data_16050_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16050
_Entry.PDB_ID 2KBM
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 5 . 1 1 1 A 2 2 SER H H 2 9.000 8.455 0.545 1
1 6 . 1 1 1 A 2 2 SER HA H 2 4.690 4.738 -0.048 1
1 9 . 1 1 1 A 2 2 SER C C 2 176.170 175.889 0.281 1
1 10 . 1 1 1 A 2 2 SER CA C 2 57.340 57.783 -0.443 1
1 11 . 1 1 1 A 2 2 SER CB C 2 65.550 65.343 0.207 1
1 12 . 1 1 1 A 2 2 SER N N 2 119.330 115.284 4.046 1
1 13 . 1 1 1 A 3 3 GLU H H 3 9.350 9.089 0.261 1
1 14 . 1 1 1 A 3 3 GLU HA H 3 4.060 3.968 0.092 1
1 17 . 1 1 1 A 3 3 GLU C C 3 180.150 178.305 1.845 1
1 18 . 1 1 1 A 3 3 GLU CA C 3 60.280 59.529 0.751 1
1 19 . 1 1 1 A 3 3 GLU CB C 3 29.230 29.406 -0.176 1
1 21 . 1 1 1 A 3 3 GLU N N 3 125.350 121.110 4.240 1
1 22 . 1 1 1 A 4 4 LEU H H 4 9.060 8.199 0.861 1
1 23 . 1 1 1 A 4 4 LEU HA H 4 4.080 4.037 0.043 1
1 33 . 1 1 1 A 4 4 LEU C C 4 177.890 179.002 -1.112 1
1 34 . 1 1 1 A 4 4 LEU CA C 4 58.090 58.085 0.005 1
1 35 . 1 1 1 A 4 4 LEU CB C 4 42.120 41.144 0.976 1
1 39 . 1 1 1 A 4 4 LEU N N 4 121.090 120.129 0.961 1
1 40 . 1 1 1 A 5 5 GLU H H 5 8.340 8.260 0.080 1
1 41 . 1 1 1 A 5 5 GLU HA H 5 4.050 3.907 0.143 1
1 46 . 1 1 1 A 5 5 GLU C C 5 177.030 178.903 -1.873 1
1 47 . 1 1 1 A 5 5 GLU CA C 5 59.840 59.635 0.205 1
1 48 . 1 1 1 A 5 5 GLU CB C 5 28.940 29.465 -0.525 1
1 50 . 1 1 1 A 5 5 GLU N N 5 119.780 119.504 0.276 1
1 51 . 1 1 1 A 6 6 THR H H 6 8.370 8.780 -0.410 1
1 52 . 1 1 1 A 6 6 THR HA H 6 4.310 3.875 0.435 1
1 57 . 1 1 1 A 6 6 THR C C 6 177.340 177.102 0.238 1
1 58 . 1 1 1 A 6 6 THR CA C 6 66.630 66.298 0.332 1
1 59 . 1 1 1 A 6 6 THR CB C 6 68.650 68.311 0.339 1
1 61 . 1 1 1 A 6 6 THR N N 6 116.940 116.183 0.757 1
1 62 . 1 1 1 A 7 7 ALA H H 7 8.270 7.764 0.506 1
1 63 . 1 1 1 A 7 7 ALA HA H 7 4.190 4.312 -0.122 1
1 67 . 1 1 1 A 7 7 ALA C C 7 179.760 179.519 0.241 1
1 68 . 1 1 1 A 7 7 ALA CA C 7 55.880 54.998 0.882 1
1 69 . 1 1 1 A 7 7 ALA CB C 7 17.720 18.097 -0.377 1
1 70 . 1 1 1 A 7 7 ALA N N 7 127.400 124.133 3.267 1
1 71 . 1 1 1 A 8 8 MET H H 8 8.110 7.787 0.323 1
1 72 . 1 1 1 A 8 8 MET HA H 8 4.020 4.212 -0.192 1
1 80 . 1 1 1 A 8 8 MET C C 8 178.510 178.214 0.296 1
1 81 . 1 1 1 A 8 8 MET CA C 8 60.580 58.122 2.458 1
1 82 . 1 1 1 A 8 8 MET CB C 8 33.630 32.215 1.415 1
1 85 . 1 1 1 A 8 8 MET N N 8 117.520 118.374 -0.854 1
1 86 . 1 1 1 A 9 9 GLU H H 9 8.210 7.816 0.394 1
1 87 . 1 1 1 A 9 9 GLU HA H 9 3.830 4.151 -0.321 1
1 92 . 1 1 1 A 9 9 GLU C C 9 179.140 179.108 0.032 1
1 93 . 1 1 1 A 9 9 GLU CA C 9 59.690 59.238 0.452 1
1 94 . 1 1 1 A 9 9 GLU CB C 9 29.530 29.279 0.251 1
1 96 . 1 1 1 A 9 9 GLU N N 9 118.560 118.265 0.295 1
1 97 . 1 1 1 A 10 10 THR H H 10 8.490 7.716 0.774 1
1 98 . 1 1 1 A 10 10 THR HA H 10 4.000 4.038 -0.038 1
1 103 . 1 1 1 A 10 10 THR C C 10 176.010 176.491 -0.481 1
1 104 . 1 1 1 A 10 10 THR CA C 10 67.110 67.302 -0.192 1
1 105 . 1 1 1 A 10 10 THR CB C 10 67.770 68.689 -0.919 1
1 107 . 1 1 1 A 10 10 THR N N 10 118.310 117.393 0.917 1
1 108 . 1 1 1 A 11 11 LEU H H 11 7.920 7.975 -0.055 1
1 109 . 1 1 1 A 11 11 LEU HA H 11 3.930 4.189 -0.259 1
1 119 . 1 1 1 A 11 11 LEU C C 11 178.820 179.201 -0.381 1
1 120 . 1 1 1 A 11 11 LEU CA C 11 59.690 58.316 1.374 1
1 121 . 1 1 1 A 11 11 LEU CB C 11 41.920 41.285 0.635 1
1 125 . 1 1 1 A 11 11 LEU N N 11 121.150 120.343 0.807 1
1 126 . 1 1 1 A 12 12 ILE H H 12 7.440 7.846 -0.406 1
1 127 . 1 1 1 A 12 12 ILE HA H 12 3.640 3.430 0.210 1
1 137 . 1 1 1 A 12 12 ILE C C 12 179.530 178.652 0.878 1
1 138 . 1 1 1 A 12 12 ILE CA C 12 63.740 65.189 -1.449 1
1 139 . 1 1 1 A 12 12 ILE CB C 12 38.800 37.764 1.036 1
1 143 . 1 1 1 A 12 12 ILE N N 12 118.010 120.203 -2.193 1
1 144 . 1 1 1 A 13 13 ASN H H 13 8.930 8.171 0.759 1
1 145 . 1 1 1 A 13 13 ASN HA H 13 4.520 4.529 -0.009 1
1 148 . 1 1 1 A 13 13 ASN C C 13 179.450 177.586 1.864 1
1 149 . 1 1 1 A 13 13 ASN CA C 13 56.470 56.357 0.113 1
1 150 . 1 1 1 A 13 13 ASN CB C 13 37.930 38.660 -0.730 1
1 151 . 1 1 1 A 13 13 ASN N N 13 121.820 119.900 1.920 1
1 152 . 1 1 1 A 14 14 VAL H H 14 9.180 8.295 0.885 1
1 153 . 1 1 1 A 14 14 VAL HA H 14 3.830 3.881 -0.051 1
1 161 . 1 1 1 A 14 14 VAL CA C 14 65.840 65.427 0.413 1
1 162 . 1 1 1 A 14 14 VAL CB C 14 31.290 31.442 -0.152 1
1 165 . 1 1 1 A 14 14 VAL N N 14 122.040 118.910 3.130 1
1 166 . 1 1 1 A 15 15 PHE H H 15 7.590 8.292 -0.702 1
1 167 . 1 1 1 A 15 15 PHE HA H 15 3.360 4.104 -0.744 1
1 170 . 1 1 1 A 15 15 PHE C C 15 177.890 177.424 0.466 1
1 171 . 1 1 1 A 15 15 PHE CA C 15 62.030 62.025 0.005 1
1 172 . 1 1 1 A 15 15 PHE CB C 15 38.900 39.264 -0.364 1
1 173 . 1 1 1 A 15 15 PHE N N 15 118.290 122.363 -4.073 1
1 174 . 1 1 1 A 16 16 HIS H H 16 7.790 7.840 -0.050 1
1 175 . 1 1 1 A 16 16 HIS HA H 16 4.890 4.227 0.663 1
1 178 . 1 1 1 A 16 16 HIS C C 16 177.810 176.818 0.992 1
1 179 . 1 1 1 A 16 16 HIS CA C 16 59.100 60.009 -0.909 1
1 180 . 1 1 1 A 16 16 HIS CB C 16 28.060 29.357 -1.297 1
1 181 . 1 1 1 A 16 16 HIS N N 16 118.290 118.478 -0.188 1
1 182 . 1 1 1 A 17 17 ALA H H 17 8.040 7.871 0.169 1
1 183 . 1 1 1 A 17 17 ALA HA H 17 4.050 3.794 0.256 1
1 187 . 1 1 1 A 17 17 ALA C C 17 179.600 179.625 -0.025 1
1 188 . 1 1 1 A 17 17 ALA CA C 17 54.000 55.118 -1.118 1
1 189 . 1 1 1 A 17 17 ALA CB C 17 17.520 18.593 -1.073 1
1 190 . 1 1 1 A 17 17 ALA N N 17 124.410 120.904 3.506 1
1 191 . 1 1 1 A 18 18 HIS H H 18 7.000 7.416 -0.416 1
1 192 . 1 1 1 A 18 18 HIS HA H 18 4.330 4.233 0.097 1
1 195 . 1 1 1 A 18 18 HIS C C 18 176.320 177.801 -1.481 1
1 196 . 1 1 1 A 18 18 HIS CA C 18 57.350 59.351 -2.001 1
1 197 . 1 1 1 A 18 18 HIS CB C 18 32.920 30.106 2.814 1
1 198 . 1 1 1 A 18 18 HIS N N 18 115.160 115.895 -0.735 1
1 199 . 1 1 1 A 19 19 SER H H 19 8.380 7.765 0.615 1
1 200 . 1 1 1 A 19 19 SER HA H 19 3.640 4.033 -0.393 1
1 203 . 1 1 1 A 19 19 SER C C 19 177.340 175.940 1.400 1
1 204 . 1 1 1 A 19 19 SER CA C 19 60.160 60.712 -0.552 1
1 205 . 1 1 1 A 19 19 SER CB C 19 61.000 62.426 -1.426 1
1 206 . 1 1 1 A 19 19 SER N N 19 114.380 114.892 -0.512 1
1 207 . 1 1 1 A 20 20 GLY H H 20 7.600 7.779 -0.179 1
1 208 . 1 1 1 A 20 20 GLY HA2 H 20 3.680 3.691 -0.011 1
1 209 . 1 1 1 A 20 20 GLY HA3 H 20 4.000 3.874 0.126 1
1 210 . 1 1 1 A 20 20 GLY C C 20 174.140 174.427 -0.287 1
1 211 . 1 1 1 A 20 20 GLY CA C 20 47.000 45.196 1.804 1
1 212 . 1 1 1 A 20 20 GLY N N 20 112.550 106.873 5.677 1
1 213 . 1 1 1 A 21 21 LYS H H 21 7.230 7.266 -0.036 1
1 214 . 1 1 1 A 21 21 LYS HA H 21 3.860 4.327 -0.467 1
1 223 . 1 1 1 A 21 21 LYS C C 21 177.730 178.057 -0.327 1
1 224 . 1 1 1 A 21 21 LYS CA C 21 59.110 56.899 2.211 1
1 225 . 1 1 1 A 21 21 LYS CB C 21 32.460 34.464 -2.004 1
1 229 . 1 1 1 A 21 21 LYS N N 21 123.240 118.416 4.824 1
1 230 . 1 1 1 A 22 22 GLU H H 22 9.350 7.753 1.597 1
1 231 . 1 1 1 A 22 22 GLU HA H 22 4.610 4.397 0.213 1
1 236 . 1 1 1 A 22 22 GLU C C 22 177.420 175.867 1.553 1
1 237 . 1 1 1 A 22 22 GLU CA C 22 53.700 56.367 -2.667 1
1 238 . 1 1 1 A 22 22 GLU CB C 22 32.000 30.094 1.906 1
1 240 . 1 1 1 A 22 22 GLU N N 22 116.770 116.016 0.754 1
1 241 . 1 1 1 A 23 23 GLY H H 23 7.570 7.581 -0.011 1
1 242 . 1 1 1 A 23 23 GLY HA2 H 23 3.630 4.000 -0.370 1
1 243 . 1 1 1 A 23 23 GLY HA3 H 23 3.880 4.018 -0.138 1
1 244 . 1 1 1 A 23 23 GLY C C 23 173.980 171.721 2.259 1
1 245 . 1 1 1 A 23 23 GLY CA C 23 45.250 45.697 -0.447 1
1 246 . 1 1 1 A 23 23 GLY N N 23 112.180 107.050 5.130 1
1 247 . 1 1 1 A 24 24 ASP H H 24 8.680 8.523 0.157 1
1 248 . 1 1 1 A 24 24 ASP HA H 24 4.380 4.580 -0.200 1
1 251 . 1 1 1 A 24 24 ASP C C 24 178.590 177.607 0.983 1
1 252 . 1 1 1 A 24 24 ASP CA C 24 60.000 54.955 5.045 1
1 253 . 1 1 1 A 24 24 ASP CB C 24 27.480 41.184 -13.704 1
1 254 . 1 1 1 A 24 24 ASP N N 24 127.470 121.396 6.074 1
1 255 . 1 1 1 A 25 25 LYS H H 25 9.270 8.653 0.617 1
1 256 . 1 1 1 A 25 25 LYS HA H 25 4.250 3.948 0.302 1
1 265 . 1 1 1 A 25 25 LYS C C 25 177.030 177.197 -0.167 1
1 266 . 1 1 1 A 25 25 LYS CA C 25 60.000 60.175 -0.175 1
1 267 . 1 1 1 A 25 25 LYS CB C 25 31.170 32.262 -1.092 1
1 271 . 1 1 1 A 25 25 LYS N N 25 132.960 123.420 9.540 1
1 272 . 1 1 1 A 26 26 TYR H H 26 9.430 8.009 1.421 1
1 273 . 1 1 1 A 26 26 TYR HA H 26 4.640 4.774 -0.134 1
1 276 . 1 1 1 A 26 26 TYR C C 26 174.290 174.738 -0.448 1
1 277 . 1 1 1 A 26 26 TYR CA C 26 56.010 58.341 -2.331 1
1 278 . 1 1 1 A 26 26 TYR CB C 26 37.730 38.812 -1.082 1
1 279 . 1 1 1 A 26 26 TYR N N 26 120.650 120.096 0.554 1
1 280 . 1 1 1 A 27 27 LYS H H 27 7.110 7.521 -0.411 1
1 281 . 1 1 1 A 27 27 LYS HA H 27 5.110 5.030 0.080 1
1 290 . 1 1 1 A 27 27 LYS C C 27 175.150 173.690 1.460 1
1 291 . 1 1 1 A 27 27 LYS CA C 27 55.070 55.214 -0.144 1
1 292 . 1 1 1 A 27 27 LYS CB C 27 38.900 36.308 2.592 1
1 296 . 1 1 1 A 27 27 LYS N N 27 115.830 120.026 -4.196 1
1 297 . 1 1 1 A 28 28 LEU H H 28 9.820 8.582 1.238 1
1 298 . 1 1 1 A 28 28 LEU HA H 28 5.080 4.879 0.201 1
1 308 . 1 1 1 A 28 28 LEU C C 28 176.640 175.872 0.768 1
1 309 . 1 1 1 A 28 28 LEU CA C 28 52.660 53.933 -1.273 1
1 310 . 1 1 1 A 28 28 LEU CB C 28 42.710 43.765 -1.055 1
1 314 . 1 1 1 A 28 28 LEU N N 28 126.930 128.048 -1.118 1
1 315 . 1 1 1 A 29 29 SER H H 29 9.890 8.530 1.360 1
1 316 . 1 1 1 A 29 29 SER HA H 29 4.530 4.914 -0.384 1
1 319 . 1 1 1 A 29 29 SER C C 29 174.990 174.643 0.347 1
1 320 . 1 1 1 A 29 29 SER CA C 29 56.180 57.227 -1.047 1
1 321 . 1 1 1 A 29 29 SER CB C 29 65.550 67.124 -1.574 1
1 322 . 1 1 1 A 29 29 SER N N 29 121.600 118.219 3.381 1
1 323 . 1 1 1 A 30 30 LYS H H 30 8.850 8.845 0.005 1
1 324 . 1 1 1 A 30 30 LYS HA H 30 3.850 3.950 -0.100 1
1 333 . 1 1 1 A 30 30 LYS C C 30 175.620 177.501 -1.881 1
1 334 . 1 1 1 A 30 30 LYS CA C 30 60.860 60.175 0.685 1
1 335 . 1 1 1 A 30 30 LYS CB C 30 31.290 32.182 -0.892 1
1 339 . 1 1 1 A 30 30 LYS N N 30 121.260 124.646 -3.386 1
1 340 . 1 1 1 A 31 31 LYS H H 31 7.970 7.844 0.126 1
1 341 . 1 1 1 A 31 31 LYS HA H 31 3.880 4.086 -0.206 1
1 350 . 1 1 1 A 31 31 LYS C C 31 179.290 179.403 -0.113 1
1 351 . 1 1 1 A 31 31 LYS CA C 31 59.110 59.188 -0.078 1
1 352 . 1 1 1 A 31 31 LYS CB C 31 32.640 31.575 1.065 1
1 356 . 1 1 1 A 31 31 LYS N N 31 121.260 118.705 2.555 1
1 357 . 1 1 1 A 32 32 GLU H H 32 7.510 8.040 -0.530 1
1 358 . 1 1 1 A 32 32 GLU HA H 32 3.830 4.020 -0.190 1
1 363 . 1 1 1 A 32 32 GLU C C 32 179.290 179.514 -0.224 1
1 364 . 1 1 1 A 32 32 GLU CA C 32 58.590 58.980 -0.390 1
1 365 . 1 1 1 A 32 32 GLU CB C 32 30.120 29.555 0.565 1
1 367 . 1 1 1 A 32 32 GLU N N 32 120.090 119.516 0.574 1
1 368 . 1 1 1 A 33 33 LEU H H 33 8.970 7.852 1.118 1
1 369 . 1 1 1 A 33 33 LEU HA H 33 3.830 3.776 0.054 1
1 379 . 1 1 1 A 33 33 LEU C C 33 178.200 178.714 -0.514 1
1 380 . 1 1 1 A 33 33 LEU CA C 33 57.930 58.050 -0.120 1
1 381 . 1 1 1 A 33 33 LEU CB C 33 40.660 41.453 -0.793 1
