 69 61.370 61.293 0.077 2 1 550 . 1 1 A 69 69 THR CB C 69 64.880 70.512 -5.632 2 1 552 . 1 1 A 69 69 THR N N 69 115.810 114.355 1.455 2 1 553 . 1 1 A 70 70 LEU H H 70 9.560 8.805 0.755 2 1 554 . 1 1 A 70 70 LEU HA H 70 5.270 4.788 0.482 2 1 564 . 1 1 A 70 70 LEU C C 70 173.800 175.522 -1.722 2 1 565 . 1 1 A 70 70 LEU CA C 70 53.460 55.004 -1.544 2 1 566 . 1 1 A 70 70 LEU CB C 70 45.040 43.239 1.801 2 1 570 . 1 1 A 70 70 LEU N N 70 129.220 128.647 0.573 2 1 571 . 1 1 A 71 71 ASN H H 71 9.590 8.590 1.000 2 1 572 . 1 1 A 71 71 ASN HA H 71 5.880 5.680 0.200 2 1 577 . 1 1 A 71 71 ASN C C 71 177.970 174.246 3.724 2 1 578 . 1 1 A 71 71 ASN CA C 71 52.060 52.154 -0.094 2 1 579 . 1 1 A 71 71 ASN CB C 71 41.020 40.670 0.350 2 1 580 . 1 1 A 71 71 ASN N N 71 125.970 121.976 3.994 2 1 582 . 1 1 A 72 72 TYR H H 72 8.740 9.154 -0.414 2 1 583 . 1 1 A 72 72 TYR HA H 72 5.110 5.309 -0.199 2 1 588 . 1 1 A 72 72 TYR C C 72 177.720 172.881 4.839 2 1 589 . 1 1 A 72 72 TYR CA C 72 55.310 55.407 -0.097 2 1 590 . 1 1 A 72 72 TYR CB C 72 41.510 41.234 0.276 2 1 591 . 1 1 A 72 72 TYR N N 72 119.640 120.545 -0.905 2 1 592 . 1 1 A 73 73 ASP H H 73 9.780 9.008 0.772 2 1 593 . 1 1 A 73 73 ASP HA H 73 4.680 5.045 -0.365 2 1 596 . 1 1 A 73 73 ASP C C 73 177.290 176.674 0.616 2 1 597 . 1 1 A 73 73 ASP CA C 73 53.650 53.034 0.616 2 1 598 . 1 1 A 73 73 ASP CB C 73 40.900 42.808 -1.908 2 1 599 . 1 1 A 73 73 ASP N N 73 119.290 120.371 -1.081 2 1 600 . 1 1 A 74 74 GLU H H 74 9.430 8.784 0.646 2 1 601 . 1 1 A 74 74 GLU HA H 74 4.740 4.478 0.262 2 1 606 . 1 1 A 74 74 GLU C C 74 176.320 178.034 -1.714 2 1 607 . 1 1 A 74 74 GLU CA C 74 57.410 58.424 -1.014 2 1 608 . 1 1 A 74 74 GLU CB C 74 29.490 29.766 -0.276 2 1 610 . 1 1 A 74 74 GLU N N 74 130.930 124.125 6.805 2 1 611 . 1 1 A 75 75 ASN H H 75 8.680 8.164 0.516 2 1 612 . 1 1 A 75 75 ASN HA H 75 4.600 4.575 0.025 2 1 617 . 1 1 A 75 75 ASN C C 75 175.340 176.523 -1.183 2 1 618 . 1 1 A 75 75 ASN CA C 75 54.620 55.376 -0.756 2 1 619 . 1 1 A 75 75 ASN CB C 75 38.770 38.547 0.223 2 1 620 . 1 1 A 75 75 ASN N N 75 115.040 117.902 -2.862 2 1 622 . 1 1 A 76 76 ALA H H 76 7.740 7.823 -0.083 2 1 623 . 1 1 A 76 76 ALA HA H 76 4.310 4.447 -0.137 2 1 627 . 1 1 A 76 76 ALA C C 76 175.550 176.815 -1.265 2 1 628 . 1 1 A 76 76 ALA CA C 76 53.260 53.176 0.084 2 1 629 . 1 1 A 76 76 ALA CB C 76 21.450 20.783 0.667 2 1 630 . 1 1 A 76 76 ALA N N 76 122.200 119.892 2.308 2 1 631 . 1 1 A 77 77 PHE H H 77 8.070 8.058 0.012 2 1 632 . 1 1 A 77 77 PHE HA H 77 5.650 5.044 0.606 2 1 637 . 1 1 A 77 77 PHE C C 77 174.570 175.169 -0.599 2 1 638 . 1 1 A 77 77 PHE CA C 77 56.360 57.377 -1.017 2 1 639 . 1 1 A 77 77 PHE CB C 77 46.080 41.284 4.796 2 1 640 . 1 1 A 77 77 PHE N N 77 114.160 114.495 -0.335 2 1 641 . 1 1 A 78 78 GLU H H 78 8.800 8.885 -0.085 2 1 642 . 1 1 A 78 78 GLU HA H 78 4.900 4.984 -0.084 2 1 647 . 1 1 A 78 78 GLU C C 78 175.950 174.736 1.214 2 1 648 . 1 1 A 78 78 GLU CA C 78 53.670 56.082 -2.412 2 1 649 . 1 1 A 78 78 GLU CB C 78 33.600 32.871 0.729 2 1 651 . 1 1 A 78 78 GLU N N 78 117.590 120.545 -2.955 2 1 652 . 1 1 A 79 79 TYR H H 79 8.770 9.258 -0.488 2 1 653 . 1 1 A 79 79 TYR HA H 79 4.250 4.231 0.019 2 1 658 . 1 1 A 79 79 TYR C C 79 174.580 174.958 -0.378 2 1 659 . 1 1 A 79 79 TYR CA C 79 59.250 59.497 -0.247 2 1 660 . 1 1 A 79 79 TYR CB C 79 38.310 39.267 -0.957 2 1 661 . 1 1 A 79 79 TYR N N 79 126.560 128.963 -2.403 2 1 662 . 1 1 A 80 80 VAL H H 80 8.220 8.270 -0.050 2 1 663 . 1 1 A 80 80 VAL HA H 80 3.690 3.873 -0.183 2 1 671 . 1 1 A 80 80 VAL C C 80 174.780 175.100 -0.320 2 1 672 . 1 1 A 80 80 VAL CA C 80 64.400 62.902 1.498 2 1 673 . 1 1 A 80 80 VAL CB C 80 33.510 32.892 0.618 2 1 676 . 1 1 A 80 80 VAL N N 80 129.460 125.135 4.325 2 1 677 . 1 1 A 81 81 GLU H H 81 6.920 7.407 -0.487 2 1 678 . 1 1 A 81 81 GLU HA H 81 4.260 4.654 -0.394 2 1 683 . 1 1 A 81 81 GLU C C 81 171.840 175.127 -3.287 2 1 684 . 1 1 A 81 81 GLU CA C 81 55.310 55.112 0.198 2 1 685 . 1 1 A 81 81 GLU CB C 81 30.520 33.262 -2.742 2 1 687 . 1 1 A 81 81 GLU N N 81 112.430 116.180 -3.750 2 1 688 . 