1 385 . 1 1 1 A 33 33 LEU N N 33 120.200 118.996 1.204 1
1 386 . 1 1 1 A 34 34 LYS H H 34 8.230 7.654 0.576 1
1 387 . 1 1 1 A 34 34 LYS HA H 34 3.550 3.814 -0.264 1
1 396 . 1 1 1 A 34 34 LYS C C 34 178.040 178.453 -0.413 1
1 397 . 1 1 1 A 34 34 LYS CA C 34 60.720 59.896 0.824 1
1 398 . 1 1 1 A 34 34 LYS CB C 34 31.980 31.945 0.035 1
1 402 . 1 1 1 A 34 34 LYS N N 34 120.780 119.021 1.759 1
1 403 . 1 1 1 A 35 35 ASP H H 35 7.990 7.739 0.251 1
1 404 . 1 1 1 A 35 35 ASP HA H 35 4.250 4.661 -0.411 1
1 407 . 1 1 1 A 35 35 ASP C C 35 179.060 178.371 0.689 1
1 408 . 1 1 1 A 35 35 ASP CA C 35 56.830 57.192 -0.362 1
1 409 . 1 1 1 A 35 35 ASP CB C 35 40.440 40.705 -0.265 1
1 410 . 1 1 1 A 35 35 ASP N N 35 119.550 119.457 0.093 1
1 411 . 1 1 1 A 36 36 LEU H H 36 8.130 7.525 0.605 1
1 412 . 1 1 1 A 36 36 LEU HA H 36 2.580 3.166 -0.586 1
1 422 . 1 1 1 A 36 36 LEU C C 36 179.450 178.123 1.327 1
1 423 . 1 1 1 A 36 36 LEU CA C 36 59.980 57.871 2.109 1
1 424 . 1 1 1 A 36 36 LEU CB C 36 42.180 41.305 0.875 1
1 428 . 1 1 1 A 36 36 LEU N N 36 125.560 121.045 4.515 1
1 429 . 1 1 1 A 37 37 LEU H H 37 8.740 7.928 0.812 1
1 430 . 1 1 1 A 37 37 LEU HA H 37 3.580 3.907 -0.327 1
1 440 . 1 1 1 A 37 37 LEU C C 37 179.290 179.395 -0.105 1
1 441 . 1 1 1 A 37 37 LEU CA C 37 58.230 58.064 0.166 1
1 442 . 1 1 1 A 37 37 LEU CB C 37 41.590 40.791 0.799 1
1 446 . 1 1 1 A 37 37 LEU N N 37 120.520 118.327 2.193 1
1 447 . 1 1 1 A 38 38 GLN H H 38 8.520 8.055 0.465 1
1 448 . 1 1 1 A 38 38 GLN HA H 38 4.000 4.041 -0.041 1
1 453 . 1 1 1 A 38 38 GLN C C 38 177.960 178.365 -0.405 1
1 454 . 1 1 1 A 38 38 GLN CA C 38 58.210 58.276 -0.066 1
1 455 . 1 1 1 A 38 38 GLN CB C 38 28.650 28.000 0.650 1
1 457 . 1 1 1 A 38 38 GLN N N 38 116.740 117.895 -1.155 1
1 458 . 1 1 1 A 39 39 THR H H 39 7.910 7.813 0.097 1
1 459 . 1 1 1 A 39 39 THR HA H 39 4.210 3.852 0.358 1
1 464 . 1 1 1 A 39 39 THR C C 39 177.180 175.894 1.286 1
1 465 . 1 1 1 A 39 39 THR CA C 39 64.730 67.133 -2.403 1
1 466 . 1 1 1 A 39 39 THR CB C 39 69.650 68.790 0.860 1
1 468 . 1 1 1 A 39 39 THR N N 39 111.400 117.154 -5.754 1
1 469 . 1 1 1 A 40 40 GLU H H 40 8.590 7.970 0.620 1
1 470 . 1 1 1 A 40 40 GLU HA H 40 4.680 4.478 0.202 1
1 475 . 1 1 1 A 40 40 GLU C C 40 178.280 177.754 0.526 1
1 476 . 1 1 1 A 40 40 GLU CA C 40 55.880 56.887 -1.007 1
1 477 . 1 1 1 A 40 40 GLU CB C 40 30.990 30.683 0.307 1
1 479 . 1 1 1 A 40 40 GLU N N 40 117.840 116.560 1.280 1
1 480 . 1 1 1 A 41 41 LEU H H 41 7.680 7.593 0.087 1
1 481 . 1 1 1 A 41 41 LEU HA H 41 5.080 4.916 0.164 1
1 491 . 1 1 1 A 41 41 LEU C C 41 179.450 177.124 2.326 1
1 492 . 1 1 1 A 41 41 LEU CA C 41 53.830 54.232 -0.402 1
1 493 . 1 1 1 A 41 41 LEU CB C 41 41.360 42.789 -1.429 1
1 497 . 1 1 1 A 41 41 LEU N N 41 121.410 117.464 3.946 1
1 498 . 1 1 1 A 42 42 SER H H 42 8.380 8.227 0.153 1
1 499 . 1 1 1 A 42 42 SER HA H 42 4.130 4.139 -0.009 1
1 502 . 1 1 1 A 42 42 SER C C 42 176.640 176.885 -0.245 1
1 503 . 1 1 1 A 42 42 SER CA C 42 61.280 61.586 -0.306 1
1 504 . 1 1 1 A 42 42 SER CB C 42 63.040 62.499 0.541 1
1 505 . 1 1 1 A 42 42 SER N N 42 117.420 116.475 0.945 1
1 506 . 1 1 1 A 43 43 SER H H 43 8.900 8.648 0.252 1
1 507 . 1 1 1 A 43 43 SER HA H 43 4.290 4.263 0.027 1
1 510 . 1 1 1 A 43 43 SER C C 43 175.620 176.671 -1.051 1
1 511 . 1 1 1 A 43 43 SER CA C 43 60.860 60.713 0.147 1
1 512 . 1 1 1 A 43 43 SER CB C 43 62.910 62.928 -0.018 1
1 513 . 1 1 1 A 43 43 SER N N 43 117.580 116.196 1.384 1
1 514 . 1 1 1 A 44 44 PHE H H 44 7.880 8.049 -0.169 1
1 515 . 1 1 1 A 44 44 PHE HA H 44 4.240 4.198 0.042 1
1 518 . 1 1 1 A 44 44 PHE C C 44 176.950 175.601 1.349 1
1 519 . 1 1 1 A 44 44 PHE CA C 44 62.710 61.101 1.609 1
1 520 . 1 1 1 A 44 44 PHE CB C 44 39.020 39.201 -0.181 1
1 521 . 1 1 1 A 44 44 PHE N N 44 119.480 122.740 -3.260 1
1 522 . 1 1 1 A 45 45 LEU H H 45 8.060 7.543 0.517 1
1 523 . 1 1 1 A 45 45 LEU HA H 45 3.810 3.484 0.326 1
1 533 . 1 1 1 A 45 45 LEU C C 45 177.500 175.866 1.634 1
1 534 . 1 1 1 A 45 45 LEU CA C 45 59.980 55.243 4.737 1
1 535 . 1 1 1 A 45 45 LEU CB C 45 39.640 42.129 -2.489 1
1 538 . 1 1 1 A 45 45 LEU N N 45 118.010 121.349 -3.339 1
1 539 . 1 1 1 A 46 46 ASP H H 46 8.150 8.562 -0.412 1
1 540 . 1 1 1 A 46 46 ASP HA H 46 4.470 4.804 -0.334 1
1 543 . 1 1 1 A 46 46 ASP C C 46 179.920 175.327 4.593 1
1 544 . 1 1 1 A 46 46 ASP CA C 46 52.950 53.588 -0.638 1
1 545 . 1 1 1 A 46 46 ASP CB C 46 40.000 40.911 -0.911 1
1 546 . 1 1 1 A 46 46 ASP N N 46 119.460 123.251 -3.791 1
1 547 . 1 1 1 A 47 47 VAL H H 47 8.010 8.488 -0.478 1
1 548 . 1 1 1 A 47 47 VAL HA H 47 3.800 4.241 -0.441 1
1 556 . 1 1 1 A 47 47 VAL C C 47 175.460 177.396 -1.936 1
1 557 . 1 1 1 A 47 47 VAL CA C 47 60.000 63.550 -3.550 1
1 558 . 1 1 1 A 47 47 VAL CB C 47 31.580 32.785 -1.205 1
1 561 . 1 1 1 A 47 47 VAL N N 47 117.720 124.054 -6.334 1
1 562 . 1 1 1 A 48 48 GLN H H 48 7.960 8.908 -0.948 1
1 563 . 1 1 1 A 48 48 GLN HA H 48 4.060 4.027 0.033 1
1 568 . 1 1 1 A 48 48 GLN C C 48 179.370 179.147 0.223 1
1 569 . 1 1 1 A 48 48 GLN CA C 48 57.350 58.918 -1.568 1
1 570 . 1 1 1 A 48 48 GLN CB C 48 28.990 28.353 0.637 1
1 572 . 1 1 1 A 48 48 GLN N N 48 119.900 120.911 -1.011 1
1 573 . 1 1 1 A 49 49 LYS H H 49 7.810 7.840 -0.030 1
1 574 . 1 1 1 A 49 49 LYS HA H 49 3.860 4.112 -0.252 1
1 583 . 1 1 1 A 49 49 LYS C C 49 177.890 176.211 1.679 1
1 584 . 1 1 1 A 49 49 LYS CA C 49 58.230 58.254 -0.024 1
1 585 . 1 1 1 A 49 49 LYS CB C 49 30.990 32.326 -1.336 1
1 587 . 1 1 1 A 49 49 LYS N N 49 120.030 118.926 1.104 1
1 588 . 1 1 1 A 50 50 ASP H H 50 7.570 7.838 -0.268 1
1 589 . 1 1 1 A 50 50 ASP HA H 50 4.700 4.940 -0.240 1
1 590 . 1 1 1 A 50 50 ASP CA C 50 52.950 53.183 -0.233 1
1 591 . 1 1 1 A 50 50 ASP CB C 50 38.900 41.552 -2.652 1
1 592 . 1 1 1 A 50 50 ASP N N 50 116.730 118.661 -1.931 1
1 593 . 1 1 1 A 51 51 ALA H H 51 7.570 8.748 -1.178 1
1 594 . 1 1 1 A 51 51 ALA HA H 51 4.200 3.950 0.250 1
1 598 . 1 1 1 A 51 51 ALA C C 51 179.760 179.227 0.533 1
1 599 . 1 1 1 A 51 51 ALA CA C 51 54.200 55.276 -1.076 1
1 600 . 1 1 1 A 51 51 ALA CB C 51 18.110 18.483 -0.373 1
1 601 . 1 1 1 A 51 51 ALA N N 51 118.390 127.875 -9.485 1
1 602 . 1 1 1 A 52 52 ASP H H 52 8.430 8.387 0.043 1
1 603 . 1 1 1 A 52 52 ASP HA H 52 4.600 4.353 0.247 1
1 606 . 1 1 1 A 52 52 ASP C C 52 177.570 178.343 -0.773 1
1 607 . 1 1 1 A 52 52 ASP CA C 52 54.420 56.752 -2.332 1
1 608 . 1 1 1 A 52 52 ASP CB C 52 40.360 40.091 0.269 1
1 609 . 1 1 1 A 52 52 ASP N N 52 117.530 119.380 -1.850 1
1 610 . 1 1 1 A 53 53 ALA H H 53 7.660 7.928 -0.268 1
1 611 . 1 1 1 A 53 53 ALA HA H 53 3.860 3.999 -0.139 1
1 615 . 1 1 1 A 53 53 ALA C C 53 180.070 180.670 -0.600 1
1 616 . 1 1 1 A 53 53 ALA CA C 53 55.590 55.482 0.108 1
1 617 . 1 1 1 A 53 53 ALA CB C 53 18.800 18.021 0.779 1
1 618 . 1 1 1 A 53 53 ALA N N 53 123.450 122.585 0.865 1
1 619 . 1 1 1 A 54 54 VAL H H 54 8.030 7.737 0.293 1
1 620 . 1 1 1 A 54 54 VAL HA H 54 3.240 3.657 -0.417 1
1 628 . 1 1 1 A 54 54 VAL C C 54 177.340 177.857 -0.517 1
1 629 . 1 1 1 A 54 54 VAL CA C 54 66.620 65.660 0.960 1
1 630 . 1 1 1 A 54 54 VAL CB C 54 30.480 31.071 -0.591 1
1 633 . 1 1 1 A 54 54 VAL N N 54 116.150 117.284 -1.134 1
1 634 . 1 1 1 A 55 55 ASP H H 55 7.660 7.808 -0.148 1
1 635 . 1 1 1 A 55 55 ASP HA H 55 4.080 4.382 -0.302 1
1 638 . 1 1 1 A 55 55 ASP C C 55 177.260 179.320 -2.060 1
1 639 . 1 1 1 A 55 55 ASP CA C 55 57.640 57.333 0.307 1
1 640 . 1 1 1 A 55 55 ASP CB C 55 40.360 40.054 0.306 1
1 641 . 1 1 1 A 55 55 ASP N N 55 120.830 122.596 -1.766 1
1 642 . 1 1 1 A 56 56 LYS H H 56 7.780 7.553 0.227 1
1 643 . 1 1 1 A 56 56 LYS HA H 56 3.860 4.035 -0.175 1
1 652 . 1 1 1 A 56 56 LYS C C 56 179.530 179.357 0.173 1
1 653 . 1 1 1 A 56 56 LYS CA C 56 59.690 59.811 -0.121 1
1 654 . 1 1 1 A 56 56 LYS CB C 56 31.870 32.582 -0.712 1
1 658 . 1 1 1 A 56 56 LYS N N 56 120.010 119.028 0.982 1
1 659 . 1 1 1 A 57 57 ILE H H 57 8.090 7.699 0.391 1
1 660 . 1 1 1 A 57 57 ILE HA H 57 3.390 3.546 -0.156 1
1 670 . 1 1 1 A 57 57 ILE C C 57 176.710 178.022 -1.312 1
1 671 . 1 1 1 A 57 57 ILE CA C 57 64.960 65.388 -0.428 1
1 672 . 1 1 1 A 57 57 ILE CB C 57 38.080 37.904 0.176 1
1 676 . 1 1 1 A 57 57 ILE N N 57 120.960 120.467 0.493 1
1 677 . 1 1 1 A 58 58 MET H H 58 8.480 8.126 0.354 1
1 678 . 1 1 1 A 58 58 MET HA H 58 3.800 3.997 -0.197 1
1 686 . 1 1 1 A 58 58 MET C C 58 177.570 178.467 -0.897 1
1 687 . 1 1 1 A 58 58 MET CA C 58 58.570 59.291 -0.721 1
1 688 . 1 1 1 A 58 58 MET CB C 58 32.570 32.648 -0.078 1
1 691 . 1 1 1 A 58 58 MET N N 58 119.160 118.469 0.691 1
1 692 . 1 1 1 A 59 59 LYS H H 59 7.550 7.897 -0.347 1
1 693 . 1 1 1 A 59 59 LYS HA H 59 3.930 3.952 -0.022 1
1 702 . 1 1 1 A 59 59 LYS C C 59 179.530 179.258 0.272 1
1 703 . 1 1 1 A 59 59 LYS CA C 59 58.820 59.761 -0.941 1
1 704 . 1 1 1 A 59 59 LYS CB C 59 32.450 32.520 -0.070 1
1 708 . 1 1 1 A 59 59 LYS N N 59 116.730 120.722 -3.992 1
1 709 . 1 1 1 A 60 60 GLU H H 60 7.470 7.712 -0.242 1
1 710 . 1 1 1 A 60 60 GLU HA H 60 4.050 4.099 -0.049 1
1 715 . 1 1 1 A 60 60 GLU C C 60 178.950 178.251 0.699 1
1 716 . 1 1 1 A 60 60 GLU CA C 60 58.600 58.783 -0.183 1
1 717 . 1 1 1 A 60 60 GLU CB C 60 31.700 29.733 1.967 1
1 719 . 1 1 1 A 60 60 GLU N N 60 116.820 118.925 -2.105 1
1 720 . 1 1 1 A 61 61 LEU H H 61 8.030 7.858 0.172 1
1 721 . 1 1 1 A 61 61 LEU HA H 61 4.310 4.356 -0.046 1
1 731 . 1 1 1 A 61 61 LEU C C 61 179.450 176.932 2.518 1
1 732 . 1 1 1 A 61 61 LEU CA C 61 54.840 55.045 -0.205 1
1 733 . 1 1 1 A 61 61 LEU CB C 61 43.820 42.312 1.508 1
1 737 . 1 1 1 A 61 61 LEU N N 61 116.000 118.597 -2.597 1
1 738 . 1 1 1 A 62 62 ASP H H 62 7.890 8.951 -1.061 1
1 739 . 1 1 1 A 62 62 ASP HA H 62 4.660 4.913 -0.253 1
1 742 . 1 1 1 A 62 62 ASP C C 62 177.030 176.142 0.888 1
1 743 . 1 1 1 A 62 62 ASP CA C 62 53.660 53.875 -0.215 1
1 744 . 1 1 1 A 62 62 ASP CB C 62 38.700 39.946 -1.246 1
1 745 . 1 1 1 A 62 62 ASP N N 62 117.550 119.596 -2.046 1
1 746 . 1 1 1 A 63 63 GLU H H 63 8.430 8.690 -0.260 1
1 747 . 1 1 1 A 63 63 GLU HA H 63 4.020 4.029 -0.009 1
1 752 . 1 1 1 A 63 63 GLU C C 63 178.120 179.059 -0.939 1
1 753 . 1 1 1 A 63 63 GLU CA C 63 58.470 59.282 -0.812 1
1 754 . 1 1 1 A 63 63 GLU CB C 63 30.120 29.406 0.714 1
1 756 . 1 1 1 A 63 63 GLU N N 63 130.230 120.381 9.849 1
1 757 . 1 1 1 A 64 64 ASN H H 64 8.010 8.136 -0.126 1
1 758 . 1 1 1 A 64 64 ASN HA H 64 4.680 4.674 0.006 1
1 761 . 1 1 1 A 64 64 ASN C C 64 177.100 175.995 1.105 1
1 762 . 1 1 1 A 64 64 ASN CA C 64 51.780 53.314 -1.534 1
1 763 . 1 1 1 A 64 64 ASN CB C 64 37.260 38.998 -1.738 1
1 764 . 1 1 1 A 64 64 ASN N N 64 113.640 115.670 -2.030 1
1 765 . 1 1 1 A 65 65 GLY H H 65 7.550 7.952 -0.402 1
1 766 . 1 1 1 A 65 65 GLY HA2 H 65 3.770 3.950 -0.180 1
1 767 . 1 1 1 A 65 65 GLY HA3 H 65 3.770 3.951 -0.181 1
1 768 . 1 1 1 A 65 65 GLY C C 65 178.980 175.013 3.967 1
1 769 . 1 1 1 A 65 65 GLY CA C 65 47.200 46.662 0.538 1
1 770 . 1 1 1 A 65 65 GLY N N 65 113.640 107.662 5.978 1
1 771 . 1 1 1 A 66 66 ASP H H 66 8.110 8.139 -0.029 1
1 772 . 1 1 1 A 66 66 ASP HA H 66 4.490 4.590 -0.100 1
1 775 . 1 1 1 A 66 66 ASP C C 66 177.960 177.571 0.389 1
1 776 . 1 1 1 A 66 66 ASP CA C 66 52.960 53.495 -0.535 1
1 777 . 1 1 1 A 66 66 ASP CB C 66 40.540 40.492 0.048 1
1 778 . 1 1 1 A 66 66 ASP N N 66 120.030 120.205 -0.175 1
1 779 . 1 1 1 A 67 67 GLY H H 67 10.260 9.245 1.015 1
1 780 . 1 1 1 A 67 67 GLY HA2 H 67 3.360 3.869 -0.509 1
1 781 . 1 1 1 A 67 67 GLY HA3 H 67 4.000 3.870 0.130 1
1 782 . 1 1 1 A 67 67 GLY C C 67 173.120 173.460 -0.340 1
1 783 . 1 1 1 A 67 67 GLY CA C 67 45.460 45.757 -0.297 1
1 784 . 1 1 1 A 67 67 GLY N N 67 114.100 111.116 2.984 1
1 785 . 1 1 1 A 68 68 GLU H H 68 7.750 7.944 -0.194 1
1 786 . 1 1 1 A 68 68 GLU HA H 68 4.780 4.962 -0.182 1
1 791 . 1 1 1 A 68 68 GLU C C 68 175.930 174.854 1.076 1
1 792 . 1 1 1 A 68 68 GLU CA C 68 54.430 54.386 0.044 1
1 793 . 1 1 1 A 68 68 GLU CB C 68 35.850 33.636 2.214 1
1 795 . 1 1 1 A 68 68 GLU N N 68 118.000 119.325 -1.325 1
1 796 . 1 1 1 A 69 69 VAL H H 69 9.380 8.300 1.080 1
1 797 . 1 1 1 A 69 69 VAL HA H 69 5.260 5.137 0.123 1
1 805 . 1 1 1 A 69 69 VAL C C 69 176.710 174.579 2.131 1
1 806 . 1 1 1 A 69 69 VAL CA C 69 61.280 60.712 0.568 1
1 807 . 1 1 1 A 69 69 VAL CB C 69 33.980 34.971 -0.991 1
1 810 . 1 1 1 A 69 69 VAL N N 69 125.970 121.040 4.930 1
1 811 . 1 1 1 A 70 70 ASP H H 70 9.100 8.953 0.147 1
1 812 . 1 1 1 A 70 70 ASP HA H 70 5.190 4.953 0.237 1
1 815 . 1 1 1 A 70 70 ASP C C 70 175.700 177.768 -2.068 1
1 816 . 1 1 1 A 70 70 ASP CA C 70 52.370 53.364 -0.994 1
1 817 . 1 1 1 A 70 70 ASP CB C 70 40.950 41.799 -0.849 1
1 818 . 1 1 1 A 70 70 ASP N N 70 130.320 127.117 3.203 1
1 819 . 1 1 1 A 71 71 PHE H H 71 9.090 9.096 -0.006 1
1 820 . 1 1 1 A 71 71 PHE HA H 71 4.100 3.875 0.225 1
1 823 . 1 1 1 A 71 71 PHE C C 71 177.000 177.436 -0.436 1
1 824 . 1 1 1 A 71 71 PHE CA C 71 58.230 61.408 -3.178 1
1 825 . 1 1 1 A 71 71 PHE CB C 71 36.910 39.049 -2.139 1
1 826 . 1 1 1 A 71 71 PHE N N 71 119.760 123.029 -3.269 1
1 827 . 1 1 1 A 72 72 GLN H H 72 8.440 8.487 -0.047 1
1 828 . 1 1 1 A 72 72 GLN HA H 72 3.600 4.012 -0.412 1
1 831 . 1 1 1 A 72 72 GLN C C 72 178.820 178.103 0.717 1
1 832 . 1 1 1 A 72 72 GLN CA C 72 59.500 58.483 1.017 1
1 833 . 1 1 1 A 72 72 GLN CB C 72 29.553 28.319 1.234 1
1 835 . 1 1 1 A 72 72 GLN N N 72 121.820 118.150 3.670 1
1 836 . 1 1 1 A 73 73 GLU H H 73 8.290 8.661 -0.371 1
1 837 . 1 1 1 A 73 73 GLU HA H 73 4.070 4.109 -0.039 1
1 842 . 1 1 1 A 73 73 GLU C C 73 179.370 178.771 0.599 1
1 843 . 1 1 1 A 73 73 GLU CA C 73 58.030 58.861 -0.831 1
1 844 . 1 1 1 A 73 73 GLU CB C 73 29.530 30.020 -0.490 1
1 846 . 1 1 1 A 73 73 GLU N N 73 120.550 118.861 1.689 1
1 847 . 1 1 1 A 74 74 PHE H H 74 8.630 8.187 0.443 1
1 848 . 1 1 1 A 74 74 PHE HA H 74 4.020 4.063 -0.043 1
1 851 . 1 1 1 A 74 74 PHE C C 74 177.890 176.852 1.038 1
1 852 . 1 1 1 A 74 74 PHE CA C 74 60.090 61.207 -1.117 1
1 853 . 1 1 1 A 74 74 PHE CB C 74 38.020 39.243 -1.223 1
1 854 . 1 1 1 A 74 74 PHE N N 74 121.010 121.686 -0.676 1
1 855 . 1 1 1 A 75 75 VAL H H 75 8.080 7.919 0.161 1
1 856 . 1 1 1 A 75 75 VAL HA H 75 2.860 2.886 -0.026 1
1 864 . 1 1 1 A 75 75 VAL C C 75 177.030 178.062 -1.032 1
1 865 . 1 1 1 A 75 75 VAL CA C 75 66.430 66.098 0.332 1
1 866 . 1 1 1 A 75 75 VAL CB C 75 30.600 30.878 -0.278 1
1 869 . 1 1 1 A 75 75 VAL N N 75 119.460 118.520 0.940 1
1 870 . 1 1 1 A 76 76 VAL H H 76 7.100 8.007 -0.907 1
1 871 . 1 1 1 A 76 76 VAL HA H 76 3.330 3.438 -0.108 1
1 879 . 1 1 1 A 76 76 VAL C C 76 178.670 177.800 0.870 1
1 880 . 1 1 1 A 76 76 VAL CA C 76 67.000 66.661 0.339 1
1 881 . 1 1 1 A 76 76 VAL CB C 76 31.280 31.401 -0.121 1
1 884 . 1 1 1 A 76 76 VAL N N 76 121.030 120.079 0.951 1
1 885 . 1 1 1 A 77 77 LEU H H 77 6.900 7.904 -1.004 1
1 886 . 1 1 1 A 77 77 LEU HA H 77 3.800 3.947 -0.147 1
1 896 . 1 1 1 A 77 77 LEU C C 77 177.960 178.292 -0.332 1
1 897 . 1 1 1 A 77 77 LEU CA C 77 57.710 58.328 -0.618 1
1 898 . 1 1 1 A 77 77 LEU CB C 77 40.070 42.133 -2.063 1
1 902 . 1 1 1 A 77 77 LEU N N 77 120.310 120.718 -0.408 1
1 903 . 1 1 1 A 78 78 VAL H H 78 7.240 7.511 -0.271 1
1 904 . 1 1 1 A 78 78 VAL HA H 78 3.030 3.765 -0.735 1
1 912 . 1 1 1 A 78 78 VAL C C 78 179.600 177.926 1.674 1
1 913 . 1 1 1 A 78 78 VAL CA C 78 66.420 64.825 1.595 1
1 914 . 1 1 1 A 78 78 VAL CB C 78 30.700 31.451 -0.751 1
1 917 . 1 1 1 A 78 78 VAL N N 78 117.180 116.281 0.899 1
1 918 . 1 1 1 A 79 79 ALA H H 79 9.000 8.217 0.783 1
1 919 . 1 1 1 A 79 79 ALA HA H 79 3.610 3.903 -0.293 1
1 923 . 1 1 1 A 79 79 ALA C C 79 182.260 180.078 2.182 1
1 924 . 1 1 1 A 79 79 ALA CA C 79 55.580 55.428 0.152 1
1 925 . 1 1 1 A 79 79 ALA CB C 79 18.400 17.903 0.497 1
1 926 . 1 1 1 A 79 79 ALA N N 79 126.000 124.975 1.025 1
1 927 . 1 1 1 A 80 80 ALA H H 80 8.000 7.670 0.330 1
1 928 . 1 1 1 A 80 80 ALA HA H 80 4.100 4.063 0.037 1
1 932 . 1 1 1 A 80 80 ALA C C 80 175.460 179.453 -3.993 1
1 933 . 1 1 1 A 80 80 ALA CA C 80 56.020 54.389 1.631 1
1 934 . 1 1 1 A 80 80 ALA CB C 80 18.040 18.292 -0.252 1
1 935 . 1 1 1 A 80 80 ALA N N 80 120.730 120.961 -0.231 1
1 936 . 1 1 1 A 81 81 LEU H H 81 8.460 7.549 0.911 1
1 937 . 1 1 1 A 81 81 LEU HA H 81 4.000 3.976 0.024 1
1 941 . 1 1 1 A 81 81 LEU C C 81 177.030 178.743 -1.713 1
1 942 . 1 1 1 A 81 81 LEU CA C 81 57.640 57.767 -0.127 1
1 943 . 1 1 1 A 81 81 LEU CB C 81 40.620 41.269 -0.649 1
1 945 . 1 1 1 A 81 81 LEU N N 81 119.890 117.924 1.966 1
1 946 . 1 1 1 A 82 82 THR H H 82 8.320 7.803 0.517 1
1 947 . 1 1 1 A 82 82 THR HA H 82 3.800 3.929 -0.129 1
1 952 . 1 1 1 A 82 82 THR C C 82 181.010 176.824 4.186 1
1 953 . 1 1 1 A 82 82 THR CA C 82 68.500 66.214 2.286 1
1 954 . 1 1 1 A 82 82 THR CB C 82 67.400 68.962 -1.562 1
1 956 . 1 1 1 A 82 82 THR N N 82 117.120 114.804 2.316 1
1 957 . 1 1 1 A 83 83 VAL H H 83 8.530 7.538 0.992 1
1 958 . 1 1 1 A 83 83 VAL HA H 83 3.890 3.831 0.059 1
1 966 . 1 1 1 A 83 83 VAL C C 83 178.120 178.167 -0.047 1
1 967 . 1 1 1 A 83 83 VAL CA C 83 67.400 65.158 2.242 1
1 968 . 1 1 1 A 83 83 VAL CB C 83 31.590 31.521 0.069 1
1 971 . 1 1 1 A 83 83 VAL N N 83 119.760 118.171 1.589 1
1 972 . 1 1 1 A 84 84 ALA H H 84 7.910 8.468 -0.558 1
1 973 . 1 1 1 A 84 84 ALA HA H 84 4.060 4.118 -0.058 1
1 977 . 1 1 1 A 84 84 ALA C C 84 180.560 179.696 0.864 1
1 978 . 1 1 1 A 84 84 ALA CA C 84 55.000 55.235 -0.235 1
1 979 . 1 1 1 A 84 84 ALA CB C 84 17.230 18.148 -0.918 1
1 980 . 1 1 1 A 84 84 ALA N N 84 122.620 124.501 -1.881 1
1 981 . 1 1 1 A 85 85 CYS H H 85 8.580 8.070 0.510 1
1 982 . 1 1 1 A 85 85 CYS HA H 85 4.080 4.479 -0.399 1
1 985 . 1 1 1 A 85 85 CYS C C 85 179.060 177.152 1.908 1
1 986 . 1 1 1 A 85 85 CYS CA C 85 63.210 61.599 1.611 1
1 987 . 1 1 1 A 85 85 CYS CB C 85 26.310 27.255 -0.945 1
1 988 . 1 1 1 A 85 85 CYS N N 85 118.730 117.451 1.279 1
1 989 . 1 1 1 A 86 86 ASN H H 86 8.430 8.137 0.293 1
1 990 . 1 1 1 A 86 86 ASN CA C 86 55.860 56.834 -0.974 1
1 991 . 1 1 1 A 86 86 ASN CB C 86 37.440 39.706 -2.266 1
1 992 . 1 1 1 A 86 86 ASN N N 86 119.360 119.073 0.287 1
1 993 . 1 1 1 A 87 87 ASN H H 87 7.880 7.890 -0.010 1
1 994 . 1 1 1 A 87 87 ASN HA H 87 4.600 4.616 -0.016 1
1 997 . 1 1 1 A 87 87 ASN C C 87 178.510 177.483 1.027 1
1 998 . 1 1 1 A 87 87 ASN CA C 87 56.470 56.394 0.076 1
1 999 . 1 1 1 A 87 87 ASN CB C 87 37.500 38.799 -1.299 1
1 1000 . 1 1 1 A 87 87 ASN N N 87 119.480 117.728 1.752 1
1 1001 . 1 1 1 A 88 88 PHE H H 88 8.050 7.859 0.191 1
1 1002 . 1 1 1 A 88 88 PHE HA H 88 4.200 4.288 -0.088 1
1 1005 . 1 1 1 A 88 88 PHE C C 88 178.510 177.611 0.899 1
1 1006 . 1 1 1 A 88 88 PHE CA C 88 56.460 59.930 -3.470 1
1 1007 . 1 1 1 A 88 88 PHE CB C 88 38.500 39.941 -1.441 1
1 1008 . 1 1 1 A 88 88 PHE N N 88 120.280 119.866 0.414 1
1 1009 . 1 1 1 A 89 89 PHE H H 89 8.020 8.157 -0.137 1
1 1010 . 1 1 1 A 89 89 PHE HA H 89 4.000 4.277 -0.277 1
1 1013 . 1 1 1 A 89 89 PHE C C 89 177.340 177.958 -0.618 1
1 1014 . 1 1 1 A 89 89 PHE CA C 89 59.000 61.075 -2.075 1
1 1015 . 1 1 1 A 89 89 PHE CB C 89 37.430 39.081 -1.651 1
1 1016 . 1 1 1 A 89 89 PHE N N 89 120.910 119.573 1.337 1
1 1017 . 1 1 1 A 90 90 TRP H H 90 7.800 7.692 0.108 1
1 1018 . 1 1 1 A 90 90 TRP HA H 90 4.460 4.346 0.114 1
1 1021 . 1 1 1 A 90 90 TRP C C 90 177.340 178.261 -0.921 1
1 1022 . 1 1 1 A 90 90 TRP CA C 90 57.930 59.450 -1.520 1
1 1023 . 1 1 1 A 90 90 TRP CB C 90 42.000 30.272 11.728 1
1 1024 . 1 1 1 A 90 90 TRP N N 90 120.050 120.415 -0.365 1
1 1025 . 1 1 1 A 91 91 GLU H H 91 7.800 8.626 -0.826 1
1 1026 . 1 1 1 A 91 91 GLU HA H 91 4.050 3.755 0.295 1
1 1031 . 1 1 1 A 91 91 GLU C C 91 177.570 177.711 -0.141 1
1 1032 . 1 1 1 A 91 91 GLU CA C 91 57.350 59.883 -2.533 1
1 1033 . 1 1 1 A 91 91 GLU CB C 91 29.530 28.915 0.615 1
1 1035 . 1 1 1 A 91 91 GLU N N 91 120.730 118.549 2.181 1
1 1036 . 1 1 1 A 92 92 ASN H H 92 7.800 7.590 0.210 1
1 1037 . 1 1 1 A 92 92 ASN HA H 92 4.630 4.621 0.009 1
1 1040 . 1 1 1 A 92 92 ASN C C 92 174.450 174.098 0.352 1
1 1041 . 1 1 1 A 92 92 ASN CA C 92 52.960 52.550 0.410 1
1 1042 . 1 1 1 A 92 92 ASN CB C 92 29.530 38.655 -9.125 1
1 1043 . 1 1 1 A 92 92 ASN N N 92 119.410 114.979 4.431 1
1 5 . 2 1 1 A 2 2 SER H H 2 9.000 7.870 1.130 1
1 6 . 2 1 1 A 2 2 SER HA H 2 4.690 4.574 0.116 1
1 9 . 2 1 1 A 2 2 SER C C 2 176.170 175.236 0.934 1
1 10 . 2 1 1 A 2 2 SER CA C 2 57.340 58.030 -0.690 1
1 11 . 2 1 1 A 2 2 SER CB C 2 65.550 64.173 1.377 1
1 12 . 2 1 1 A 2 2 SER N N 2 119.330 115.854 3.476 1
1 13 . 2 1 1 A 3 3 GLU H H 3 9.350 8.996 0.354 1
1 14 . 2 1 1 A 3 3 GLU HA H 3 4.060 3.947 0.113 1
1 17 . 2 1 1 A 3 3 GLU C C 3 180.150 178.279 1.871 1
1 18 . 2 1 1 A 3 3 GLU CA C 3 60.280 59.733 0.547 1
1 19 . 2 1 1 A 3 3 GLU CB C 3 29.230 29.502 -0.272 1
1 21 . 2 1 1 A 3 3 GLU N N 3 125.350 126.416 -1.066 1
1 22 . 2 1 1 A 4 4 LEU H H 4 9.060 8.236 0.824 1
1 23 . 2 1 1 A 4 4 LEU HA H 4 4.080 4.000 0.080 1
1 33 . 2 1 1 A 4 4 LEU C C 4 177.890 179.409 -1.519 1
1 34 . 2 1 1 A 4 4 LEU CA C 4 58.090 58.028 0.062 1
1 35 . 2 1 1 A 4 4 LEU CB C 4 42.120 41.368 0.752 1
1 39 . 2 1 1 A 4 4 LEU N N 4 121.090 120.173 0.917 1
1 40 . 2 1 1 A 5 5 GLU H H 5 8.340 8.332 0.008 1
1 41 . 2 1 1 A 5 5 GLU HA H 5 4.050 3.954 0.096 1
1 46 . 2 1 1 A 5 5 GLU C C 5 177.030 179.438 -2.408 1
1 47 . 2 1 1 A 5 5 GLU CA C 5 59.840 59.455 0.385 1
1 48 . 2 1 1 A 5 5 GLU CB C 5 28.940 29.140 -0.200 1
1 50 . 2 1 1 A 5 5 GLU N N 5 119.780 120.315 -0.535 1
1 51 . 2 1 1 A 6 6 THR H H 6 8.370 8.796 -0.426 1
1 52 . 2 1 1 A 6 6 THR HA H 6 4.310 3.931 0.379 1
1 57 . 2 1 1 A 6 6 THR C C 6 177.340 176.983 0.357 1