1 1 A 82 82 ALA H H 82 8.310 8.623 -0.313 2 1 689 . 1 1 A 82 82 ALA HA H 82 5.650 5.058 0.592 2 1 693 . 1 1 A 82 82 ALA C C 82 176.110 177.026 -0.916 2 1 694 . 1 1 A 82 82 ALA CA C 82 50.620 51.702 -1.082 2 1 695 . 1 1 A 82 82 ALA CB C 82 21.770 20.082 1.688 2 1 696 . 1 1 A 82 82 ALA N N 82 121.240 125.513 -4.273 2 1 697 . 1 1 A 83 83 ILE H H 83 9.150 9.261 -0.111 2 1 698 . 1 1 A 83 83 ILE HA H 83 4.600 4.892 -0.292 2 1 708 . 1 1 A 83 83 ILE C C 83 174.810 174.919 -0.109 2 1 709 . 1 1 A 83 83 ILE CA C 83 60.060 59.194 0.866 2 1 710 . 1 1 A 83 83 ILE CB C 83 42.440 41.909 0.531 2 1 714 . 1 1 A 83 83 ILE N N 83 119.720 119.738 -0.018 2 1 715 . 1 1 A 84 84 SER H H 84 8.350 8.818 -0.468 2 1 716 . 1 1 A 84 84 SER HA H 84 4.660 4.902 -0.242 2 1 719 . 1 1 A 84 84 SER C C 84 177.550 172.617 4.933 2 1 720 . 1 1 A 84 84 SER CA C 84 57.330 56.057 1.273 2 1 721 . 1 1 A 84 84 SER CB C 84 66.490 65.662 0.828 2 1 722 . 1 1 A 84 84 SER N N 84 116.740 118.809 -2.070 2 1 723 . 1 1 A 85 85 ASP H H 85 8.740 8.656 0.084 2 1 724 . 1 1 A 85 85 ASP HA H 85 4.820 4.812 0.008 2 1 727 . 1 1 A 85 85 ASP C C 85 176.090 176.120 -0.030 2 1 728 . 1 1 A 85 85 ASP CA C 85 53.480 52.692 0.788 2 1 729 . 1 1 A 85 85 ASP CB C 85 42.480 42.719 -0.239 2 1 730 . 1 1 A 85 85 ASP N N 85 120.960 121.967 -1.007 2 1 731 . 1 1 A 86 86 ASP H H 86 8.380 8.739 -0.359 2 1 732 . 1 1 A 86 86 ASP HA H 86 4.450 4.851 -0.401 2 1 735 . 1 1 A 86 86 ASP C C 86 177.100 176.720 0.380 2 1 736 . 1 1 A 86 86 ASP CA C 86 56.240 53.699 2.541 2 1 737 . 1 1 A 86 86 ASP CB C 86 41.100 41.100 0.000 2 1 738 . 1 1 A 86 86 ASP N N 86 117.710 120.781 -3.071 2 1 739 . 1 1 A 87 87 GLY H H 87 8.690 7.654 1.036 2 1 740 . 1 1 A 87 87 GLY HA2 H 87 3.870 4.080 -0.210 2 1 741 . 1 1 A 87 87 GLY HA3 H 87 4.090 4.088 0.002 2 1 742 . 1 1 A 87 87 GLY C C 87 173.800 174.189 -0.389 2 1 743 . 1 1 A 87 87 GLY CA C 87 45.770 45.704 0.066 2 1 744 . 1 1 A 87 87 GLY N N 87 108.540 107.293 1.247 2 1 745 . 1 1 A 88 88 VAL H H 88 7.910 7.722 0.188 2 1 746 . 1 1 A 88 88 VAL HA H 88 4.780 4.287 0.493 2 1 754 . 1 1 A 88 88 VAL C C 88 173.970 175.106 -1.136 2 1 755 . 1 1 A 88 88 VAL CA C 88 60.900 61.954 -1.054 2 1 756 . 1 1 A 88 88 VAL CB C 88 35.460 33.110 2.350 2 1 759 . 1 1 A 88 88 VAL N N 88 119.790 120.032 -0.242 2 1 760 . 1 1 A 89 89 PHE H H 89 9.210 9.592 -0.382 2 1 761 . 1 1 A 89 89 PHE HA H 89 4.930 5.360 -0.430 2 1 766 . 1 1 A 89 89 PHE C C 89 173.970 173.836 0.134 2 1 767 . 1 1 A 89 89 PHE CA C 89 56.450 55.651 0.799 2 1 768 . 1 1 A 89 89 PHE CB C 89 41.120 41.819 -0.699 2 1 769 . 1 1 A 89 89 PHE N N 89 126.780 126.099 0.681 2 1 770 . 1 1 A 90 90 VAL H H 90 7.880 8.667 -0.787 2 1 771 . 1 1 A 90 90 VAL HA H 90 4.860 5.017 -0.157 2 1 779 . 1 1 A 90 90 VAL C C 90 173.190 174.762 -1.572 2 1 780 . 1 1 A 90 90 VAL CA C 90 59.750 60.918 -1.168 2 1 781 . 1 1 A 90 90 VAL CB C 90 34.770 34.147 0.624 2 1 784 . 1 1 A 90 90 VAL N N 90 124.990 126.882 -1.892 2 1 785 . 1 1 A 91 91 ASN H H 91 8.670 8.935 -0.265 2 1 786 . 1 1 A 91 91 ASN HA H 91 4.730 5.290 -0.560 2 1 791 . 1 1 A 91 91 ASN C C 91 173.200 174.220 -1.020 2 1 792 . 1 1 A 91 91 ASN CA C 91 51.970 52.594 -0.625 2 1 793 . 1 1 A 91 91 ASN CB C 91 41.340 41.578 -0.238 2 1 794 . 1 1 A 91 91 ASN N N 91 124.860 125.063 -0.203 2 1 796 . 1 1 A 92 92 ALA H H 92 8.840 9.092 -0.252 2 1 797 . 1 1 A 92 92 ALA HA H 92 5.290 5.210 0.080 2 1 801 . 1 1 A 92 92 ALA C C 92 176.330 176.327 0.003 2 1 802 . 1 1 A 92 92 ALA CA C 92 50.170 51.003 -0.833 2 1 803 . 1 1 A 92 92 ALA CB C 92 23.610 21.211 2.399 2 1 804 . 1 1 A 92 92 ALA N N 92 128.510 128.760 -0.250 2 1 805 . 1 1 A 93 93 LYS H H 93 8.670 9.214 -0.544 2 1 806 . 1 1 A 93 93 LYS HA H 93 4.460 4.805 -0.345 2 1 815 . 1 1 A 93 93 LYS C C 93 174.170 175.072 -0.902 2 1 816 . 1 1 A 93 93 LYS CA C 93 55.010 55.056 -0.046 2 1 817 . 1 1 A 93 93 LYS CB C 93 36.430 35.505 0.925 2 1 821 . 1 1 A 93 93 LYS N N 93 121.300 120.253 1.047 2 1 822 . 1 1 A 94 94 LYS H H 94 8.960 8.726 0.234 2 1 823 . 1 1 A 94 94 LYS HA H 94 4.460 4.171 0.289 2 1 832 . 