1 58 . 2 1 1 A 6 6 THR CA C 6 66.630 66.471 0.159 1
1 59 . 2 1 1 A 6 6 THR CB C 6 68.650 68.682 -0.032 1
1 61 . 2 1 1 A 6 6 THR N N 6 116.940 116.955 -0.015 1
1 62 . 2 1 1 A 7 7 ALA H H 7 8.270 7.842 0.428 1
1 63 . 2 1 1 A 7 7 ALA HA H 7 4.190 4.317 -0.127 1
1 67 . 2 1 1 A 7 7 ALA C C 7 179.760 179.597 0.163 1
1 68 . 2 1 1 A 7 7 ALA CA C 7 55.880 55.123 0.757 1
1 69 . 2 1 1 A 7 7 ALA CB C 7 17.720 18.132 -0.412 1
1 70 . 2 1 1 A 7 7 ALA N N 7 127.400 124.313 3.087 1
1 71 . 2 1 1 A 8 8 MET H H 8 8.110 7.702 0.408 1
1 72 . 2 1 1 A 8 8 MET HA H 8 4.020 4.266 -0.246 1
1 80 . 2 1 1 A 8 8 MET C C 8 178.510 178.230 0.280 1
1 81 . 2 1 1 A 8 8 MET CA C 8 60.580 58.116 2.464 1
1 82 . 2 1 1 A 8 8 MET CB C 8 33.630 32.310 1.320 1
1 85 . 2 1 1 A 8 8 MET N N 8 117.520 118.398 -0.878 1
1 86 . 2 1 1 A 9 9 GLU H H 9 8.210 7.760 0.450 1
1 87 . 2 1 1 A 9 9 GLU HA H 9 3.830 4.178 -0.348 1
1 92 . 2 1 1 A 9 9 GLU C C 9 179.140 179.038 0.102 1
1 93 . 2 1 1 A 9 9 GLU CA C 9 59.690 59.137 0.553 1
1 94 . 2 1 1 A 9 9 GLU CB C 9 29.530 29.014 0.516 1
1 96 . 2 1 1 A 9 9 GLU N N 9 118.560 118.328 0.232 1
1 97 . 2 1 1 A 10 10 THR H H 10 8.490 7.675 0.815 1
1 98 . 2 1 1 A 10 10 THR HA H 10 4.000 3.984 0.016 1
1 103 . 2 1 1 A 10 10 THR C C 10 176.010 176.923 -0.913 1
1 104 . 2 1 1 A 10 10 THR CA C 10 67.110 66.939 0.171 1
1 105 . 2 1 1 A 10 10 THR CB C 10 67.770 68.583 -0.813 1
1 107 . 2 1 1 A 10 10 THR N N 10 118.310 116.600 1.710 1
1 108 . 2 1 1 A 11 11 LEU H H 11 7.920 7.913 0.007 1
1 109 . 2 1 1 A 11 11 LEU HA H 11 3.930 4.117 -0.187 1
1 119 . 2 1 1 A 11 11 LEU C C 11 178.820 179.267 -0.447 1
1 120 . 2 1 1 A 11 11 LEU CA C 11 59.690 58.311 1.379 1
1 121 . 2 1 1 A 11 11 LEU CB C 11 41.920 41.397 0.523 1
1 125 . 2 1 1 A 11 11 LEU N N 11 121.150 121.317 -0.167 1
1 126 . 2 1 1 A 12 12 ILE H H 12 7.440 7.852 -0.412 1
1 127 . 2 1 1 A 12 12 ILE HA H 12 3.640 3.639 0.001 1
1 137 . 2 1 1 A 12 12 ILE C C 12 179.530 178.707 0.823 1
1 138 . 2 1 1 A 12 12 ILE CA C 12 63.740 65.257 -1.517 1
1 139 . 2 1 1 A 12 12 ILE CB C 12 38.800 37.608 1.192 1
1 143 . 2 1 1 A 12 12 ILE N N 12 118.010 120.394 -2.384 1
1 144 . 2 1 1 A 13 13 ASN H H 13 8.930 7.927 1.003 1
1 145 . 2 1 1 A 13 13 ASN HA H 13 4.520 4.728 -0.208 1
1 148 . 2 1 1 A 13 13 ASN C C 13 179.450 177.853 1.597 1
1 149 . 2 1 1 A 13 13 ASN CA C 13 56.470 55.894 0.576 1
1 150 . 2 1 1 A 13 13 ASN CB C 13 37.930 38.638 -0.708 1
1 151 . 2 1 1 A 13 13 ASN N N 13 121.820 119.263 2.557 1
1 152 . 2 1 1 A 14 14 VAL H H 14 9.180 8.231 0.949 1
1 153 . 2 1 1 A 14 14 VAL HA H 14 3.830 3.844 -0.014 1
1 161 . 2 1 1 A 14 14 VAL CA C 14 65.840 65.394 0.446 1
1 162 . 2 1 1 A 14 14 VAL CB C 14 31.290 31.387 -0.097 1
1 165 . 2 1 1 A 14 14 VAL N N 14 122.040 119.251 2.789 1
1 166 . 2 1 1 A 15 15 PHE H H 15 7.590 8.137 -0.547 1
1 167 . 2 1 1 A 15 15 PHE HA H 15 3.360 4.010 -0.650 1
1 170 . 2 1 1 A 15 15 PHE C C 15 177.890 177.394 0.496 1
1 171 . 2 1 1 A 15 15 PHE CA C 15 62.030 61.928 0.102 1
1 172 . 2 1 1 A 15 15 PHE CB C 15 38.900 39.153 -0.253 1
1 173 . 2 1 1 A 15 15 PHE N N 15 118.290 122.195 -3.905 1
1 174 . 2 1 1 A 16 16 HIS H H 16 7.790 7.819 -0.029 1
1 175 . 2 1 1 A 16 16 HIS HA H 16 4.890 4.211 0.679 1
1 178 . 2 1 1 A 16 16 HIS C C 16 177.810 176.786 1.024 1
1 179 . 2 1 1 A 16 16 HIS CA C 16 59.100 59.920 -0.820 1
1 180 . 2 1 1 A 16 16 HIS CB C 16 28.060 29.264 -1.204 1
1 181 . 2 1 1 A 16 16 HIS N N 16 118.290 118.377 -0.087 1
1 182 . 2 1 1 A 17 17 ALA H H 17 8.040 7.816 0.224 1
1 183 . 2 1 1 A 17 17 ALA HA H 17 4.050 3.755 0.295 1
1 187 . 2 1 1 A 17 17 ALA C C 17 179.600 179.742 -0.142 1
1 188 . 2 1 1 A 17 17 ALA CA C 17 54.000 55.123 -1.123 1
1 189 . 2 1 1 A 17 17 ALA CB C 17 17.520 18.553 -1.033 1
1 190 . 2 1 1 A 17 17 ALA N N 17 124.410 120.827 3.583 1
1 191 . 2 1 1 A 18 18 HIS H H 18 7.000 7.425 -0.425 1
1 192 . 2 1 1 A 18 18 HIS HA H 18 4.330 4.219 0.111 1
1 195 . 2 1 1 A 18 18 HIS C C 18 176.320 178.021 -1.701 1
1 196 . 2 1 1 A 18 18 HIS CA C 18 57.350 59.526 -2.176 1
1 197 . 2 1 1 A 18 18 HIS CB C 18 32.920 30.099 2.821 1
1 198 . 2 1 1 A 18 18 HIS N N 18 115.160 115.880 -0.720 1
1 199 . 2 1 1 A 19 19 SER H H 19 8.380 8.140 0.240 1
1 200 . 2 1 1 A 19 19 SER HA H 19 3.640 4.051 -0.411 1
1 203 . 2 1 1 A 19 19 SER C C 19 177.340 175.820 1.520 1
1 204 . 2 1 1 A 19 19 SER CA C 19 60.160 60.851 -0.691 1
1 205 . 2 1 1 A 19 19 SER CB C 19 61.000 61.918 -0.918 1
1 206 . 2 1 1 A 19 19 SER N N 19 114.380 115.874 -1.494 1
1 207 . 2 1 1 A 20 20 GLY H H 20 7.600 7.686 -0.086 1
1 208 . 2 1 1 A 20 20 GLY HA2 H 20 3.680 3.484 0.196 1
1 209 . 2 1 1 A 20 20 GLY HA3 H 20 4.000 3.669 0.331 1
1 210 . 2 1 1 A 20 20 GLY C C 20 174.140 174.299 -0.159 1
1 211 . 2 1 1 A 20 20 GLY CA C 20 47.000 45.047 1.953 1
1 212 . 2 1 1 A 20 20 GLY N N 20 112.550 109.229 3.321 1
1 213 . 2 1 1 A 21 21 LYS H H 21 7.230 7.570 -0.340 1
1 214 . 2 1 1 A 21 21 LYS HA H 21 3.860 4.276 -0.416 1
1 223 . 2 1 1 A 21 21 LYS C C 21 177.730 177.538 0.192 1
1 224 . 2 1 1 A 21 21 LYS CA C 21 59.110 56.884 2.226 1
1 225 . 2 1 1 A 21 21 LYS CB C 21 32.460 34.648 -2.188 1
1 229 . 2 1 1 A 21 21 LYS N N 21 123.240 118.249 4.991 1
1 230 . 2 1 1 A 22 22 GLU H H 22 9.350 7.848 1.502 1
1 231 . 2 1 1 A 22 22 GLU HA H 22 4.610 4.289 0.321 1
1 236 . 2 1 1 A 22 22 GLU C C 22 177.420 176.020 1.400 1
1 237 . 2 1 1 A 22 22 GLU CA C 22 53.700 56.225 -2.525 1
1 238 . 2 1 1 A 22 22 GLU CB C 22 32.000 29.724 2.276 1
1 240 . 2 1 1 A 22 22 GLU N N 22 116.770 117.118 -0.348 1
1 241 . 2 1 1 A 23 23 GLY H H 23 7.570 7.274 0.296 1
1 242 . 2 1 1 A 23 23 GLY HA2 H 23 3.630 4.008 -0.378 1
1 243 . 2 1 1 A 23 23 GLY HA3 H 23 3.880 4.019 -0.139 1
1 244 . 2 1 1 A 23 23 GLY C C 23 173.980 172.327 1.653 1
1 245 . 2 1 1 A 23 23 GLY CA C 23 45.250 45.606 -0.356 1
1 246 . 2 1 1 A 23 23 GLY N N 23 112.180 107.620 4.560 1
1 247 . 2 1 1 A 24 24 ASP H H 24 8.680 8.482 0.198 1
1 248 . 2 1 1 A 24 24 ASP HA H 24 4.380 4.470 -0.090 1
1 251 . 2 1 1 A 24 24 ASP C C 24 178.590 177.549 1.041 1
1 252 . 2 1 1 A 24 24 ASP CA C 24 60.000 54.758 5.242 1
1 253 . 2 1 1 A 24 24 ASP CB C 24 27.480 42.243 -14.763 1
1 254 . 2 1 1 A 24 24 ASP N N 24 127.470 120.420 7.050 1
1 255 . 2 1 1 A 25 25 LYS H H 25 9.270 8.719 0.551 1
1 256 . 2 1 1 A 25 25 LYS HA H 25 4.250 3.727 0.523 1
1 265 . 2 1 1 A 25 25 LYS C C 25 177.030 176.336 0.694 1
1 266 . 2 1 1 A 25 25 LYS CA C 25 60.000 59.128 0.872 1
1 267 . 2 1 1 A 25 25 LYS CB C 25 31.170 32.270 -1.100 1
1 271 . 2 1 1 A 25 25 LYS N N 25 132.960 124.796 8.164 1
1 272 . 2 1 1 A 26 26 TYR H H 26 9.430 7.788 1.642 1
1 273 . 2 1 1 A 26 26 TYR HA H 26 4.640 4.836 -0.196 1
1 276 . 2 1 1 A 26 26 TYR C C 26 174.290 174.566 -0.276 1
1 277 . 2 1 1 A 26 26 TYR CA C 26 56.010 57.499 -1.489 1
1 278 . 2 1 1 A 26 26 TYR CB C 26 37.730 38.778 -1.048 1
1 279 . 2 1 1 A 26 26 TYR N N 26 120.650 113.993 6.657 1
1 280 . 2 1 1 A 27 27 LYS H H 27 7.110 7.352 -0.242 1
1 281 . 2 1 1 A 27 27 LYS HA H 27 5.110 5.186 -0.076 1
1 290 . 2 1 1 A 27 27 LYS C C 27 175.150 174.395 0.755 1
1 291 . 2 1 1 A 27 27 LYS CA C 27 55.070 55.221 -0.151 1
1 292 . 2 1 1 A 27 27 LYS CB C 27 38.900 36.386 2.514 1
1 296 . 2 1 1 A 27 27 LYS N N 27 115.830 121.148 -5.318 1
1 297 . 2 1 1 A 28 28 LEU H H 28 9.820 8.520 1.300 1
1 298 . 2 1 1 A 28 28 LEU HA H 28 5.080 4.835 0.245 1
1 308 . 2 1 1 A 28 28 LEU C C 28 176.640 175.514 1.126 1
1 309 . 2 1 1 A 28 28 LEU CA C 28 52.660 54.301 -1.641 1
1 310 . 2 1 1 A 28 28 LEU CB C 28 42.710 43.609 -0.899 1
1 314 . 2 1 1 A 28 28 LEU N N 28 126.930 128.037 -1.107 1
1 315 . 2 1 1 A 29 29 SER H H 29 9.890 8.483 1.407 1
1 316 . 2 1 1 A 29 29 SER HA H 29 4.530 5.090 -0.560 1
1 319 . 2 1 1 A 29 29 SER C C 29 174.990 174.801 0.189 1
1 320 . 2 1 1 A 29 29 SER CA C 29 56.180 56.144 0.036 1
1 321 . 2 1 1 A 29 29 SER CB C 29 65.550 65.558 -0.008 1
1 322 . 2 1 1 A 29 29 SER N N 29 121.600 116.737 4.863 1
1 323 . 2 1 1 A 30 30 LYS H H 30 8.850 8.850 0.000 1
1 324 . 2 1 1 A 30 30 LYS HA H 30 3.850 3.994 -0.144 1
1 333 . 2 1 1 A 30 30 LYS C C 30 175.620 177.469 -1.849 1
1 334 . 2 1 1 A 30 30 LYS CA C 30 60.860 60.007 0.853 1
1 335 . 2 1 1 A 30 30 LYS CB C 30 31.290 32.193 -0.903 1
1 339 . 2 1 1 A 30 30 LYS N N 30 121.260 126.735 -5.475 1
1 340 . 2 1 1 A 31 31 LYS H H 31 7.970 7.912 0.058 1
1 341 . 2 1 1 A 31 31 LYS HA H 31 3.880 4.068 -0.188 1
1 350 . 2 1 1 A 31 31 LYS C C 31 179.290 179.413 -0.123 1
1 351 . 2 1 1 A 31 31 LYS CA C 31 59.110 59.266 -0.156 1
1 352 . 2 1 1 A 31 31 LYS CB C 31 32.640 31.637 1.003 1
1 356 . 2 1 1 A 31 31 LYS N N 31 121.260 118.729 2.531 1
1 357 . 2 1 1 A 32 32 GLU H H 32 7.510 7.989 -0.479 1
1 358 . 2 1 1 A 32 32 GLU HA H 32 3.830 4.072 -0.242 1
1 363 . 2 1 1 A 32 32 GLU C C 32 179.290 179.549 -0.259 1
1 364 . 2 1 1 A 32 32 GLU CA C 32 58.590 58.991 -0.401 1
1 365 . 2 1 1 A 32 32 GLU CB C 32 30.120 29.982 0.138 1
1 367 . 2 1 1 A 32 32 GLU N N 32 120.090 119.454 0.636 1
1 368 . 2 1 1 A 33 33 LEU H H 33 8.970 7.839 1.131 1
1 369 . 2 1 1 A 33 33 LEU HA H 33 3.830 4.013 -0.183 1
1 379 . 2 1 1 A 33 33 LEU C C 33 178.200 178.876 -0.676 1
1 380 . 2 1 1 A 33 33 LEU CA C 33 57.930 58.123 -0.193 1
1 381 . 2 1 1 A 33 33 LEU CB C 33 40.660 41.733 -1.073 1
1 385 . 2 1 1 A 33 33 LEU N N 33 120.200 119.523 0.677 1
1 386 . 2 1 1 A 34 34 LYS H H 34 8.230 7.741 0.489 1
1 387 . 2 1 1 A 34 34 LYS HA H 34 3.550 3.949 -0.399 1
1 396 . 2 1 1 A 34 34 LYS C C 34 178.040 178.751 -0.711 1
1 397 . 2 1 1 A 34 34 LYS CA C 34 60.720 59.058 1.662 1
1 398 . 2 1 1 A 34 34 LYS CB C 34 31.980 31.958 0.022 1
1 402 . 2 1 1 A 34 34 LYS N N 34 120.780 119.194 1.586 1
1 403 . 2 1 1 A 35 35 ASP H H 35 7.990 7.987 0.003 1
1 404 . 2 1 1 A 35 35 ASP HA H 35 4.250 4.698 -0.448 1
1 407 . 2 1 1 A 35 35 ASP C C 35 179.060 178.578 0.482 1
1 408 . 2 1 1 A 35 35 ASP CA C 35 56.830 57.357 -0.527 1
1 409 . 2 1 1 A 35 35 ASP CB C 35 40.440 40.361 0.079 1
1 410 . 2 1 1 A 35 35 ASP N N 35 119.550 119.760 -0.210 1
1 411 . 2 1 1 A 36 36 LEU H H 36 8.130 7.685 0.445 1
1 412 . 2 1 1 A 36 36 LEU HA H 36 2.580 3.559 -0.979 1
1 422 . 2 1 1 A 36 36 LEU C C 36 179.450 178.788 0.662 1
1 423 . 2 1 1 A 36 36 LEU CA C 36 59.980 57.827 2.153 1
1 424 . 2 1 1 A 36 36 LEU CB C 36 42.180 41.437 0.743 1
1 428 . 2 1 1 A 36 36 LEU N N 36 125.560 121.270 4.290 1
1 429 . 2 1 1 A 37 37 LEU H H 37 8.740 7.809 0.931 1
1 430 . 2 1 1 A 37 37 LEU HA H 37 3.580 4.159 -0.579 1
1 440 . 2 1 1 A 37 37 LEU C C 37 179.290 179.162 0.128 1
1 441 . 2 1 1 A 37 37 LEU CA C 37 58.230 57.970 0.260 1
1 442 . 2 1 1 A 37 37 LEU CB C 37 41.590 41.654 -0.064 1
1 446 . 2 1 1 A 37 37 LEU N N 37 120.520 118.495 2.025 1
1 447 . 2 1 1 A 38 38 GLN H H 38 8.520 8.142 0.378 1
1 448 . 2 1 1 A 38 38 GLN HA H 38 4.000 4.072 -0.072 1