1 1 A 94 94 LYS C C 94 176.330 176.806 -0.476 2 1 833 . 1 1 A 94 94 LYS CA C 94 56.720 56.780 -0.060 2 1 834 . 1 1 A 94 94 LYS CB C 94 31.930 32.679 -0.749 2 1 837 . 1 1 A 94 94 LYS N N 94 127.060 127.251 -0.191 2 1 838 . 1 1 A 95 95 ILE H H 95 8.290 8.639 -0.349 2 1 839 . 1 1 A 95 95 ILE HA H 95 4.120 4.181 -0.061 2 1 849 . 1 1 A 95 95 ILE C C 95 175.740 175.124 0.616 2 1 850 . 1 1 A 95 95 ILE CA C 95 62.760 62.361 0.399 2 1 851 . 1 1 A 95 95 ILE CB C 95 38.890 39.471 -0.581 2 1 855 . 1 1 A 95 95 ILE N N 95 126.530 128.008 -1.478 2 1 856 . 1 1 A 96 96 GLU H H 96 8.030 7.378 0.651 2 1 857 . 1 1 A 96 96 GLU HA H 96 4.450 4.650 -0.200 2 1 862 . 1 1 A 96 96 GLU C C 96 174.380 174.775 -0.395 2 1 863 . 1 1 A 96 96 GLU CA C 96 54.320 55.231 -0.911 2 1 864 . 1 1 A 96 96 GLU CB C 96 32.770 33.236 -0.466 2 1 866 . 1 1 A 96 96 GLU N N 96 117.080 119.640 -2.560 2 1 867 . 1 1 A 97 97 ASP H H 97 8.730 8.719 0.011 2 1 868 . 1 1 A 97 97 ASP HA H 97 4.360 4.542 -0.182 2 1 871 . 1 1 A 97 97 ASP C C 97 177.100 177.061 0.039 2 1 872 . 1 1 A 97 97 ASP CA C 97 57.160 55.684 1.476 2 1 873 . 1 1 A 97 97 ASP CB C 97 39.920 40.591 -0.671 2 1 874 . 1 1 A 97 97 ASP N N 97 120.570 121.092 -0.522 2 1 875 . 1 1 A 98 98 GLY H H 98 8.760 8.334 0.426 2 1 876 . 1 1 A 98 98 GLY HA2 H 98 2.120 1.686 0.434 2 1 877 . 1 1 A 98 98 GLY HA3 H 98 3.910 3.363 0.547 2 1 878 . 1 1 A 98 98 GLY C C 98 174.000 172.922 1.078 2 1 879 . 1 1 A 98 98 GLY CA C 98 45.720 45.310 0.410 2 1 880 . 1 1 A 98 98 GLY N N 98 112.090 110.457 1.633 2 1 881 . 1 1 A 99 99 LYS H H 99 7.890 7.165 0.725 2 1 882 . 1 1 A 99 99 LYS HA H 99 5.330 5.101 0.229 2 1 891 . 1 1 A 99 99 LYS C C 99 174.750 174.358 0.392 2 1 892 . 1 1 A 99 99 LYS CA C 99 55.990 54.900 1.090 2 1 893 . 1 1 A 99 99 LYS CB C 99 37.840 35.615 2.225 2 1 897 . 1 1 A 99 99 LYS N N 99 118.050 115.161 2.889 2 1 898 . 1 1 A 100 100 VAL H H 100 8.980 8.555 0.425 2 1 899 . 1 1 A 100 100 VAL HA H 100 4.510 4.728 -0.218 2 1 907 . 1 1 A 100 100 VAL C C 100 174.760 173.691 1.069 2 1 908 . 1 1 A 100 100 VAL CA C 100 60.130 59.100 1.030 2 1 909 . 1 1 A 100 100 VAL CB C 100 35.240 35.716 -0.476 2 1 912 . 1 1 A 100 100 VAL N N 100 123.850 119.633 4.217 2 1 913 . 1 1 A 101 101 ARG H H 101 8.810 8.221 0.589 2 1 914 . 1 1 A 101 101 ARG HA H 101 4.850 4.721 0.129 2 1 921 . 1 1 A 101 101 ARG C C 101 174.770 174.432 0.338 2 1 922 . 1 1 A 101 101 ARG CA C 101 54.580 54.967 -0.387 2 1 923 . 1 1 A 101 101 ARG CB C 101 32.400 31.577 0.823 2 1 926 . 1 1 A 101 101 ARG N N 101 129.210 124.073 5.137 2 1 927 . 1 1 A 102 102 VAL H H 102 9.100 8.279 0.821 2 1 928 . 1 1 A 102 102 VAL HA H 102 4.120 4.756 -0.636 2 1 936 . 1 1 A 102 102 VAL C C 102 171.640 173.676 -2.036 2 1 937 . 1 1 A 102 102 VAL CA C 102 61.350 59.697 1.653 2 1 938 . 1 1 A 102 102 VAL CB C 102 32.530 34.219 -1.689 2 1 941 . 1 1 A 102 102 VAL N N 102 130.470 123.240 7.230 2 1 942 . 1 1 A 103 103 LEU H H 103 8.110 9.296 -1.186 2 1 943 . 1 1 A 103 103 LEU HA H 103 5.120 4.907 0.213 2 1 953 . 1 1 A 103 103 LEU C C 103 176.410 175.619 0.791 2 1 954 . 1 1 A 103 103 LEU CA C 103 53.380 53.691 -0.311 2 1 955 . 1 1 A 103 103 LEU CB C 103 43.680 42.633 1.047 2 1 959 . 1 1 A 103 103 LEU N N 103 125.560 129.046 -3.486 2 1 960 . 1 1 A 104 104 VAL H H 104 9.580 9.028 0.552 2 1 961 . 1 1 A 104 104 VAL HA H 104 5.260 5.233 0.027 2 1 969 . 1 1 A 104 104 VAL C C 104 176.030 174.732 1.298 2 1 970 . 1 1 A 104 104 VAL CA C 104 60.220 60.501 -0.281 2 1 971 . 1 1 A 104 104 VAL CB C 104 34.310 34.214 0.096 2 1 974 . 1 1 A 104 104 VAL N N 104 125.790 125.436 0.354 2 1 975 . 1 1 A 105 105 SER H H 105 9.340 8.990 0.350 2 1 976 . 1 1 A 105 105 SER HA H 105 5.300 5.106 0.194 2 1 979 . 1 1 A 105 105 SER C C 105 173.600 172.988 0.612 2 1 980 . 1 1 A 105 105 SER CA C 105 57.450 57.382 0.068 2 1 981 . 1 1 A 105 105 SER CB C 105 65.600 66.802 -1.202 2 1 982 . 1 1 A 105 105 SER N N 105 119.220 120.274 -1.054 2 1 983 . 1 1 A 106 106 SER H H 106 8.350 8.937 -0.587 2 1 984 . 1 1 A 106 106 SER HA H 106 4.720 4.645 0.075 2 1 987 . 