1 453 . 2 1 1 A 38 38 GLN C C 38 177.960 178.322 -0.362 1
1 454 . 2 1 1 A 38 38 GLN CA C 38 58.210 58.221 -0.011 1
1 455 . 2 1 1 A 38 38 GLN CB C 38 28.650 28.155 0.495 1
1 457 . 2 1 1 A 38 38 GLN N N 38 116.740 117.970 -1.230 1
1 458 . 2 1 1 A 39 39 THR H H 39 7.910 7.636 0.274 1
1 459 . 2 1 1 A 39 39 THR HA H 39 4.210 3.868 0.342 1
1 464 . 2 1 1 A 39 39 THR C C 39 177.180 175.827 1.353 1
1 465 . 2 1 1 A 39 39 THR CA C 39 64.730 67.106 -2.376 1
1 466 . 2 1 1 A 39 39 THR CB C 39 69.650 68.808 0.842 1
1 468 . 2 1 1 A 39 39 THR N N 39 111.400 117.096 -5.696 1
1 469 . 2 1 1 A 40 40 GLU H H 40 8.590 7.817 0.773 1
1 470 . 2 1 1 A 40 40 GLU HA H 40 4.680 4.459 0.221 1
1 475 . 2 1 1 A 40 40 GLU C C 40 178.280 177.097 1.183 1
1 476 . 2 1 1 A 40 40 GLU CA C 40 55.880 56.565 -0.685 1
1 477 . 2 1 1 A 40 40 GLU CB C 40 30.990 30.664 0.326 1
1 479 . 2 1 1 A 40 40 GLU N N 40 117.840 116.420 1.420 1
1 480 . 2 1 1 A 41 41 LEU H H 41 7.680 7.646 0.034 1
1 481 . 2 1 1 A 41 41 LEU HA H 41 5.080 4.795 0.285 1
1 491 . 2 1 1 A 41 41 LEU C C 41 179.450 176.727 2.723 1
1 492 . 2 1 1 A 41 41 LEU CA C 41 53.830 53.528 0.302 1
1 493 . 2 1 1 A 41 41 LEU CB C 41 41.360 42.772 -1.412 1
1 497 . 2 1 1 A 41 41 LEU N N 41 121.410 119.651 1.759 1
1 498 . 2 1 1 A 42 42 SER H H 42 8.380 8.371 0.009 1
1 499 . 2 1 1 A 42 42 SER HA H 42 4.130 4.155 -0.025 1
1 502 . 2 1 1 A 42 42 SER C C 42 176.640 176.488 0.152 1
1 503 . 2 1 1 A 42 42 SER CA C 42 61.280 61.603 -0.323 1
1 504 . 2 1 1 A 42 42 SER CB C 42 63.040 62.671 0.369 1
1 505 . 2 1 1 A 42 42 SER N N 42 117.420 115.821 1.599 1
1 506 . 2 1 1 A 43 43 SER H H 43 8.900 8.083 0.817 1
1 507 . 2 1 1 A 43 43 SER HA H 43 4.290 4.235 0.055 1
1 510 . 2 1 1 A 43 43 SER C C 43 175.620 177.223 -1.603 1
1 511 . 2 1 1 A 43 43 SER CA C 43 60.860 61.328 -0.468 1
1 512 . 2 1 1 A 43 43 SER CB C 43 62.910 62.959 -0.049 1
1 513 . 2 1 1 A 43 43 SER N N 43 117.580 116.740 0.840 1
1 514 . 2 1 1 A 44 44 PHE H H 44 7.880 8.005 -0.125 1
1 515 . 2 1 1 A 44 44 PHE HA H 44 4.240 4.199 0.041 1
1 518 . 2 1 1 A 44 44 PHE C C 44 176.950 175.635 1.315 1
1 519 . 2 1 1 A 44 44 PHE CA C 44 62.710 61.311 1.399 1
1 520 . 2 1 1 A 44 44 PHE CB C 44 39.020 38.975 0.045 1
1 521 . 2 1 1 A 44 44 PHE N N 44 119.480 121.786 -2.306 1
1 522 . 2 1 1 A 45 45 LEU H H 45 8.060 8.073 -0.013 1
1 523 . 2 1 1 A 45 45 LEU HA H 45 3.810 3.988 -0.178 1
1 533 . 2 1 1 A 45 45 LEU C C 45 177.500 176.614 0.886 1
1 534 . 2 1 1 A 45 45 LEU CA C 45 59.980 55.824 4.156 1
1 535 . 2 1 1 A 45 45 LEU CB C 45 39.640 42.320 -2.680 1
1 538 . 2 1 1 A 45 45 LEU N N 45 118.010 121.774 -3.764 1
1 539 . 2 1 1 A 46 46 ASP H H 46 8.150 8.568 -0.418 1
1 540 . 2 1 1 A 46 46 ASP HA H 46 4.470 4.631 -0.161 1
1 543 . 2 1 1 A 46 46 ASP C C 46 179.920 175.948 3.972 1
1 544 . 2 1 1 A 46 46 ASP CA C 46 52.950 53.423 -0.473 1
1 545 . 2 1 1 A 46 46 ASP CB C 46 40.000 41.105 -1.105 1
1 546 . 2 1 1 A 46 46 ASP N N 46 119.460 126.087 -6.627 1
1 547 . 2 1 1 A 47 47 VAL H H 47 8.010 8.514 -0.504 1
1 548 . 2 1 1 A 47 47 VAL HA H 47 3.800 4.402 -0.602 1
1 556 . 2 1 1 A 47 47 VAL C C 47 175.460 176.631 -1.171 1
1 557 . 2 1 1 A 47 47 VAL CA C 47 60.000 62.547 -2.547 1
1 558 . 2 1 1 A 47 47 VAL CB C 47 31.580 33.789 -2.209 1
1 561 . 2 1 1 A 47 47 VAL N N 47 117.720 120.261 -2.541 1
1 562 . 2 1 1 A 48 48 GLN H H 48 7.960 8.240 -0.280 1
1 563 . 2 1 1 A 48 48 GLN HA H 48 4.060 4.235 -0.175 1
1 568 . 2 1 1 A 48 48 GLN C C 48 179.370 178.142 1.228 1
1 569 . 2 1 1 A 48 48 GLN CA C 48 57.350 58.575 -1.225 1
1 570 . 2 1 1 A 48 48 GLN CB C 48 28.990 29.249 -0.259 1
1 572 . 2 1 1 A 48 48 GLN N N 48 119.900 120.547 -0.647 1
1 573 . 2 1 1 A 49 49 LYS H H 49 7.810 8.039 -0.229 1
1 574 . 2 1 1 A 49 49 LYS HA H 49 3.860 4.119 -0.259 1
1 583 . 2 1 1 A 49 49 LYS C C 49 177.890 176.353 1.537 1
1 584 . 2 1 1 A 49 49 LYS CA C 49 58.230 59.093 -0.863 1
1 585 . 2 1 1 A 49 49 LYS CB C 49 30.990 32.197 -1.207 1
1 587 . 2 1 1 A 49 49 LYS N N 49 120.030 118.510 1.520 1
1 588 . 2 1 1 A 50 50 ASP H H 50 7.570 7.599 -0.029 1
1 589 . 2 1 1 A 50 50 ASP HA H 50 4.700 4.896 -0.196 1
1 590 . 2 1 1 A 50 50 ASP CA C 50 52.950 52.593 0.357 1
1 591 . 2 1 1 A 50 50 ASP CB C 50 38.900 40.143 -1.243 1
1 592 . 2 1 1 A 50 50 ASP N N 50 116.730 118.920 -2.190 1
1 593 . 2 1 1 A 51 51 ALA H H 51 7.570 8.795 -1.225 1
1 594 . 2 1 1 A 51 51 ALA HA H 51 4.200 3.999 0.201 1
1 598 . 2 1 1 A 51 51 ALA C C 51 179.760 179.258 0.502 1
1 599 . 2 1 1 A 51 51 ALA CA C 51 54.200 55.443 -1.243 1
1 600 . 2 1 1 A 51 51 ALA CB C 51 18.110 18.448 -0.338 1
1 601 . 2 1 1 A 51 51 ALA N N 51 118.390 128.116 -9.726 1
1 602 . 2 1 1 A 52 52 ASP H H 52 8.430 8.282 0.148 1
1 603 . 2 1 1 A 52 52 ASP HA H 52 4.600 4.354 0.246 1
1 606 . 2 1 1 A 52 52 ASP C C 52 177.570 178.121 -0.551 1
1 607 . 2 1 1 A 52 52 ASP CA C 52 54.420 57.149 -2.729 1
1 608 . 2 1 1 A 52 52 ASP CB C 52 40.360 42.222 -1.862 1
1 609 . 2 1 1 A 52 52 ASP N N 52 117.530 118.637 -1.107 1
1 610 . 2 1 1 A 53 53 ALA H H 53 7.660 7.715 -0.055 1
1 611 . 2 1 1 A 53 53 ALA HA H 53 3.860 3.988 -0.128 1
1 615 . 2 1 1 A 53 53 ALA C C 53 180.070 180.344 -0.274 1
1 616 . 2 1 1 A 53 53 ALA CA C 53 55.590 55.435 0.155 1
1 617 . 2 1 1 A 53 53 ALA CB C 53 18.800 17.948 0.852 1
1 618 . 2 1 1 A 53 53 ALA N N 53 123.450 121.479 1.971 1
1 619 . 2 1 1 A 54 54 VAL H H 54 8.030 7.840 0.190 1
1 620 . 2 1 1 A 54 54 VAL HA H 54 3.240 3.542 -0.302 1
1 628 . 2 1 1 A 54 54 VAL C C 54 177.340 177.621 -0.281 1
1 629 . 2 1 1 A 54 54 VAL CA C 54 66.620 66.241 0.379 1
1 630 . 2 1 1 A 54 54 VAL CB C 54 30.480 30.921 -0.441 1
1 633 . 2 1 1 A 54 54 VAL N N 54 116.150 117.991 -1.841 1
1 634 . 2 1 1 A 55 55 ASP H H 55 7.660 7.884 -0.224 1
1 635 . 2 1 1 A 55 55 ASP HA H 55 4.080 4.296 -0.216 1
1 638 . 2 1 1 A 55 55 ASP C C 55 177.260 178.748 -1.488 1
1 639 . 2 1 1 A 55 55 ASP CA C 55 57.640 57.703 -0.063 1
1 640 . 2 1 1 A 55 55 ASP CB C 55 40.360 40.854 -0.494 1
1 641 . 2 1 1 A 55 55 ASP N N 55 120.830 121.654 -0.824 1
1 642 . 2 1 1 A 56 56 LYS H H 56 7.780 7.575 0.205 1
1 643 . 2 1 1 A 56 56 LYS HA H 56 3.860 4.006 -0.146 1
1 652 . 2 1 1 A 56 56 LYS C C 56 179.530 179.481 0.049 1
1 653 . 2 1 1 A 56 56 LYS CA C 56 59.690 59.559 0.131 1
1 654 . 2 1 1 A 56 56 LYS CB C 56 31.870 32.304 -0.434 1
1 658 . 2 1 1 A 56 56 LYS N N 56 120.010 118.482 1.528 1
1 659 . 2 1 1 A 57 57 ILE H H 57 8.090 7.950 0.140 1
1 660 . 2 1 1 A 57 57 ILE HA H 57 3.390 3.558 -0.168 1
1 670 . 2 1 1 A 57 57 ILE C C 57 176.710 177.472 -0.762 1
1 671 . 2 1 1 A 57 57 ILE CA C 57 64.960 65.209 -0.249 1
1 672 . 2 1 1 A 57 57 ILE CB C 57 38.080 38.270 -0.190 1
1 676 . 2 1 1 A 57 57 ILE N N 57 120.960 120.420 0.540 1
1 677 . 2 1 1 A 58 58 MET H H 58 8.480 8.322 0.158 1
1 678 . 2 1 1 A 58 58 MET HA H 58 3.800 4.128 -0.328 1
1 686 . 2 1 1 A 58 58 MET C C 58 177.570 178.337 -0.767 1
1 687 . 2 1 1 A 58 58 MET CA C 58 58.570 58.300 0.270 1
1 688 . 2 1 1 A 58 58 MET CB C 58 32.570 31.941 0.629 1
1 691 . 2 1 1 A 58 58 MET N N 58 119.160 120.706 -1.546 1
1 692 . 2 1 1 A 59 59 LYS H H 59 7.550 7.941 -0.391 1
1 693 . 2 1 1 A 59 59 LYS HA H 59 3.930 3.952 -0.022 1
1 702 . 2 1 1 A 59 59 LYS C C 59 179.530 179.418 0.112 1
1 703 . 2 1 1 A 59 59 LYS CA C 59 58.820 59.696 -0.876 1
1 704 . 2 1 1 A 59 59 LYS CB C 59 32.450 32.475 -0.025 1
1 708 . 2 1 1 A 59 59 LYS N N 59 116.730 119.687 -2.957 1
1 709 . 2 1 1 A 60 60 GLU H H 60 7.470 7.879 -0.409 1
1 710 . 2 1 1 A 60 60 GLU HA H 60 4.050 4.078 -0.028 1
1 715 . 2 1 1 A 60 60 GLU C C 60 178.950 178.511 0.439 1
1 716 . 2 1 1 A 60 60 GLU CA C 60 58.600 59.192 -0.592 1
1 717 . 2 1 1 A 60 60 GLU CB C 60 31.700 29.235 2.465 1
1 719 . 2 1 1 A 60 60 GLU N N 60 116.820 119.377 -2.557 1
1 720 . 2 1 1 A 61 61 LEU H H 61 8.030 7.967 0.063 1
1 721 . 2 1 1 A 61 61 LEU HA H 61 4.310 4.231 0.079 1
1 731 . 2 1 1 A 61 61 LEU C C 61 179.450 177.074 2.376 1
1 732 . 2 1 1 A 61 61 LEU CA C 61 54.840 56.379 -1.539 1
1 733 . 2 1 1 A 61 61 LEU CB C 61 43.820 41.710 2.110 1
1 737 . 2 1 1 A 61 61 LEU N N 61 116.000 120.690 -4.690 1
1 738 . 2 1 1 A 62 62 ASP H H 62 7.890 7.945 -0.055 1
1 739 . 2 1 1 A 62 62 ASP HA H 62 4.660 4.733 -0.073 1
1 742 . 2 1 1 A 62 62 ASP C C 62 177.030 176.901 0.129 1
1 743 . 2 1 1 A 62 62 ASP CA C 62 53.660 52.723 0.937 1
1 744 . 2 1 1 A 62 62 ASP CB C 62 38.700 39.151 -0.451 1
1 745 . 2 1 1 A 62 62 ASP N N 62 117.550 119.818 -2.268 1
1 746 . 2 1 1 A 63 63 GLU H H 63 8.430 8.207 0.223 1
1 747 . 2 1 1 A 63 63 GLU HA H 63 4.020 4.078 -0.058 1
1 752 . 2 1 1 A 63 63 GLU C C 63 178.120 178.584 -0.464 1
1 753 . 2 1 1 A 63 63 GLU CA C 63 58.470 59.209 -0.739 1
1 754 . 2 1 1 A 63 63 GLU CB C 63 30.120 29.681 0.439 1
1 756 . 2 1 1 A 63 63 GLU N N 63 130.230 125.136 5.094 1
1 757 . 2 1 1 A 64 64 ASN H H 64 8.010 7.912 0.098 1
1 758 . 2 1 1 A 64 64 ASN HA H 64 4.680 4.618 0.062 1
1 761 . 2 1 1 A 64 64 ASN C C 64 177.100 176.227 0.873 1
1 762 . 2 1 1 A 64 64 ASN CA C 64 51.780 52.548 -0.768 1
1 763 . 2 1 1 A 64 64 ASN CB C 64 37.260 37.968 -0.708 1
1 764 . 2 1 1 A 64 64 ASN N N 64 113.640 114.487 -0.847 1
1 765 . 2 1 1 A 65 65 GLY H H 65 7.550 7.943 -0.393 1
1 766 . 2 1 1 A 65 65 GLY HA2 H 65 3.770 3.958 -0.188 1
1 767 . 2 1 1 A 65 65 GLY HA3 H 65 3.770 3.959 -0.189 1
1 768 . 2 1 1 A 65 65 GLY C C 65 178.980 174.062 4.918 1
1 769 . 2 1 1 A 65 65 GLY CA C 65 47.200 46.112 1.088 1
1 770 . 2 1 1 A 65 65 GLY N N 65 113.640 108.981 4.659 1
1 771 . 2 1 1 A 66 66 ASP H H 66 8.110 8.490 -0.380 1
1 772 . 2 1 1 A 66 66 ASP HA H 66 4.490 4.955 -0.465 1
1 775 . 2 1 1 A 66 66 ASP C C 66 177.960 175.859 2.101 1
1 776 . 2 1 1 A 66 66 ASP CA C 66 52.960 52.988 -0.028 1
1 777 . 2 1 1 A 66 66 ASP CB C 66 40.540 41.091 -0.551 1
1 778 . 2 1 1 A 66 66 ASP N N 66 120.030 120.015 0.015 1
1 779 . 2 1 1 A 67 67 GLY H H 67 10.260 7.850 2.410 1
1 780 . 2 1 1 A 67 67 GLY HA2 H 67 3.360 4.133 -0.773 1
1 781 . 2 1 1 A 67 67 GLY HA3 H 67 4.000 4.135 -0.135 1
1 782 . 2 1 1 A 67 67 GLY C C 67 173.120 173.489 -0.369 1
1 783 . 2 1 1 A 67 67 GLY CA C 67 45.460 45.725 -0.265 1
1 784 . 2 1 1 A 67 67 GLY N N 67 114.100 108.778 5.322 1
1 785 . 2 1 1 A 68 68 GLU H H 68 7.750 7.753 -0.003 1
1 786 . 2 1 1 A 68 68 GLU HA H 68 4.780 4.965 -0.185 1
1 791 . 2 1 1 A 68 68 GLU C C 68 175.930 175.214 0.716 1
1 792 . 2 1 1 A 68 68 GLU CA C 68 54.430 54.538 -0.108 1
1 793 . 2 1 1 A 68 68 GLU CB C 68 35.850 33.720 2.130 1
1 795 . 2 1 1 A 68 68 GLU N N 68 118.000 119.443 -1.443 1
1 796 . 2 1 1 A 69 69 VAL H H 69 9.380 8.408 0.972 1
1 797 . 2 1 1 A 69 69 VAL HA H 69 5.260 4.888 0.372 1
1 805 . 2 1 1 A 69 69 VAL C C 69 176.710 174.642 2.068 1
1 806 . 2 1 1 A 69 69 VAL CA C 69 61.280 60.856 0.424 1
1 807 . 2 1 1 A 69 69 VAL CB C 69 33.980 34.823 -0.843 1
1 810 . 2 1 1 A 69 69 VAL N N 69 125.970 120.994 4.976 1