1 1 A 106 106 SER C C 106 176.930 174.415 2.515 2 1 988 . 1 1 A 106 106 SER CA C 106 58.170 58.380 -0.210 2 1 989 . 1 1 A 106 106 SER CB C 106 64.170 63.156 1.014 2 1 990 . 1 1 A 106 106 SER N N 106 114.800 119.148 -4.348 2 1 991 . 1 1 A 107 107 LEU H H 107 8.770 8.692 0.078 2 1 992 . 1 1 A 107 107 LEU HA H 107 4.710 4.417 0.293 2 1 1001 . 1 1 A 107 107 LEU C C 107 178.280 177.973 0.307 2 1 1002 . 1 1 A 107 107 LEU CA C 107 55.280 55.725 -0.445 2 1 1003 . 1 1 A 107 107 LEU CB C 107 43.410 41.921 1.489 2 1 1007 . 1 1 A 107 107 LEU N N 107 127.210 128.078 -0.868 2 1 1008 . 1 1 A 108 108 THR H H 108 8.210 7.806 0.404 2 1 1009 . 1 1 A 108 108 THR HA H 108 4.400 4.445 -0.045 2 1 1015 . 1 1 A 108 108 THR C C 108 176.130 175.684 0.446 2 1 1016 . 1 1 A 108 108 THR CA C 108 62.050 62.741 -0.691 2 1 1017 . 1 1 A 108 108 THR CB C 108 70.910 70.788 0.122 2 1 1019 . 1 1 A 108 108 THR N N 108 108.810 111.176 -2.366 2 1 1020 . 1 1 A 109 109 GLY H H 109 8.250 7.910 0.340 2 1 1021 . 1 1 A 109 109 GLY HA2 H 109 3.780 4.048 -0.268 2 1 1022 . 1 1 A 109 109 GLY HA3 H 109 4.290 4.061 0.228 2 1 1023 . 1 1 A 109 109 GLY C C 109 173.180 174.294 -1.114 2 1 1024 . 1 1 A 109 109 GLY CA C 109 45.340 45.161 0.179 2 1 1025 . 1 1 A 109 109 GLY N N 109 110.160 110.891 -0.731 2 1 1026 . 1 1 A 110 110 GLU H H 110 7.960 7.554 0.406 2 1 1027 . 1 1 A 110 110 GLU HA H 110 4.760 4.720 0.040 2 1 1032 . 1 1 A 110 110 GLU CA C 110 53.450 53.751 -0.301 2 1 1033 . 1 1 A 110 110 GLU CB C 110 30.020 30.146 -0.126 2 1 1035 . 1 1 A 110 110 GLU N N 110 119.720 120.180 -0.460 2 1 1036 . 1 1 A 111 111 PRO HA H 111 3.250 4.060 -0.810 2 1 1043 . 1 1 A 111 111 PRO C C 111 176.710 176.305 0.405 2 1 1044 . 1 1 A 111 111 PRO CA C 111 62.240 62.062 0.178 2 1 1045 . 1 1 A 111 111 PRO CB C 111 31.990 31.900 0.090 2 1 1048 . 1 1 A 112 112 LEU H H 112 8.840 8.204 0.636 2 1 1049 . 1 1 A 112 112 LEU HA H 112 4.290 4.255 0.035 2 1 1059 . 1 1 A 112 112 LEU CA C 112 52.220 53.488 -1.268 2 1 1060 . 1 1 A 112 112 LEU CB C 112 41.090 42.280 -1.190 2 1 1063 . 1 1 A 112 112 LEU N N 112 122.420 122.121 0.300 2 1 1064 . 1 1 A 113 113 PRO HA H 113 4.380 4.348 0.032 2 1 1071 . 1 1 A 113 113 PRO C C 113 176.100 177.106 -1.006 2 1 1072 . 1 1 A 113 113 PRO CA C 113 61.930 64.261 -2.331 2 1 1073 . 1 1 A 113 113 PRO CB C 113 32.470 31.923 0.547 2 1 1076 . 1 1 A 114 114 ALA H H 114 8.070 7.914 0.156 2 1 1077 . 1 1 A 114 114 ALA HA H 114 4.550 4.094 0.456 2 1 1081 . 1 1 A 114 114 ALA C C 114 177.490 177.167 0.323 2 1 1082 . 1 1 A 114 114 ALA CA C 114 51.340 53.188 -1.848 2 1 1083 . 1 1 A 114 114 ALA CB C 114 19.940 18.878 1.062 2 1 1084 . 1 1 A 114 114 ALA N N 114 121.460 121.227 0.233 2 1 1085 . 1 1 A 115 115 LYS H H 115 9.000 8.638 0.362 2 1 1086 . 1 1 A 115 115 LYS HA H 115 3.930 3.865 0.065 2 1 1095 . 1 1 A 115 115 LYS C C 115 175.740 175.173 0.567 2 1 1096 . 1 1 A 115 115 LYS CA C 115 57.580 57.645 -0.065 2 1 1097 . 1 1 A 115 115 LYS CB C 115 29.510 30.508 -0.998 2 1 1101 . 1 1 A 115 115 LYS N N 115 112.560 115.642 -3.082 2 1 1102 . 1 1 A 116 116 GLU H H 116 7.620 7.659 -0.039 2 1 1103 . 1 1 A 116 116 GLU HA H 116 4.550 4.775 -0.225 2 1 1108 . 1 1 A 116 116 GLU C C 116 176.110 174.904 1.206 2 1 1109 . 1 1 A 116 116 GLU CA C 116 54.570 54.825 -0.255 2 1 1110 . 1 1 A 116 116 GLU CB C 116 33.680 33.107 0.573 2 1 1112 . 1 1 A 116 116 GLU N N 116 115.710 117.657 -1.947 2 1 1113 . 1 1 A 117 117 VAL H H 117 8.770 8.811 -0.041 2 1 1114 . 1 1 A 117 117 VAL HA H 117 3.200 4.023 -0.823 2 1 1122 . 1 1 A 117 117 VAL C C 117 175.740 175.826 -0.086 2 1 1123 . 1 1 A 117 117 VAL CA C 117 65.340 63.286 2.054 2 1 1124 . 1 1 A 117 117 VAL CB C 117 31.290 30.992 0.298 2 1 1127 . 1 1 A 117 117 VAL N N 117 124.450 122.242 2.208 2 1 1128 . 1 1 A 118 118 LEU H H 118 8.550 8.981 -0.431 2 1 1129 . 1 1 A 118 118 LEU HA H 118 4.540 4.423 0.117 2 1 1139 . 1 1 A 118 118 LEU C C 118 176.210 176.735 -0.525 2 1 1140 . 1 1 A 118 118 LEU CA C 118 55.510 55.895 -0.386 2 1 1141 . 1 1 A 118 118 LEU CB C 118 44.600 42.809 1.791 2 1 1145 . 1 1 A 118 118 LEU N N 118 128.440 129.170 -0.730 2 1 1146 . 1 1 A 119 119 ALA H H 119 7.970 7.588 0.382 2 1 1147 . 1 1 A 119 119 ALA HA H 119 4.740 4.844 -0.104 2 1 1151 . 1 1 A 119 119 ALA C C 119 174.570 175.278 -0.708 2 1 1152 . 1 1 A 119 119 ALA CA C 119 50.770 51.742 -0.972 2 1 1153 . 1 1 A 119 119 ALA CB C 119 22.450 22.416 0.034 2 1 1154 . 1 1 A 119 119 ALA N N 119 118.100 117.979 0.121 2 1 1155 . 1 1 A 120 120 LYS H H 120 8.760 8.936 -0.176 2 1 1156 . 1 1 A 120 120 LYS HA H 120 5.240 5.444 -0.204 2 1 1165 . 1 1 A 120 120 LYS C C 120 175.340 174.932 0.408 2 1 1166 . 1 1 A 120 120 LYS CA C 120 54.220 54.867 -0.647 2 1 1167 . 1 1 A 120 120 LYS CB C 120 34.340 34.864 -0.524 2 1 1171 . 1 1 A 120 120 LYS N N 120 120.010 121.467 -1.457 2 1 1172 . 1 1 A 121 121 VAL H H 121 9.410 8.862 0.548 2 1 1173 . 1 1 A 121 121 VAL HA H 121 4.230 4.670 -0.440 2 1 1181 . 1 1 A 121 121 VAL C C 121 173.980 174.856 -0.876 2 1 1182 . 1 1 A 121 121 VAL CA C 121 62.370 61.550 0.820 2 1 1183 . 1 1 A 121 121 VAL CB C 121 32.410 33.045 -0.635 2 1 1186 . 1 1 A 121 121 VAL N N 121 124.960 125.034 -0.073 2 1 1187 . 1 1 A 122 122 VAL H H 122 9.280 8.505 0.775 2 1 1188 . 1 1 A 122 122 VAL HA H 122 4.360 4.757 -0.397 2 1 1196 . 1 1 A 122 122 VAL C C 122 174.190 175.238 -1.048 2 1 1197 . 1 1 A 122 122 VAL CA C 122 62.760 61.813 0.947 2 1 1198 . 1 1 A 122 122 VAL CB C 122 32.020 32.080 -0.060 2 1 1201 . 1 1 A 122 122 VAL N N 122 128.990 127.242 1.748 2 1 1202 . 1 1 A 123 123 LEU H H 123 8.610 8.784 -0.174 2 1 1203 . 1 1 A 123 123 LEU HA H 123 4.900 4.652 0.248 2 1 1213 . 1 1 A 123 123 LEU C C 123 174.950 176.257 -1.307 2 1 1214 . 1 1 A 123 123 LEU CA C 123 52.050 53.630 -1.580 2 1 1215 . 1 1 A 123 123 LEU CB C 123 45.210 42.093 3.117 2 1 1219 . 1 1 A 123 123 LEU N N 123 127.200 128.465 -1.265 2 1 1220 . 1 1 A 124 124 ARG H H 124 9.540 8.916 0.624 2 1 1221 . 1 1 A 124 124 ARG HA H 124 4.900 4.648 0.252 2 1 1229 . 1 1 A 124 124 ARG C C 124 176.320 175.529 0.791 2 1 1230 . 1 1 A 124 124 ARG CA C 124 55.320 55.975 -0.655 2 1 1231 . 1 1 A 124 124 ARG CB C 124 31.750 31.451 0.299 2 1 1234 . 1 1 A 124 124 ARG N N 124 124.290 124.457 -0.167 2 1 1236 . 1 1 A 125 125 ALA H H 125 8.880 8.537 0.343 2 1 1237 . 1 1 A 125 125 ALA HA H 125 4.380 4.044 0.336 2 1 1241 . 1 1 A 125 125 ALA C C 125 177.290 177.668 -0.378 2 1 1242 . 1 1 A 125 125 ALA CA C 125 52.530 51.318 1.212 2 1 1243 . 1 1 A 125 125 ALA CB C 125 19.870 17.366 2.504 2 1 1244 . 1 1 A 125 125 ALA N N 125 130.790 129.446 1.344 2 1 1245 . 1 1 A 126 126 GLU H H 126 9.260 8.560 0.700 2 1 1246 . 1 1 A 126 126 GLU HA H 126 4.460 4.380 0.080 2 1 1251 . 1 1 A 126 126 GLU C C 126 176.120 176.097 0.023 2 1 1252 . 1 1 A 126 126 GLU CA C 126 56.940 57.194 -0.254 2 1 1253 . 1 1 A 126 126 GLU CB C 126 32.450 30.206 2.244 2 1 1255 . 1 1 A 126 126 GLU N N 126 125.740 123.272 2.468 2 1 1256 . 1 1 A 127 127 ALA H H 127 7.460 7.462 -0.002 2 1 1257 . 1 1 A 127 127 ALA HA H 127 4.360 4.601 -0.241 2 1 1261 . 1 1 A 127 127 ALA C C 127 173.400 175.793 -2.393 2 1 1262 . 1 1 A 127 127 ALA CA C 127 51.360 51.646 -0.286 2 1 1263 . 1 1 A 127 127 ALA CB C 127 22.180 22.029 0.151 2 1 1264 . 1 1 A 127 127 ALA N N 127 120.910 119.628 1.282 2 1 1265 . 1 1 A 128 128 LYS H H 128 7.940 8.666 -0.726 2 1 1266 . 1 1 A 128 128 LYS HA H 128 3.580 4.118 -0.538 2 1 1275 . 1 1 A 128 128 LYS C C 128 176.080 175.787 0.293 2 1 1276 . 1 1 A 128 128 LYS CA C 128 56.860 57.079 -0.219 2 1 1277 . 1 1 A 128 128 LYS CB C 128 33.170 33.135 0.035 2 1 1281 . 1 1 A 128 128 LYS N N 128 116.520 124.417 -7.897 2 1 1282 . 1 1 A 129 129 ALA H H 129 8.590 8.635 -0.045 2 1 1283 . 1 1 A 129 129 ALA HA H 129 4.390 4.671 -0.281 2 1 1287 . 1 1 A 129 129 ALA C C 129 174.970 176.081 -1.111 2 1 1288 . 1 1 A 129 129 ALA CA C 129 52.970 51.210 1.760 2 1 1289 . 1 1 A 129 129 ALA CB C 129 21.500 19.030 2.470 2 1 1290 . 1 1 A 129 129 ALA N N 129 124.710 127.913 -3.203 2 1 1291 . 1 1 A 130 130 GLU H H 130 8.660 8.184 0.476 2 1 1292 . 1 1 A 130 130 GLU HA H 130 4.660 4.053 0.607 2 1 1297 . 1 1 A 130 130 GLU C C 130 177.390 177.372 0.018 2 1 1298 . 