1 811 . 2 1 1 A 70 70 ASP H H 70 9.100 9.267 -0.167 1
1 812 . 2 1 1 A 70 70 ASP HA H 70 5.190 5.053 0.137 1
1 815 . 2 1 1 A 70 70 ASP C C 70 175.700 177.633 -1.933 1
1 816 . 2 1 1 A 70 70 ASP CA C 70 52.370 53.193 -0.823 1
1 817 . 2 1 1 A 70 70 ASP CB C 70 40.950 42.352 -1.402 1
1 818 . 2 1 1 A 70 70 ASP N N 70 130.320 126.560 3.760 1
1 819 . 2 1 1 A 71 71 PHE H H 71 9.090 9.330 -0.240 1
1 820 . 2 1 1 A 71 71 PHE HA H 71 4.100 3.836 0.264 1
1 823 . 2 1 1 A 71 71 PHE C C 71 177.000 177.037 -0.037 1
1 824 . 2 1 1 A 71 71 PHE CA C 71 58.230 61.955 -3.725 1
1 825 . 2 1 1 A 71 71 PHE CB C 71 36.910 39.361 -2.451 1
1 826 . 2 1 1 A 71 71 PHE N N 71 119.760 123.262 -3.502 1
1 827 . 2 1 1 A 72 72 GLN H H 72 8.440 8.278 0.162 1
1 828 . 2 1 1 A 72 72 GLN HA H 72 3.600 3.896 -0.296 1
1 831 . 2 1 1 A 72 72 GLN C C 72 178.820 178.690 0.130 1
1 832 . 2 1 1 A 72 72 GLN CA C 72 59.500 59.202 0.298 1
1 833 . 2 1 1 A 72 72 GLN CB C 72 29.553 28.653 0.900 1
1 835 . 2 1 1 A 72 72 GLN N N 72 121.820 118.179 3.641 1
1 836 . 2 1 1 A 73 73 GLU H H 73 8.290 8.482 -0.192 1
1 837 . 2 1 1 A 73 73 GLU HA H 73 4.070 4.018 0.052 1
1 842 . 2 1 1 A 73 73 GLU C C 73 179.370 178.900 0.470 1
1 843 . 2 1 1 A 73 73 GLU CA C 73 58.030 58.781 -0.751 1
1 844 . 2 1 1 A 73 73 GLU CB C 73 29.530 29.964 -0.434 1
1 846 . 2 1 1 A 73 73 GLU N N 73 120.550 120.448 0.102 1
1 847 . 2 1 1 A 74 74 PHE H H 74 8.630 8.548 0.082 1
1 848 . 2 1 1 A 74 74 PHE HA H 74 4.020 4.057 -0.037 1
1 851 . 2 1 1 A 74 74 PHE C C 74 177.890 176.808 1.082 1
1 852 . 2 1 1 A 74 74 PHE CA C 74 60.090 61.257 -1.167 1
1 853 . 2 1 1 A 74 74 PHE CB C 74 38.020 39.193 -1.173 1
1 854 . 2 1 1 A 74 74 PHE N N 74 121.010 121.655 -0.645 1
1 855 . 2 1 1 A 75 75 VAL H H 75 8.080 8.119 -0.039 1
1 856 . 2 1 1 A 75 75 VAL HA H 75 2.860 3.143 -0.283 1
1 864 . 2 1 1 A 75 75 VAL C C 75 177.030 178.007 -0.977 1
1 865 . 2 1 1 A 75 75 VAL CA C 75 66.430 66.074 0.356 1
1 866 . 2 1 1 A 75 75 VAL CB C 75 30.600 31.313 -0.713 1
1 869 . 2 1 1 A 75 75 VAL N N 75 119.460 118.724 0.736 1
1 870 . 2 1 1 A 76 76 VAL H H 76 7.100 8.039 -0.939 1
1 871 . 2 1 1 A 76 76 VAL HA H 76 3.330 3.450 -0.120 1
1 879 . 2 1 1 A 76 76 VAL C C 76 178.670 178.018 0.652 1
1 880 . 2 1 1 A 76 76 VAL CA C 76 67.000 66.676 0.324 1
1 881 . 2 1 1 A 76 76 VAL CB C 76 31.280 31.418 -0.138 1
1 884 . 2 1 1 A 76 76 VAL N N 76 121.030 120.496 0.534 1
1 885 . 2 1 1 A 77 77 LEU H H 77 6.900 7.596 -0.696 1
1 886 . 2 1 1 A 77 77 LEU HA H 77 3.800 3.887 -0.087 1
1 896 . 2 1 1 A 77 77 LEU C C 77 177.960 178.466 -0.506 1
1 897 . 2 1 1 A 77 77 LEU CA C 77 57.710 58.005 -0.295 1
1 898 . 2 1 1 A 77 77 LEU CB C 77 40.070 41.545 -1.475 1
1 902 . 2 1 1 A 77 77 LEU N N 77 120.310 120.668 -0.358 1
1 903 . 2 1 1 A 78 78 VAL H H 78 7.240 7.276 -0.036 1
1 904 . 2 1 1 A 78 78 VAL HA H 78 3.030 3.588 -0.558 1
1 912 . 2 1 1 A 78 78 VAL C C 78 179.600 178.147 1.453 1
1 913 . 2 1 1 A 78 78 VAL CA C 78 66.420 66.162 0.258 1
1 914 . 2 1 1 A 78 78 VAL CB C 78 30.700 31.293 -0.593 1
1 917 . 2 1 1 A 78 78 VAL N N 78 117.180 119.387 -2.207 1
1 918 . 2 1 1 A 79 79 ALA H H 79 9.000 8.229 0.771 1
1 919 . 2 1 1 A 79 79 ALA HA H 79 3.610 3.933 -0.323 1
1 923 . 2 1 1 A 79 79 ALA C C 79 182.260 180.086 2.174 1
1 924 . 2 1 1 A 79 79 ALA CA C 79 55.580 55.423 0.157 1
1 925 . 2 1 1 A 79 79 ALA CB C 79 18.400 17.991 0.409 1
1 926 . 2 1 1 A 79 79 ALA N N 79 126.000 122.112 3.888 1
1 927 . 2 1 1 A 80 80 ALA H H 80 8.000 7.664 0.336 1
1 928 . 2 1 1 A 80 80 ALA HA H 80 4.100 4.061 0.039 1
1 932 . 2 1 1 A 80 80 ALA C C 80 175.460 179.874 -4.414 1
1 933 . 2 1 1 A 80 80 ALA CA C 80 56.020 54.381 1.639 1
1 934 . 2 1 1 A 80 80 ALA CB C 80 18.040 18.218 -0.178 1
1 935 . 2 1 1 A 80 80 ALA N N 80 120.730 120.988 -0.258 1
1 936 . 2 1 1 A 81 81 LEU H H 81 8.460 7.670 0.790 1
1 937 . 2 1 1 A 81 81 LEU HA H 81 4.000 4.057 -0.057 1
1 941 . 2 1 1 A 81 81 LEU C C 81 177.030 179.238 -2.208 1
1 942 . 2 1 1 A 81 81 LEU CA C 81 57.640 57.804 -0.164 1
1 943 . 2 1 1 A 81 81 LEU CB C 81 40.620 41.632 -1.012 1
1 945 . 2 1 1 A 81 81 LEU N N 81 119.890 119.633 0.257 1
1 946 . 2 1 1 A 82 82 THR H H 82 8.320 7.739 0.581 1
1 947 . 2 1 1 A 82 82 THR HA H 82 3.800 3.941 -0.141 1
1 952 . 2 1 1 A 82 82 THR C C 82 181.010 176.916 4.094 1
1 953 . 2 1 1 A 82 82 THR CA C 82 68.500 66.191 2.309 1
1 954 . 2 1 1 A 82 82 THR CB C 82 67.400 69.101 -1.701 1
1 956 . 2 1 1 A 82 82 THR N N 82 117.120 113.529 3.591 1
1 957 . 2 1 1 A 83 83 VAL H H 83 8.530 7.490 1.040 1
1 958 . 2 1 1 A 83 83 VAL HA H 83 3.890 3.836 0.054 1
1 966 . 2 1 1 A 83 83 VAL C C 83 178.120 178.218 -0.098 1
1 967 . 2 1 1 A 83 83 VAL CA C 83 67.400 65.141 2.259 1
1 968 . 2 1 1 A 83 83 VAL CB C 83 31.590 31.558 0.032 1
1 971 . 2 1 1 A 83 83 VAL N N 83 119.760 118.179 1.581 1
1 972 . 2 1 1 A 84 84 ALA H H 84 7.910 8.090 -0.180 1
1 973 . 2 1 1 A 84 84 ALA HA H 84 4.060 4.107 -0.047 1
1 977 . 2 1 1 A 84 84 ALA C C 84 180.560 179.604 0.956 1
1 978 . 2 1 1 A 84 84 ALA CA C 84 55.000 55.198 -0.198 1
1 979 . 2 1 1 A 84 84 ALA CB C 84 17.230 18.154 -0.924 1
1 980 . 2 1 1 A 84 84 ALA N N 84 122.620 124.448 -1.828 1
1 981 . 2 1 1 A 85 85 CYS H H 85 8.580 7.888 0.692 1
1 982 . 2 1 1 A 85 85 CYS HA H 85 4.080 4.533 -0.453 1
1 985 . 2 1 1 A 85 85 CYS C C 85 179.060 177.004 2.056 1
1 986 . 2 1 1 A 85 85 CYS CA C 85 63.210 61.676 1.534 1
1 987 . 2 1 1 A 85 85 CYS CB C 85 26.310 27.421 -1.111 1
1 988 . 2 1 1 A 85 85 CYS N N 85 118.730 117.314 1.416 1
1 989 . 2 1 1 A 86 86 ASN H H 86 8.430 8.124 0.306 1
1 990 . 2 1 1 A 86 86 ASN CA C 86 55.860 56.658 -0.798 1
1 991 . 2 1 1 A 86 86 ASN CB C 86 37.440 39.245 -1.805 1
1 992 . 2 1 1 A 86 86 ASN N N 86 119.360 119.174 0.186 1
1 993 . 2 1 1 A 87 87 ASN H H 87 7.880 8.111 -0.231 1
1 994 . 2 1 1 A 87 87 ASN HA H 87 4.600 4.572 0.028 1
1 997 . 2 1 1 A 87 87 ASN C C 87 178.510 177.400 1.110 1
1 998 . 2 1 1 A 87 87 ASN CA C 87 56.470 56.793 -0.323 1
1 999 . 2 1 1 A 87 87 ASN CB C 87 37.500 38.072 -0.572 1
1 1000 . 2 1 1 A 87 87 ASN N N 87 119.480 117.320 2.160 1
1 1001 . 2 1 1 A 88 88 PHE H H 88 8.050 7.744 0.306 1
1 1002 . 2 1 1 A 88 88 PHE HA H 88 4.200 4.295 -0.095 1
1 1005 . 2 1 1 A 88 88 PHE C C 88 178.510 177.475 1.035 1
1 1006 . 2 1 1 A 88 88 PHE CA C 88 56.460 59.874 -3.414 1
1 1007 . 2 1 1 A 88 88 PHE CB C 88 38.500 39.913 -1.413 1
1 1008 . 2 1 1 A 88 88 PHE N N 88 120.280 121.842 -1.562 1
1 1009 . 2 1 1 A 89 89 PHE H H 89 8.020 8.241 -0.221 1
1 1010 . 2 1 1 A 89 89 PHE HA H 89 4.000 4.061 -0.061 1
1 1013 . 2 1 1 A 89 89 PHE C C 89 177.340 177.311 0.029 1
1 1014 . 2 1 1 A 89 89 PHE CA C 89 59.000 61.378 -2.378 1
1 1015 . 2 1 1 A 89 89 PHE CB C 89 37.430 38.621 -1.191 1
1 1016 . 2 1 1 A 89 89 PHE N N 89 120.910 119.254 1.656 1
1 1017 . 2 1 1 A 90 90 TRP H H 90 7.800 7.634 0.166 1
1 1018 . 2 1 1 A 90 90 TRP HA H 90 4.460 4.541 -0.081 1
1 1021 . 2 1 1 A 90 90 TRP C C 90 177.340 178.849 -1.509 1
1 1022 . 2 1 1 A 90 90 TRP CA C 90 57.930 60.459 -2.529 1
1 1023 . 2 1 1 A 90 90 TRP CB C 90 42.000 28.640 13.360 1
1 1024 . 2 1 1 A 90 90 TRP N N 90 120.050 116.854 3.196 1
1 1025 . 2 1 1 A 91 91 GLU H H 91 7.800 8.574 -0.774 1
1 1026 . 2 1 1 A 91 91 GLU HA H 91 4.050 3.966 0.084 1
1 1031 . 2 1 1 A 91 91 GLU C C 91 177.570 178.236 -0.666 1
1 1032 . 2 1 1 A 91 91 GLU CA C 91 57.350 59.649 -2.299 1
1 1033 . 2 1 1 A 91 91 GLU CB C 91 29.530 29.138 0.392 1
1 1035 . 2 1 1 A 91 91 GLU N N 91 120.730 120.684 0.046 1
1 1036 . 2 1 1 A 92 92 ASN H H 92 7.800 7.597 0.203 1
1 1037 . 2 1 1 A 92 92 ASN HA H 92 4.630 4.520 0.110 1
1 1040 . 2 1 1 A 92 92 ASN C C 92 174.450 174.991 -0.541 1
1 1041 . 2 1 1 A 92 92 ASN CA C 92 52.960 51.926 1.034 1
1 1042 . 2 1 1 A 92 92 ASN CB C 92 29.530 37.365 -7.835 1
1 1043 . 2 1 1 A 92 92 ASN N N 92 119.410 114.019 5.391 1
1 5 . 3 1 1 A 2 2 SER H H 2 9.000 9.757 -0.757 1
1 6 . 3 1 1 A 2 2 SER HA H 2 4.690 4.587 0.103 1
1 9 . 3 1 1 A 2 2 SER C C 2 176.170 175.895 0.275 1
1 10 . 3 1 1 A 2 2 SER CA C 2 57.340 57.783 -0.443 1
1 11 . 3 1 1 A 2 2 SER CB C 2 65.550 64.512 1.038 1
1 12 . 3 1 1 A 2 2 SER N N 2 119.330 115.201 4.129 1
1 13 . 3 1 1 A 3 3 GLU H H 3 9.350 9.116 0.234 1
1 14 . 3 1 1 A 3 3 GLU HA H 3 4.060 4.047 0.013 1
1 17 . 3 1 1 A 3 3 GLU C C 3 180.150 178.602 1.548 1
1 18 . 3 1 1 A 3 3 GLU CA C 3 60.280 59.398 0.882 1
1 19 . 3 1 1 A 3 3 GLU CB C 3 29.230 29.482 -0.252 1
1 21 . 3 1 1 A 3 3 GLU N N 3 125.350 124.065 1.285 1
1 22 . 3 1 1 A 4 4 LEU H H 4 9.060 8.392 0.668 1
1 23 . 3 1 1 A 4 4 LEU HA H 4 4.080 3.988 0.092 1
1 33 . 3 1 1 A 4 4 LEU C C 4 177.890 179.959 -2.069 1
1 34 . 3 1 1 A 4 4 LEU CA C 4 58.090 58.018 0.072 1
1 35 . 3 1 1 A 4 4 LEU CB C 4 42.120 41.457 0.663 1
1 39 . 3 1 1 A 4 4 LEU N N 4 121.090 120.342 0.748 1
1 40 . 3 1 1 A 5 5 GLU H H 5 8.340 8.459 -0.119 1
1 41 . 3 1 1 A 5 5 GLU HA H 5 4.050 4.126 -0.076 1
1 46 . 3 1 1 A 5 5 GLU C C 5 177.030 178.628 -1.598 1
1 47 . 3 1 1 A 5 5 GLU CA C 5 59.840 58.599 1.241 1
1 48 . 3 1 1 A 5 5 GLU CB C 5 28.940 28.213 0.727 1
1 50 . 3 1 1 A 5 5 GLU N N 5 119.780 118.148 1.632 1
1 51 . 3 1 1 A 6 6 THR H H 6 8.370 7.803 0.567 1
1 52 . 3 1 1 A 6 6 THR HA H 6 4.310 3.910 0.400 1
1 57 . 3 1 1 A 6 6 THR C C 6 177.340 176.832 0.508 1
1 58 . 3 1 1 A 6 6 THR CA C 6 66.630 66.216 0.414 1
1 59 . 3 1 1 A 6 6 THR CB C 6 68.650 68.466 0.184 1
1 61 . 3 1 1 A 6 6 THR N N 6 116.940 116.857 0.083 1
1 62 . 3 1 1 A 7 7 ALA H H 7 8.270 7.554 0.716 1
1 63 . 3 1 1 A 7 7 ALA HA H 7 4.190 4.158 0.032 1
1 67 . 3 1 1 A 7 7 ALA C C 7 179.760 179.510 0.250 1
1 68 . 3 1 1 A 7 7 ALA CA C 7 55.880 55.086 0.794 1
1 69 . 3 1 1 A 7 7 ALA CB C 7 17.720 18.372 -0.652 1
1 70 . 3 1 1 A 7 7 ALA N N 7 127.400 124.037 3.363 1
1 71 . 3 1 1 A 8 8 MET H H 8 8.110 7.680 0.430 1
1 72 . 3 1 1 A 8 8 MET HA H 8 4.020 4.164 -0.144 1
1 80 . 3 1 1 A 8 8 MET C C 8 178.510 178.517 -0.007 1
1 81 . 3 1 1 A 8 8 MET CA C 8 60.580 58.660 1.920 1
1 82 . 3 1 1 A 8 8 MET CB C 8 33.630 32.873 0.757 1
1 85 . 3 1 1 A 8 8 MET N N 8 117.520 116.807 0.713 1
1 86 . 3 1 1 A 9 9 GLU H H 9 8.210 7.676 0.534 1
1 87 . 3 1 1 A 9 9 GLU HA H 9 3.830 4.167 -0.337 1
1 92 . 3 1 1 A 9 9 GLU C C 9 179.140 178.812 0.328 1
1 93 . 3 1 1 A 9 9 GLU CA C 9 59.690 59.241 0.449 1
1 94 . 3 1 1 A 9 9 GLU CB C 9 29.530 29.258 0.272 1
1 96 . 3 1 1 A 9 9 GLU N N 9 118.560 118.793 -0.233 1
1 97 . 3 1 1 A 10 10 THR H H 10 8.490 7.455 1.035 1
1 98 . 3 1 1 A 10 10 THR HA H 10 4.000 4.127 -0.127 1
1 103 . 3 1 1 A 10 10 THR C C 10 176.010 176.324 -0.314 1
1 104 . 3 1 1 A 10 10 THR CA C 10 67.110 65.893 1.217 1
1 105 . 3 1 1 A 10 10 THR CB C 10 67.770 69.094 -1.324 1
1 107 . 3 1 1 A 10 10 THR N N 10 118.310 116.262 2.048 1
1 108 . 3 1 1 A 11 11 LEU H H 11 7.920 7.931 -0.011 1
1 109 . 3 1 1 A 11 11 LEU HA H 11 3.930 4.083 -0.153 1