1 1 A 130 130 GLU CA C 130 55.070 58.203 -3.133 2 1 1299 . 1 1 A 130 130 GLU CB C 130 30.860 29.252 1.609 2 1 1301 . 1 1 A 130 130 GLU N N 130 123.180 120.730 2.450 2 1 1302 . 1 1 A 131 131 GLY H H 131 9.170 8.983 0.187 2 1 1303 . 1 1 A 131 131 GLY HA2 H 131 3.560 3.992 -0.432 2 1 1304 . 1 1 A 131 131 GLY HA3 H 131 3.750 3.998 -0.248 2 1 1305 . 1 1 A 131 131 GLY C C 131 174.550 174.574 -0.024 2 1 1306 . 1 1 A 131 131 GLY CA C 131 47.660 45.465 2.195 2 1 1307 . 1 1 A 131 131 GLY N N 131 115.530 114.606 0.924 2 1 1308 . 1 1 A 132 132 SER H H 132 8.430 8.242 0.188 2 1 1309 . 1 1 A 132 132 SER HA H 132 4.170 4.554 -0.384 2 1 1312 . 1 1 A 132 132 SER C C 132 175.350 173.983 1.367 2 1 1313 . 1 1 A 132 132 SER CA C 132 59.050 57.981 1.069 2 1 1314 . 1 1 A 132 132 SER CB C 132 64.880 62.201 2.679 2 1 1315 . 1 1 A 132 132 SER N N 132 115.930 118.080 -2.150 2 1 1316 . 1 1 A 133 133 ASN H H 133 8.850 8.808 0.042 2 1 1317 . 1 1 A 133 133 ASN HA H 133 4.910 5.125 -0.215 2 1 1322 . 1 1 A 133 133 ASN C C 133 175.450 174.795 0.655 2 1 1323 . 1 1 A 133 133 ASN CA C 133 54.920 53.925 0.995 2 1 1324 . 1 1 A 133 133 ASN CB C 133 41.060 39.065 1.995 2 1 1325 . 1 1 A 133 133 ASN N N 133 125.590 123.738 1.852 2 1 1327 . 1 1 A 134 134 LEU H H 134 9.070 9.496 -0.426 2 1 1328 . 1 1 A 134 134 LEU HA H 134 5.230 5.336 -0.106 2 1 1338 . 1 1 A 134 134 LEU C C 134 175.240 175.535 -0.295 2 1 1339 . 1 1 A 134 134 LEU CA C 134 53.470 53.613 -0.143 2 1 1340 . 1 1 A 134 134 LEU CB C 134 45.090 44.849 0.241 2 1 1344 . 1 1 A 134 134 LEU N N 134 129.210 124.631 4.579 2 1 1345 . 1 1 A 135 135 SER H H 135 8.690 8.739 -0.049 2 1 1346 . 1 1 A 135 135 SER HA H 135 5.280 5.327 -0.047 2 1 1349 . 1 1 A 135 135 SER C C 135 173.590 173.197 0.393 2 1 1350 . 1 1 A 135 135 SER CA C 135 56.220 56.890 -0.670 2 1 1351 . 1 1 A 135 135 SER CB C 135 66.510 65.063 1.447 2 1 1352 . 1 1 A 135 135 SER N N 135 113.020 118.616 -5.596 2 1 1353 . 1 1 A 136 136 VAL H H 136 8.940 8.687 0.253 2 1 1354 . 1 1 A 136 136 VAL HA H 136 5.500 4.807 0.693 2 1 1362 . 1 1 A 136 136 VAL C C 136 175.730 175.332 0.398 2 1 1363 . 1 1 A 136 136 VAL CA C 136 60.960 61.267 -0.307 2 1 1364 . 1 1 A 136 136 VAL CB C 136 33.630 32.415 1.215 2 1 1367 . 1 1 A 136 136 VAL N N 136 124.340 123.132 1.209 2 1 1368 . 1 1 A 137 137 THR H H 137 9.240 8.509 0.731 2 1 1369 . 1 1 A 137 137 THR HA H 137 4.920 4.785 0.135 2 1 1374 . 1 1 A 137 137 THR C C 137 173.500 174.312 -0.812 2 1 1375 . 1 1 A 137 137 THR CA C 137 59.120 60.251 -1.131 2 1 1376 . 1 1 A 137 137 THR CB C 137 72.500 70.680 1.820 2 1 1378 . 1 1 A 137 137 THR N N 137 117.010 118.542 -1.532 2 1 1379 . 1 1 A 138 138 ASN H H 138 9.190 8.838 0.352 2 1 1380 . 1 1 A 138 138 ASN HA H 138 4.420 4.332 0.088 2 1 1385 . 1 1 A 138 138 ASN C C 138 175.550 174.589 0.961 2 1 1386 . 1 1 A 138 138 ASN CA C 138 54.350 54.108 0.242 2 1 1387 . 1 1 A 138 138 ASN CB C 138 37.380 36.484 0.896 2 1 1388 . 1 1 A 138 138 ASN N N 138 115.270 119.546 -4.276 2 1 1390 . 1 1 A 139 139 SER H H 139 8.560 7.898 0.662 2 1 1391 . 1 1 A 139 139 SER HA H 139 5.800 4.357 1.443 2 1 1394 . 1 1 A 139 139 SER C C 139 175.750 173.965 1.785 2 1 1395 . 1 1 A 139 139 SER CA C 139 56.020 59.269 -3.249 2 1 1396 . 1 1 A 139 139 SER CB C 139 65.320 63.050 2.270 2 1 1397 . 1 1 A 139 139 SER N N 139 112.360 115.615 -3.255 2 1 1398 . 1 1 A 140 140 SER H H 140 9.900 8.417 1.483 2 1 1399 . 1 1 A 140 140 SER HA H 140 5.360 5.257 0.103 2 1 1402 . 1 1 A 140 140 SER C C 140 172.620 173.511 -0.891 2 1 1403 . 1 1 A 140 140 SER CA C 140 57.400 56.825 0.575 2 1 1404 . 1 1 A 140 140 SER CB C 140 66.550 65.737 0.813 2 1 1405 . 1 1 A 140 140 SER N N 140 119.130 121.360 -2.230 2 1 1406 . 1 1 A 141 141 VAL H H 141 9.030 8.778 0.252 2 1 1407 . 1 1 A 141 141 VAL HA H 141 5.520 5.061 0.459 2 1 1415 . 1 1 A 141 141 VAL C C 141 174.750 174.804 -0.054 2 1 1416 . 1 1 A 141 141 VAL CA C 141 58.310 59.816 -1.506 2 1 1417 . 1 1 A 141 141 VAL CB C 141 35.030 35.790 -0.760 2 1 1420 . 1 1 A 141 141 VAL N N 141 111.410 116.725 -5.315 2 1 1421 . 