1 119 . 3 1 1 A 11 11 LEU C C 11 178.820 179.314 -0.494 1
1 120 . 3 1 1 A 11 11 LEU CA C 11 59.690 58.360 1.330 1
1 121 . 3 1 1 A 11 11 LEU CB C 11 41.920 41.906 0.014 1
1 125 . 3 1 1 A 11 11 LEU N N 11 121.150 121.117 0.033 1
1 126 . 3 1 1 A 12 12 ILE H H 12 7.440 7.835 -0.395 1
1 127 . 3 1 1 A 12 12 ILE HA H 12 3.640 3.449 0.191 1
1 137 . 3 1 1 A 12 12 ILE C C 12 179.530 178.540 0.990 1
1 138 . 3 1 1 A 12 12 ILE CA C 12 63.740 65.189 -1.449 1
1 139 . 3 1 1 A 12 12 ILE CB C 12 38.800 37.599 1.201 1
1 143 . 3 1 1 A 12 12 ILE N N 12 118.010 120.081 -2.071 1
1 144 . 3 1 1 A 13 13 ASN H H 13 8.930 8.185 0.745 1
1 145 . 3 1 1 A 13 13 ASN HA H 13 4.520 4.582 -0.062 1
1 148 . 3 1 1 A 13 13 ASN C C 13 179.450 177.360 2.090 1
1 149 . 3 1 1 A 13 13 ASN CA C 13 56.470 56.529 -0.059 1
1 150 . 3 1 1 A 13 13 ASN CB C 13 37.930 38.826 -0.896 1
1 151 . 3 1 1 A 13 13 ASN N N 13 121.820 120.062 1.758 1
1 152 . 3 1 1 A 14 14 VAL H H 14 9.180 8.019 1.161 1
1 153 . 3 1 1 A 14 14 VAL HA H 14 3.830 3.878 -0.048 1
1 161 . 3 1 1 A 14 14 VAL CA C 14 65.840 65.519 0.321 1
1 162 . 3 1 1 A 14 14 VAL CB C 14 31.290 31.622 -0.332 1
1 165 . 3 1 1 A 14 14 VAL N N 14 122.040 117.655 4.385 1
1 166 . 3 1 1 A 15 15 PHE H H 15 7.590 8.204 -0.614 1
1 167 . 3 1 1 A 15 15 PHE HA H 15 3.360 4.103 -0.743 1
1 170 . 3 1 1 A 15 15 PHE C C 15 177.890 177.374 0.516 1
1 171 . 3 1 1 A 15 15 PHE CA C 15 62.030 62.156 -0.126 1
1 172 . 3 1 1 A 15 15 PHE CB C 15 38.900 39.300 -0.400 1
1 173 . 3 1 1 A 15 15 PHE N N 15 118.290 123.925 -5.635 1
1 174 . 3 1 1 A 16 16 HIS H H 16 7.790 7.965 -0.175 1
1 175 . 3 1 1 A 16 16 HIS HA H 16 4.890 4.197 0.693 1
1 178 . 3 1 1 A 16 16 HIS C C 16 177.810 177.295 0.515 1
1 179 . 3 1 1 A 16 16 HIS CA C 16 59.100 59.936 -0.836 1
1 180 . 3 1 1 A 16 16 HIS CB C 16 28.060 29.348 -1.288 1
1 181 . 3 1 1 A 16 16 HIS N N 16 118.290 118.332 -0.042 1
1 182 . 3 1 1 A 17 17 ALA H H 17 8.040 7.970 0.070 1
1 183 . 3 1 1 A 17 17 ALA HA H 17 4.050 3.826 0.224 1
1 187 . 3 1 1 A 17 17 ALA C C 17 179.600 179.601 -0.001 1
1 188 . 3 1 1 A 17 17 ALA CA C 17 54.000 55.176 -1.176 1
1 189 . 3 1 1 A 17 17 ALA CB C 17 17.520 18.619 -1.099 1
1 190 . 3 1 1 A 17 17 ALA N N 17 124.410 120.906 3.504 1
1 191 . 3 1 1 A 18 18 HIS H H 18 7.000 7.207 -0.207 1
1 192 . 3 1 1 A 18 18 HIS HA H 18 4.330 4.108 0.222 1
1 195 . 3 1 1 A 18 18 HIS C C 18 176.320 176.857 -0.537 1
1 196 . 3 1 1 A 18 18 HIS CA C 18 57.350 59.241 -1.891 1
1 197 . 3 1 1 A 18 18 HIS CB C 18 32.920 29.752 3.168 1
1 198 . 3 1 1 A 18 18 HIS N N 18 115.160 118.151 -2.991 1
1 199 . 3 1 1 A 19 19 SER H H 19 8.380 7.835 0.545 1
1 200 . 3 1 1 A 19 19 SER HA H 19 3.640 4.221 -0.581 1
1 203 . 3 1 1 A 19 19 SER C C 19 177.340 175.675 1.665 1
1 204 . 3 1 1 A 19 19 SER CA C 19 60.160 62.567 -2.407 1
1 205 . 3 1 1 A 19 19 SER CB C 19 61.000 62.118 -1.118 1
1 206 . 3 1 1 A 19 19 SER N N 19 114.380 115.344 -0.964 1
1 207 . 3 1 1 A 20 20 GLY H H 20 7.600 7.593 0.007 1
1 208 . 3 1 1 A 20 20 GLY HA2 H 20 3.680 3.763 -0.083 1
1 209 . 3 1 1 A 20 20 GLY HA3 H 20 4.000 3.910 0.090 1
1 210 . 3 1 1 A 20 20 GLY C C 20 174.140 174.417 -0.277 1
1 211 . 3 1 1 A 20 20 GLY CA C 20 47.000 45.087 1.913 1
1 212 . 3 1 1 A 20 20 GLY N N 20 112.550 107.779 4.771 1
1 213 . 3 1 1 A 21 21 LYS H H 21 7.230 7.186 0.044 1
1 214 . 3 1 1 A 21 21 LYS HA H 21 3.860 4.305 -0.445 1
1 223 . 3 1 1 A 21 21 LYS C C 21 177.730 176.201 1.529 1
1 224 . 3 1 1 A 21 21 LYS CA C 21 59.110 57.085 2.025 1
1 225 . 3 1 1 A 21 21 LYS CB C 21 32.460 34.614 -2.154 1
1 229 . 3 1 1 A 21 21 LYS N N 21 123.240 117.955 5.285 1
1 230 . 3 1 1 A 22 22 GLU H H 22 9.350 7.435 1.915 1
1 231 . 3 1 1 A 22 22 GLU HA H 22 4.610 4.269 0.341 1
1 236 . 3 1 1 A 22 22 GLU C C 22 177.420 176.470 0.950 1
1 237 . 3 1 1 A 22 22 GLU CA C 22 53.700 55.966 -2.266 1
1 238 . 3 1 1 A 22 22 GLU CB C 22 32.000 28.194 3.806 1
1 240 . 3 1 1 A 22 22 GLU N N 22 116.770 117.615 -0.845 1
1 241 . 3 1 1 A 23 23 GLY H H 23 7.570 8.061 -0.491 1
1 242 . 3 1 1 A 23 23 GLY HA2 H 23 3.630 4.138 -0.508 1
1 243 . 3 1 1 A 23 23 GLY HA3 H 23 3.880 4.155 -0.275 1
1 244 . 3 1 1 A 23 23 GLY C C 23 173.980 171.649 2.331 1
1 245 . 3 1 1 A 23 23 GLY CA C 23 45.250 45.055 0.195 1
1 246 . 3 1 1 A 23 23 GLY N N 23 112.180 110.892 1.288 1
1 247 . 3 1 1 A 24 24 ASP H H 24 8.680 8.305 0.375 1
1 248 . 3 1 1 A 24 24 ASP HA H 24 4.380 4.749 -0.369 1
1 251 . 3 1 1 A 24 24 ASP C C 24 178.590 177.446 1.144 1
1 252 . 3 1 1 A 24 24 ASP CA C 24 60.000 53.879 6.121 1
1 253 . 3 1 1 A 24 24 ASP CB C 24 27.480 42.479 -14.999 1
1 254 . 3 1 1 A 24 24 ASP N N 24 127.470 121.626 5.844 1
1 255 . 3 1 1 A 25 25 LYS H H 25 9.270 8.841 0.429 1
1 256 . 3 1 1 A 25 25 LYS HA H 25 4.250 3.907 0.343 1
1 265 . 3 1 1 A 25 25 LYS C C 25 177.030 177.243 -0.213 1
1 266 . 3 1 1 A 25 25 LYS CA C 25 60.000 60.137 -0.137 1
1 267 . 3 1 1 A 25 25 LYS CB C 25 31.170 32.475 -1.305 1
1 271 . 3 1 1 A 25 25 LYS N N 25 132.960 125.201 7.759 1
1 272 . 3 1 1 A 26 26 TYR H H 26 9.430 7.987 1.443 1
1 273 . 3 1 1 A 26 26 TYR HA H 26 4.640 4.843 -0.203 1
1 276 . 3 1 1 A 26 26 TYR C C 26 174.290 174.994 -0.704 1
1 277 . 3 1 1 A 26 26 TYR CA C 26 56.010 57.808 -1.798 1
1 278 . 3 1 1 A 26 26 TYR CB C 26 37.730 39.121 -1.391 1
1 279 . 3 1 1 A 26 26 TYR N N 26 120.650 118.853 1.797 1
1 280 . 3 1 1 A 27 27 LYS H H 27 7.110 7.298 -0.188 1
1 281 . 3 1 1 A 27 27 LYS HA H 27 5.110 5.025 0.085 1
1 290 . 3 1 1 A 27 27 LYS C C 27 175.150 173.888 1.262 1
1 291 . 3 1 1 A 27 27 LYS CA C 27 55.070 54.920 0.150 1
1 292 . 3 1 1 A 27 27 LYS CB C 27 38.900 36.321 2.579 1
1 296 . 3 1 1 A 27 27 LYS N N 27 115.830 121.596 -5.766 1
1 297 . 3 1 1 A 28 28 LEU H H 28 9.820 8.283 1.537 1
1 298 . 3 1 1 A 28 28 LEU HA H 28 5.080 4.802 0.278 1
1 308 . 3 1 1 A 28 28 LEU C C 28 176.640 175.674 0.966 1
1 309 . 3 1 1 A 28 28 LEU CA C 28 52.660 53.980 -1.320 1
1 310 . 3 1 1 A 28 28 LEU CB C 28 42.710 44.328 -1.618 1
1 314 . 3 1 1 A 28 28 LEU N N 28 126.930 128.592 -1.662 1
1 315 . 3 1 1 A 29 29 SER H H 29 9.890 8.648 1.242 1
1 316 . 3 1 1 A 29 29 SER HA H 29 4.530 4.945 -0.415 1
1 319 . 3 1 1 A 29 29 SER C C 29 174.990 174.762 0.228 1
1 320 . 3 1 1 A 29 29 SER CA C 29 56.180 57.181 -1.001 1
1 321 . 3 1 1 A 29 29 SER CB C 29 65.550 66.972 -1.422 1
1 322 . 3 1 1 A 29 29 SER N N 29 121.600 119.648 1.952 1
1 323 . 3 1 1 A 30 30 LYS H H 30 8.850 8.856 -0.006 1
1 324 . 3 1 1 A 30 30 LYS HA H 30 3.850 3.950 -0.100 1
1 333 . 3 1 1 A 30 30 LYS C C 30 175.620 177.632 -2.012 1
1 334 . 3 1 1 A 30 30 LYS CA C 30 60.860 60.140 0.720 1
1 335 . 3 1 1 A 30 30 LYS CB C 30 31.290 32.103 -0.813 1
1 339 . 3 1 1 A 30 30 LYS N N 30 121.260 124.650 -3.390 1
1 340 . 3 1 1 A 31 31 LYS H H 31 7.970 7.851 0.119 1
1 341 . 3 1 1 A 31 31 LYS HA H 31 3.880 4.019 -0.139 1
1 350 . 3 1 1 A 31 31 LYS C C 31 179.290 179.386 -0.096 1
1 351 . 3 1 1 A 31 31 LYS CA C 31 59.110 59.239 -0.129 1
1 352 . 3 1 1 A 31 31 LYS CB C 31 32.640 31.699 0.941 1
1 356 . 3 1 1 A 31 31 LYS N N 31 121.260 118.607 2.653 1
1 357 . 3 1 1 A 32 32 GLU H H 32 7.510 8.054 -0.544 1
1 358 . 3 1 1 A 32 32 GLU HA H 32 3.830 4.397 -0.567 1
1 363 . 3 1 1 A 32 32 GLU C C 32 179.290 179.565 -0.275 1
1 364 . 3 1 1 A 32 32 GLU CA C 32 58.590 58.968 -0.378 1
1 365 . 3 1 1 A 32 32 GLU CB C 32 30.120 29.798 0.322 1
1 367 . 3 1 1 A 32 32 GLU N N 32 120.090 119.589 0.501 1
1 368 . 3 1 1 A 33 33 LEU H H 33 8.970 7.815 1.155 1
1 369 . 3 1 1 A 33 33 LEU HA H 33 3.830 3.776 0.054 1
1 379 . 3 1 1 A 33 33 LEU C C 33 178.200 178.687 -0.487 1
1 380 . 3 1 1 A 33 33 LEU CA C 33 57.930 57.913 0.017 1
1 381 . 3 1 1 A 33 33 LEU CB C 33 40.660 41.458 -0.798 1
1 385 . 3 1 1 A 33 33 LEU N N 33 120.200 119.288 0.912 1
1 386 . 3 1 1 A 34 34 LYS H H 34 8.230 7.476 0.754 1
1 387 . 3 1 1 A 34 34 LYS HA H 34 3.550 3.898 -0.348 1
1 396 . 3 1 1 A 34 34 LYS C C 34 178.040 178.360 -0.320 1
1 397 . 3 1 1 A 34 34 LYS CA C 34 60.720 59.189 1.531 1
1 398 . 3 1 1 A 34 34 LYS CB C 34 31.980 31.858 0.122 1
1 402 . 3 1 1 A 34 34 LYS N N 34 120.780 119.202 1.578 1
1 403 . 3 1 1 A 35 35 ASP H H 35 7.990 7.793 0.197 1
1 404 . 3 1 1 A 35 35 ASP HA H 35 4.250 4.295 -0.045 1
1 407 . 3 1 1 A 35 35 ASP C C 35 179.060 178.578 0.482 1
1 408 . 3 1 1 A 35 35 ASP CA C 35 56.830 56.727 0.103 1
1 409 . 3 1 1 A 35 35 ASP CB C 35 40.440 39.677 0.763 1
1 410 . 3 1 1 A 35 35 ASP N N 35 119.550 116.601 2.949 1
1 411 . 3 1 1 A 36 36 LEU H H 36 8.130 7.525 0.605 1
1 412 . 3 1 1 A 36 36 LEU HA H 36 2.580 3.840 -1.260 1
1 422 . 3 1 1 A 36 36 LEU C C 36 179.450 178.196 1.254 1
1 423 . 3 1 1 A 36 36 LEU CA C 36 59.980 58.169 1.811 1
1 424 . 3 1 1 A 36 36 LEU CB C 36 42.180 41.371 0.809 1
1 428 . 3 1 1 A 36 36 LEU N N 36 125.560 122.170 3.390 1
1 429 . 3 1 1 A 37 37 LEU H H 37 8.740 7.907 0.833 1
1 430 . 3 1 1 A 37 37 LEU HA H 37 3.580 3.936 -0.356 1
1 440 . 3 1 1 A 37 37 LEU C C 37 179.290 179.062 0.228 1
1 441 . 3 1 1 A 37 37 LEU CA C 37 58.230 58.099 0.131 1
1 442 . 3 1 1 A 37 37 LEU CB C 37 41.590 40.804 0.786 1
1 446 . 3 1 1 A 37 37 LEU N N 37 120.520 118.502 2.018 1
1 447 . 3 1 1 A 38 38 GLN H H 38 8.520 7.864 0.656 1
1 448 . 3 1 1 A 38 38 GLN HA H 38 4.000 3.947 0.053 1
1 453 . 3 1 1 A 38 38 GLN C C 38 177.960 178.508 -0.548 1
1 454 . 3 1 1 A 38 38 GLN CA C 38 58.210 58.855 -0.645 1
1 455 . 3 1 1 A 38 38 GLN CB C 38 28.650 28.252 0.398 1
1 457 . 3 1 1 A 38 38 GLN N N 38 116.740 118.402 -1.662 1
1 458 . 3 1 1 A 39 39 THR H H 39 7.910 8.375 -0.465 1
1 459 . 3 1 1 A 39 39 THR HA H 39 4.210 3.787 0.423 1
1 464 . 3 1 1 A 39 39 THR C C 39 177.180 175.785 1.395 1
1 465 . 3 1 1 A 39 39 THR CA C 39 64.730 67.350 -2.620 1
1 466 . 3 1 1 A 39 39 THR CB C 39 69.650 68.655 0.995 1
1 468 . 3 1 1 A 39 39 THR N N 39 111.400 117.254 -5.854 1
1 469 . 3 1 1 A 40 40 GLU H H 40 8.590 7.413 1.177 1
1 470 . 3 1 1 A 40 40 GLU HA H 40 4.680 4.411 0.269 1
1 475 . 3 1 1 A 40 40 GLU C C 40 178.280 177.238 1.042 1
1 476 . 3 1 1 A 40 40 GLU CA C 40 55.880 56.686 -0.806 1
1 477 . 3 1 1 A 40 40 GLU CB C 40 30.990 30.413 0.577 1
1 479 . 3 1 1 A 40 40 GLU N N 40 117.840 116.434 1.406 1
1 480 . 3 1 1 A 41 41 LEU H H 41 7.680 7.468 0.212 1
1 481 . 3 1 1 A 41 41 LEU HA H 41 5.080 4.905 0.175 1
1 491 . 3 1 1 A 41 41 LEU C C 41 179.450 177.395 2.055 1
1 492 . 3 1 1 A 41 41 LEU CA C 41 53.830 53.842 -0.012 1
1 493 . 3 1 1 A 41 41 LEU CB C 41 41.360 42.749 -1.389 1
1 497 . 3 1 1 A 41 41 LEU N N 41 121.410 119.940 1.470 1
1 498 . 3 1 1 A 42 42 SER H H 42 8.380 7.952 0.428 1
1 499 . 3 1 1 A 42 42 SER HA H 42 4.130 4.119 0.011 1
1 502 . 3 1 1 A 42 42 SER C C 42 176.640 176.843 -0.203 1
1 503 . 3 1 1 A 42 42 SER CA C 42 61.280 61.678 -0.398 1
1 504 . 3 1 1 A 42 42 SER CB C 42 63.040 62.906 0.134 1