1 1 A 142 142 GLY H H 142 8.790 8.922 -0.132 2 1 1422 . 1 1 A 142 142 GLY HA2 H 142 3.600 4.089 -0.489 2 1 1423 . 1 1 A 142 142 GLY HA3 H 142 5.310 4.119 1.191 2 1 1424 . 1 1 A 142 142 GLY C C 142 174.180 173.633 0.547 2 1 1425 . 1 1 A 142 142 GLY CA C 142 44.110 46.106 -1.996 2 1 1426 . 1 1 A 142 142 GLY N N 142 109.330 111.416 -2.086 2 1 1427 . 1 1 A 143 143 ASP H H 143 8.840 8.722 0.118 2 1 1428 . 1 1 A 143 143 ASP HA H 143 5.790 5.083 0.707 2 1 1431 . 1 1 A 143 143 ASP C C 143 178.860 177.958 0.902 2 1 1432 . 1 1 A 143 143 ASP CA C 143 53.040 54.596 -1.556 2 1 1433 . 1 1 A 143 143 ASP CB C 143 43.660 42.490 1.170 2 1 1434 . 1 1 A 143 143 ASP N N 143 125.390 125.938 -0.548 2 1 1435 . 1 1 A 144 144 GLY H H 144 9.150 8.770 0.380 2 1 1436 . 1 1 A 144 144 GLY HA2 H 144 3.450 3.625 -0.175 2 1 1437 . 1 1 A 144 144 GLY HA3 H 144 3.720 3.841 -0.121 2 1 1438 . 1 1 A 144 144 GLY C C 144 174.770 175.786 -1.016 2 1 1439 . 1 1 A 144 144 GLY CA C 144 46.930 47.264 -0.334 2 1 1440 . 1 1 A 144 144 GLY N N 144 106.470 110.041 -3.571 2 1 1441 . 1 1 A 145 145 GLU H H 145 8.470 7.911 0.559 2 1 1442 . 1 1 A 145 145 GLU HA H 145 4.460 4.241 0.219 2 1 1447 . 1 1 A 145 145 GLU C C 145 176.520 176.373 0.147 2 1 1448 . 1 1 A 145 145 GLU CA C 145 55.330 57.167 -1.837 2 1 1449 . 1 1 A 145 145 GLU CB C 145 30.620 30.078 0.542 2 1 1451 . 1 1 A 145 145 GLU N N 145 119.170 120.255 -1.085 2 1 1452 . 1 1 A 146 146 GLY H H 146 7.950 7.960 -0.010 2 1 1453 . 1 1 A 146 146 GLY HA2 H 146 3.630 4.011 -0.381 2 1 1454 . 1 1 A 146 146 GLY HA3 H 146 4.130 4.019 0.111 2 1 1455 . 1 1 A 146 146 GLY C C 146 174.350 174.472 -0.122 2 1 1456 . 1 1 A 146 146 GLY CA C 146 45.330 45.174 0.156 2 1 1457 . 1 1 A 146 146 GLY N N 146 108.130 106.777 1.353 2 1 1458 . 1 1 A 147 147 LEU H H 147 8.440 7.937 0.503 2 1 1459 . 1 1 A 147 147 LEU HA H 147 4.340 4.490 -0.150 2 1 1469 . 1 1 A 147 147 LEU C C 147 175.950 175.546 0.404 2 1 1470 . 1 1 A 147 147 LEU CA C 147 54.860 54.213 0.647 2 1 1471 . 1 1 A 147 147 LEU CB C 147 41.590 42.821 -1.231 2 1 1475 . 1 1 A 147 147 LEU N N 147 124.000 122.010 1.990 2 1 1476 . 1 1 A 148 148 VAL H H 148 7.780 8.465 -0.685 2 1 1477 . 1 1 A 148 148 VAL HA H 148 4.830 4.934 -0.104 2 1 1485 . 1 1 A 148 148 VAL C C 148 175.740 174.296 1.444 2 1 1486 . 1 1 A 148 148 VAL CA C 148 61.140 60.817 0.323 2 1 1487 . 1 1 A 148 148 VAL CB C 148 33.640 33.983 -0.343 2 1 1490 . 1 1 A 148 148 VAL N N 148 120.440 121.603 -1.163 2 1 1491 . 1 1 A 149 149 HIS H H 149 9.170 8.783 0.387 2 1 1492 . 1 1 A 149 149 HIS HA H 149 4.950 4.996 -0.046 2 1 1496 . 1 1 A 149 149 HIS C C 149 174.780 174.603 0.177 2 1 1497 . 1 1 A 149 149 HIS CA C 149 53.900 54.618 -0.718 2 1 1498 . 1 1 A 149 149 HIS CB C 149 32.200 29.825 2.375 2 1 1499 . 1 1 A 149 149 HIS N N 149 124.700 126.583 -1.883 2 1 1500 . 1 1 A 150 150 GLU H H 150 9.060 8.669 0.391 2 1 1501 . 1 1 A 150 150 GLU HA H 150 4.420 4.268 0.152 2 1 1506 . 1 1 A 150 150 GLU C C 150 176.520 176.490 0.030 2 1 1507 . 1 1 A 150 150 GLU CA C 150 57.630 57.070 0.560 2 1 1508 . 1 1 A 150 150 GLU CB C 150 30.370 29.934 0.436 2 1 1510 . 1 1 A 150 150 GLU N N 150 125.540 124.231 1.308 2 1 1511 . 1 1 A 151 151 ILE H H 151 8.150 8.075 0.075 2 1 1512 . 1 1 A 151 151 ILE HA H 151 4.780 4.491 0.289 2 1 1522 . 1 1 A 151 151 ILE C C 151 174.570 176.260 -1.690 2 1 1523 . 1 1 A 151 151 ILE CA C 151 59.390 59.589 -0.199 2 1 1524 . 1 1 A 151 151 ILE CB C 151 42.040 39.547 2.493 2 1 1528 . 1 1 A 151 151 ILE N N 151 115.880 122.749 -6.869 2 1 1529 . 1 1 A 152 152 ALA H H 152 8.010 8.548 -0.538 2 1 1530 . 1 1 A 152 152 ALA HA H 152 4.310 4.386 -0.076 2 1 1534 . 1 1 A 152 152 ALA C C 152 177.500 176.775 0.725 2 1 1535 . 1 1 A 152 152 ALA CA C 152 53.680 51.768 1.912 2 1 1536 . 1 1 A 152 152 ALA CB C 152 20.050 19.756 0.294 2 1 1537 . 1 1 A 152 152 ALA N N 152 126.640 124.519 2.121 2 1 1538 . 1 1 A 153 153 GLY H H 153 8.340 8.338 0.002 2 1 1539 . 1 1 A 153 153 GLY HA2 H 153 4.050 4.326 -0.276 2 1 1540 . 1 1 A 153 153 GLY HA3 H 153 4.140 4.329 -0.189 2 1 1541 . 1 1 A 153 153 GLY C C 153 173.140 171.731 1.409 2 1 1542 . 1 1 A 153 153 GLY CA C 153 44.130 45.817 -1.687 2 1 1543 . 1 1 A 153 153 GLY N N 153 107.490 105.378 2.112 2 1 1544 . 1 1 A 154 154 THR H H 154 7.380 8.323 -0.943 2 1 1545 . 1 1 A 154 154 THR HA H 154 4.700 5.029 -0.329 2 1 1550 . 1 1 A 154 154 THR C C 154 171.120 173.160 -2.040 2 1 1551 . 1 1 A 154 154 THR CA C 154 60.830 60.909 -0.079 2 1 1552 . 1 1 A 154 154 THR CB C 154 68.850 72.134 -3.284 2 1 1554 . 1 1 A 154 154 THR N N 154 109.340 113.840 -4.500 2 1 1555 . 1 1 A 155 155 GLU H H 155 8.020 8.754 -0.734 2 1 1556 . 1 1 A 155 155 GLU HA H 155 5.370 5.399 -0.029 2 1 1561 . 1 1 A 155 155 GLU C C 155 174.240 174.514 -0.274 2 1 1562 . 1 1 A 155 155 GLU CA C 155 54.830 54.663 0.167 2 1 1563 . 1 1 A 155 155 GLU CB C 155 33.620 33.159 0.461 2 1 1565 . 1 1 A 155 155 GLU N N 155 118.690 123.691 -5.001 2 1 1566 . 1 1 A 156 156 LYS H H 156 9.230 9.102 0.128 2 1 1567 . 1 1 A 156 156 LYS HA H 156 4.650 4.994 -0.344 2 1 1576 . 1 1 A 156 156 LYS C C 156 174.000 174.506 -0.506 2 1 1577 . 1 1 A 156 156 LYS CA C 156 55.840 55.159 0.681 2 1 1578 . 1 1 A 156 156 LYS CB C 156 37.550 36.586 0.964 2 1 1582 . 1 1 A 156 156 LYS N N 156 121.940 123.012 -1.072 2 1 1583 . 1 1 A 157 157 THR H H 157 8.160 8.692 -0.532 2 1 1584 . 1 1 A 157 157 THR HA H 157 5.440 5.146 0.294 2 1 1589 . 1 1 A 157 157 THR C C 157 174.360 173.579 0.781 2 1 1590 . 1 1 A 157 157 THR CA C 157 60.410 60.582 -0.172 2 1 1591 . 1 1 A 157 157 THR CB C 157 71.500 71.366 0.134 2 1 1593 . 1 1 A 157 157 THR N N 157 113.240 112.930 0.310 2 1 1594 . 1 1 A 158 158 VAL H H 158 9.120 8.982 0.138 2 1 1595 . 1 1 A 158 158 VAL HA H 158 4.580 5.098 -0.518 2 1 1603 . 1 1 A 158 158 VAL C C 158 172.800 174.624 -1.824 2 1 1604 . 1 1 A 158 158 VAL CA C 158 59.980 59.948 0.032 2 1 1605 . 1 1 A 158 158 VAL CB C 158 36.290 34.537 1.753 2 1 1608 . 1 1 A 158 158 VAL N N 158 121.710 121.452 0.258 2 1 1609 . 1 1 A 159 159 ASN H H 159 8.240 8.711 -0.471 2 1 1610 . 1 1 A 159 159 ASN HA H 159 5.420 5.106 0.313 2 1 1615 . 1 1 A 159 159 ASN C C 159 173.800 174.236 -0.436 2 1 1616 . 1 1 A 159 159 ASN CA C 159 51.740 52.456 -0.716 2 1 1617 . 1 1 A 159 159 ASN CB C 159 40.380 39.448 0.932 2 1 1618 . 1 1 A 159 159 ASN N N 159 122.730 123.815 -1.085 2 1 1620 . 1 1 A 160 160 ILE H H 160 9.160 8.691 0.469 2 1 1621 . 1 1 A 160 160 ILE HA H 160 5.130 4.975 0.155 2 1 1631 . 1 1 A 160 160 ILE C C 160 177.320 175.632 1.688 2 1 1632 . 1 1 A 160 160 ILE CA C 160 60.640 60.901 -0.261 2 1 1633 . 1 1 A 160 160 ILE CB C 160 38.520 37.665 0.855 2 1 1637 . 1 1 A 160 160 ILE N N 160 123.690 125.641 -1.951 2 1 1638 . 1 1 A 161 161 ILE H H 161 8.780 9.090 -0.310 2 1 1639 . 1 1 A 161 161 ILE HA H 161 4.590 4.563 0.027 2 1 1649 . 1 1 A 161 161 ILE C C 161 174.960 175.805 -0.845 2 1 1650 . 1 1 A 161 161 ILE CA C 161 59.320 60.386 -1.066 2 1 1651 . 1 1 A 161 161 ILE CB C 161 41.030 39.799 1.231 2 1 1655 . 1 1 A 161 161 ILE N N 161 122.490 128.979 -6.489 2 1 1656 . 1 1 A 162 162 GLU H H 162 8.620 8.527 0.093 2 1 1657 . 1 1 A 162 162 GLU HA H 162 4.290 4.306 -0.016 2 1 1662 . 1 1 A 162 162 GLU C C 162 176.660 176.766 -0.106 2 1 1663 . 1 1 A 162 162 GLU CA C 162 56.470 57.488 -1.018 2 1 1664 . 1 1 A 162 162 GLU CB C 162 31.150 30.394 0.756 2 1 1666 . 1 1 A 162 162 GLU N N 162 120.520 126.540 -6.020 2 1 1667 . 1 1 A 163 163 GLY H H 163 8.480 8.435 0.045 2 1 1668 . 1 1 A 163 163 GLY HA2 H 163 3.910 4.165 -0.255 2 1 1669 . 1 1 A 163 163 GLY HA3 H 163 4.150 4.166 -0.016 2 1 1670 . 1 1 A 163 163 GLY C C 163 174.000 173.018 0.982 2 1 1671 . 1 1 A 163 163 GLY CA C 163 45.270 45.020 0.250 2 1 1672 . 1 1 A 163 163 GLY N N 163 110.210 109.960 0.250 2 1 1673 . 1 1 A 164 164 THR H H 164 8.170 8.500 -0.330 2 1 1674 . 1 1 A 164 164 THR HA H 164 4.410 4.589 -0.179 2 1 1679 . 1 1 A 164 164 THR C C 164 174.100 174.322 -0.222 2 1 1680 . 1 1 A 164 164 THR CA C 164 61.620 61.581 0.039 2 1 1681 . 1 1 A 164 164 THR CB C 164 70.060 70.364 -0.304 2 1 1683 . 1 1 A 164 164 THR N N 164 113.480 117.120 -3.640 2 stop_ save_