1 505 . 3 1 1 A 42 42 SER N N 42 117.420 117.418 0.002 1
1 506 . 3 1 1 A 43 43 SER H H 43 8.900 8.446 0.454 1
1 507 . 3 1 1 A 43 43 SER HA H 43 4.290 4.414 -0.124 1
1 510 . 3 1 1 A 43 43 SER C C 43 175.620 176.370 -0.750 1
1 511 . 3 1 1 A 43 43 SER CA C 43 60.860 60.311 0.549 1
1 512 . 3 1 1 A 43 43 SER CB C 43 62.910 63.132 -0.222 1
1 513 . 3 1 1 A 43 43 SER N N 43 117.580 115.686 1.894 1
1 514 . 3 1 1 A 44 44 PHE H H 44 7.880 8.094 -0.214 1
1 515 . 3 1 1 A 44 44 PHE HA H 44 4.240 4.305 -0.065 1
1 518 . 3 1 1 A 44 44 PHE C C 44 176.950 175.568 1.382 1
1 519 . 3 1 1 A 44 44 PHE CA C 44 62.710 60.697 2.013 1
1 520 . 3 1 1 A 44 44 PHE CB C 44 39.020 39.215 -0.195 1
1 521 . 3 1 1 A 44 44 PHE N N 44 119.480 122.943 -3.463 1
1 522 . 3 1 1 A 45 45 LEU H H 45 8.060 7.783 0.277 1
1 523 . 3 1 1 A 45 45 LEU HA H 45 3.810 3.622 0.188 1
1 533 . 3 1 1 A 45 45 LEU C C 45 177.500 176.091 1.409 1
1 534 . 3 1 1 A 45 45 LEU CA C 45 59.980 55.072 4.908 1
1 535 . 3 1 1 A 45 45 LEU CB C 45 39.640 42.238 -2.598 1
1 538 . 3 1 1 A 45 45 LEU N N 45 118.010 121.318 -3.308 1
1 539 . 3 1 1 A 46 46 ASP H H 46 8.150 8.566 -0.416 1
1 540 . 3 1 1 A 46 46 ASP HA H 46 4.470 4.822 -0.352 1
1 543 . 3 1 1 A 46 46 ASP C C 46 179.920 175.412 4.508 1
1 544 . 3 1 1 A 46 46 ASP CA C 46 52.950 53.721 -0.771 1
1 545 . 3 1 1 A 46 46 ASP CB C 46 40.000 41.611 -1.611 1
1 546 . 3 1 1 A 46 46 ASP N N 46 119.460 123.289 -3.829 1
1 547 . 3 1 1 A 47 47 VAL H H 47 8.010 8.463 -0.453 1
1 548 . 3 1 1 A 47 47 VAL HA H 47 3.800 4.294 -0.494 1
1 556 . 3 1 1 A 47 47 VAL C C 47 175.460 177.086 -1.626 1
1 557 . 3 1 1 A 47 47 VAL CA C 47 60.000 63.202 -3.202 1
1 558 . 3 1 1 A 47 47 VAL CB C 47 31.580 33.284 -1.704 1
1 561 . 3 1 1 A 47 47 VAL N N 47 117.720 122.406 -4.686 1
1 562 . 3 1 1 A 48 48 GLN H H 48 7.960 8.775 -0.815 1
1 563 . 3 1 1 A 48 48 GLN HA H 48 4.060 4.006 0.054 1
1 568 . 3 1 1 A 48 48 GLN C C 48 179.370 178.679 0.691 1
1 569 . 3 1 1 A 48 48 GLN CA C 48 57.350 58.915 -1.565 1
1 570 . 3 1 1 A 48 48 GLN CB C 48 28.990 28.276 0.714 1
1 572 . 3 1 1 A 48 48 GLN N N 48 119.900 121.504 -1.604 1
1 573 . 3 1 1 A 49 49 LYS H H 49 7.810 7.698 0.112 1
1 574 . 3 1 1 A 49 49 LYS HA H 49 3.860 4.155 -0.295 1
1 583 . 3 1 1 A 49 49 LYS C C 49 177.890 176.522 1.368 1
1 584 . 3 1 1 A 49 49 LYS CA C 49 58.230 58.736 -0.506 1
1 585 . 3 1 1 A 49 49 LYS CB C 49 30.990 32.482 -1.492 1
1 587 . 3 1 1 A 49 49 LYS N N 49 120.030 119.517 0.513 1
1 588 . 3 1 1 A 50 50 ASP H H 50 7.570 7.787 -0.217 1
1 589 . 3 1 1 A 50 50 ASP HA H 50 4.700 4.799 -0.099 1
1 590 . 3 1 1 A 50 50 ASP CA C 50 52.950 53.065 -0.115 1
1 591 . 3 1 1 A 50 50 ASP CB C 50 38.900 41.269 -2.369 1
1 592 . 3 1 1 A 50 50 ASP N N 50 116.730 119.589 -2.859 1
1 593 . 3 1 1 A 51 51 ALA H H 51 7.570 8.771 -1.201 1
1 594 . 3 1 1 A 51 51 ALA HA H 51 4.200 3.944 0.256 1
1 598 . 3 1 1 A 51 51 ALA C C 51 179.760 179.160 0.600 1
1 599 . 3 1 1 A 51 51 ALA CA C 51 54.200 55.338 -1.138 1
1 600 . 3 1 1 A 51 51 ALA CB C 51 18.110 18.325 -0.215 1
1 601 . 3 1 1 A 51 51 ALA N N 51 118.390 127.439 -9.049 1
1 602 . 3 1 1 A 52 52 ASP H H 52 8.430 8.000 0.430 1
1 603 . 3 1 1 A 52 52 ASP HA H 52 4.600 4.361 0.239 1
1 606 . 3 1 1 A 52 52 ASP C C 52 177.570 178.286 -0.716 1
1 607 . 3 1 1 A 52 52 ASP CA C 52 54.420 57.162 -2.742 1
1 608 . 3 1 1 A 52 52 ASP CB C 52 40.360 42.266 -1.906 1
1 609 . 3 1 1 A 52 52 ASP N N 52 117.530 118.639 -1.109 1
1 610 . 3 1 1 A 53 53 ALA H H 53 7.660 8.254 -0.594 1
1 611 . 3 1 1 A 53 53 ALA HA H 53 3.860 3.997 -0.137 1
1 615 . 3 1 1 A 53 53 ALA C C 53 180.070 180.450 -0.380 1
1 616 . 3 1 1 A 53 53 ALA CA C 53 55.590 55.398 0.192 1
1 617 . 3 1 1 A 53 53 ALA CB C 53 18.800 18.054 0.746 1
1 618 . 3 1 1 A 53 53 ALA N N 53 123.450 121.146 2.304 1
1 619 . 3 1 1 A 54 54 VAL H H 54 8.030 7.959 0.071 1
1 620 . 3 1 1 A 54 54 VAL HA H 54 3.240 3.546 -0.306 1
1 628 . 3 1 1 A 54 54 VAL C C 54 177.340 178.139 -0.799 1
1 629 . 3 1 1 A 54 54 VAL CA C 54 66.620 66.167 0.453 1
1 630 . 3 1 1 A 54 54 VAL CB C 54 30.480 30.955 -0.475 1
1 633 . 3 1 1 A 54 54 VAL N N 54 116.150 118.163 -2.013 1
1 634 . 3 1 1 A 55 55 ASP H H 55 7.660 7.631 0.029 1
1 635 . 3 1 1 A 55 55 ASP HA H 55 4.080 4.372 -0.292 1
1 638 . 3 1 1 A 55 55 ASP C C 55 177.260 179.426 -2.166 1
1 639 . 3 1 1 A 55 55 ASP CA C 55 57.640 57.303 0.337 1
1 640 . 3 1 1 A 55 55 ASP CB C 55 40.360 40.258 0.102 1
1 641 . 3 1 1 A 55 55 ASP N N 55 120.830 121.162 -0.332 1
1 642 . 3 1 1 A 56 56 LYS H H 56 7.780 7.661 0.119 1
1 643 . 3 1 1 A 56 56 LYS HA H 56 3.860 4.018 -0.158 1
1 652 . 3 1 1 A 56 56 LYS C C 56 179.530 179.523 0.007 1
1 653 . 3 1 1 A 56 56 LYS CA C 56 59.690 59.646 0.044 1
1 654 . 3 1 1 A 56 56 LYS CB C 56 31.870 32.505 -0.635 1
1 658 . 3 1 1 A 56 56 LYS N N 56 120.010 119.838 0.172 1
1 659 . 3 1 1 A 57 57 ILE H H 57 8.090 7.917 0.173 1
1 660 . 3 1 1 A 57 57 ILE HA H 57 3.390 3.597 -0.207 1
1 670 . 3 1 1 A 57 57 ILE C C 57 176.710 177.592 -0.882 1
1 671 . 3 1 1 A 57 57 ILE CA C 57 64.960 65.261 -0.301 1
1 672 . 3 1 1 A 57 57 ILE CB C 57 38.080 38.400 -0.320 1
1 676 . 3 1 1 A 57 57 ILE N N 57 120.960 120.399 0.561 1
1 677 . 3 1 1 A 58 58 MET H H 58 8.480 8.280 0.200 1
1 678 . 3 1 1 A 58 58 MET HA H 58 3.800 4.092 -0.292 1
1 686 . 3 1 1 A 58 58 MET C C 58 177.570 178.073 -0.503 1
1 687 . 3 1 1 A 58 58 MET CA C 58 58.570 58.408 0.162 1
1 688 . 3 1 1 A 58 58 MET CB C 58 32.570 31.808 0.762 1
1 691 . 3 1 1 A 58 58 MET N N 58 119.160 120.634 -1.474 1
1 692 . 3 1 1 A 59 59 LYS H H 59 7.550 7.889 -0.339 1
1 693 . 3 1 1 A 59 59 LYS HA H 59 3.930 3.959 -0.029 1
1 702 . 3 1 1 A 59 59 LYS C C 59 179.530 179.487 0.043 1
1 703 . 3 1 1 A 59 59 LYS CA C 59 58.820 59.759 -0.939 1
1 704 . 3 1 1 A 59 59 LYS CB C 59 32.450 32.475 -0.025 1
1 708 . 3 1 1 A 59 59 LYS N N 59 116.730 119.832 -3.102 1
1 709 . 3 1 1 A 60 60 GLU H H 60 7.470 7.652 -0.182 1
1 710 . 3 1 1 A 60 60 GLU HA H 60 4.050 4.100 -0.050 1
1 715 . 3 1 1 A 60 60 GLU C C 60 178.950 178.047 0.903 1
1 716 . 3 1 1 A 60 60 GLU CA C 60 58.600 58.771 -0.171 1
1 717 . 3 1 1 A 60 60 GLU CB C 60 31.700 29.750 1.950 1
1 719 . 3 1 1 A 60 60 GLU N N 60 116.820 119.074 -2.254 1
1 720 . 3 1 1 A 61 61 LEU H H 61 8.030 7.751 0.279 1
1 721 . 3 1 1 A 61 61 LEU HA H 61 4.310 4.353 -0.043 1
1 731 . 3 1 1 A 61 61 LEU C C 61 179.450 177.013 2.437 1
1 732 . 3 1 1 A 61 61 LEU CA C 61 54.840 55.239 -0.399 1
1 733 . 3 1 1 A 61 61 LEU CB C 61 43.820 42.327 1.493 1
1 737 . 3 1 1 A 61 61 LEU N N 61 116.000 118.470 -2.470 1
1 738 . 3 1 1 A 62 62 ASP H H 62 7.890 8.631 -0.741 1
1 739 . 3 1 1 A 62 62 ASP HA H 62 4.660 4.848 -0.188 1
1 742 . 3 1 1 A 62 62 ASP C C 62 177.030 176.089 0.941 1
1 743 . 3 1 1 A 62 62 ASP CA C 62 53.660 53.982 -0.322 1
1 744 . 3 1 1 A 62 62 ASP CB C 62 38.700 39.716 -1.016 1
1 745 . 3 1 1 A 62 62 ASP N N 62 117.550 119.025 -1.475 1
1 746 . 3 1 1 A 63 63 GLU H H 63 8.430 9.126 -0.696 1
1 747 . 3 1 1 A 63 63 GLU HA H 63 4.020 4.032 -0.012 1
1 752 . 3 1 1 A 63 63 GLU C C 63 178.120 178.733 -0.613 1
1 753 . 3 1 1 A 63 63 GLU CA C 63 58.470 59.265 -0.795 1
1 754 . 3 1 1 A 63 63 GLU CB C 63 30.120 29.410 0.710 1
1 756 . 3 1 1 A 63 63 GLU N N 63 130.230 120.352 9.878 1
1 757 . 3 1 1 A 64 64 ASN H H 64 8.010 7.730 0.280 1
1 758 . 3 1 1 A 64 64 ASN HA H 64 4.680 4.809 -0.129 1
1 761 . 3 1 1 A 64 64 ASN C C 64 177.100 175.648 1.452 1
1 762 . 3 1 1 A 64 64 ASN CA C 64 51.780 53.304 -1.524 1
1 763 . 3 1 1 A 64 64 ASN CB C 64 37.260 39.173 -1.913 1
1 764 . 3 1 1 A 64 64 ASN N N 64 113.640 115.143 -1.503 1
1 765 . 3 1 1 A 65 65 GLY H H 65 7.550 7.919 -0.369 1
1 766 . 3 1 1 A 65 65 GLY HA2 H 65 3.770 3.962 -0.192 1
1 767 . 3 1 1 A 65 65 GLY HA3 H 65 3.770 3.962 -0.192 1
1 768 . 3 1 1 A 65 65 GLY C C 65 178.980 175.012 3.968 1
1 769 . 3 1 1 A 65 65 GLY CA C 65 47.200 46.556 0.644 1
1 770 . 3 1 1 A 65 65 GLY N N 65 113.640 107.362 6.278 1
1 771 . 3 1 1 A 66 66 ASP H H 66 8.110 8.174 -0.064 1
1 772 . 3 1 1 A 66 66 ASP HA H 66 4.490 4.588 -0.098 1
1 775 . 3 1 1 A 66 66 ASP C C 66 177.960 177.616 0.344 1
1 776 . 3 1 1 A 66 66 ASP CA C 66 52.960 53.520 -0.560 1
1 777 . 3 1 1 A 66 66 ASP CB C 66 40.540 40.485 0.055 1
1 778 . 3 1 1 A 66 66 ASP N N 66 120.030 120.309 -0.279 1
1 779 . 3 1 1 A 67 67 GLY H H 67 10.260 9.116 1.144 1
1 780 . 3 1 1 A 67 67 GLY HA2 H 67 3.360 3.874 -0.514 1
1 781 . 3 1 1 A 67 67 GLY HA3 H 67 4.000 3.874 0.126 1
1 782 . 3 1 1 A 67 67 GLY C C 67 173.120 173.478 -0.358 1
1 783 . 3 1 1 A 67 67 GLY CA C 67 45.460 45.836 -0.376 1
1 784 . 3 1 1 A 67 67 GLY N N 67 114.100 111.072 3.028 1
1 785 . 3 1 1 A 68 68 GLU H H 68 7.750 8.527 -0.777 1
1 786 . 3 1 1 A 68 68 GLU HA H 68 4.780 4.968 -0.188 1
1 791 . 3 1 1 A 68 68 GLU C C 68 175.930 174.859 1.071 1
1 792 . 3 1 1 A 68 68 GLU CA C 68 54.430 54.388 0.042 1
1 793 . 3 1 1 A 68 68 GLU CB C 68 35.850 33.697 2.153 1
1 795 . 3 1 1 A 68 68 GLU N N 68 118.000 119.394 -1.394 1
1 796 . 3 1 1 A 69 69 VAL H H 69 9.380 8.358 1.022 1
1 797 . 3 1 1 A 69 69 VAL HA H 69 5.260 5.138 0.122 1
1 805 . 3 1 1 A 69 69 VAL C C 69 176.710 173.424 3.286 1
1 806 . 3 1 1 A 69 69 VAL CA C 69 61.280 60.765 0.515 1
1 807 . 3 1 1 A 69 69 VAL CB C 69 33.980 35.061 -1.081 1
1 810 . 3 1 1 A 69 69 VAL N N 69 125.970 120.972 4.998 1
1 811 . 3 1 1 A 70 70 ASP H H 70 9.100 8.929 0.171 1
1 812 . 3 1 1 A 70 70 ASP HA H 70 5.190 5.166 0.024 1
1 815 . 3 1 1 A 70 70 ASP C C 70 175.700 176.876 -1.176 1
1 816 . 3 1 1 A 70 70 ASP CA C 70 52.370 53.282 -0.912 1
1 817 . 3 1 1 A 70 70 ASP CB C 70 40.950 42.830 -1.880 1
1 818 . 3 1 1 A 70 70 ASP N N 70 130.320 127.297 3.023 1
1 819 . 3 1 1 A 71 71 PHE H H 71 9.090 9.147 -0.057 1
1 820 . 3 1 1 A 71 71 PHE HA H 71 4.100 3.975 0.125 1
1 823 . 3 1 1 A 71 71 PHE C C 71 177.000 177.241 -0.241 1
1 824 . 3 1 1 A 71 71 PHE CA C 71 58.230 61.449 -3.219 1
1 825 . 3 1 1 A 71 71 PHE CB C 71 36.910 39.162 -2.252 1
1 826 . 3 1 1 A 71 71 PHE N N 71 119.760 127.216 -7.456 1
1 827 . 3 1 1 A 72 72 GLN H H 72 8.440 8.176 0.264 1
1 828 . 3 1 1 A 72 72 GLN HA H 72 3.600 4.091 -0.491 1
1 831 . 3 1 1 A 72 72 GLN C C 72 178.820 177.952 0.868 1
1 832 . 3 1 1 A 72 72 GLN CA C 72 59.500 58.208 1.292 1
1 833 . 3 1 1 A 72 72 GLN CB C 72 29.553 28.125 1.428 1
1 835 . 3 1 1 A 72 72 GLN N N 72 121.820 118.285 3.535 1
1 836 . 3 1 1 A 73 73 GLU H H 73 8.290 9.032 -0.742 1
1 837 . 3 1 1 A 73 73 GLU HA H 73 4.070 4.157 -0.087 1
1 842 . 3 1 1 A 73 73 GLU C C 73 179.370 178.880 0.490 1
1 843 . 3 1 1 A 73 73 GLU CA C 73 58.030 58.837 -0.807 1
1 844 . 3 1 1 A 73 73 GLU CB C 73 29.530 30.207 -0.677 1
1 846 . 3 1 1 A 73 73 GLU N N 73 120.550 120.117 0.433 1
1 847 . 3 1 1 A 74 74 PHE H H 74 8.630 8.098 0.532 1
1 848 . 3 1 1 A 74 74 PHE HA H 74 4.020 4.057 -0.037 1
1 851 . 3 1 1 A 74 74 PHE C C 74 177.890 176.856 1.034 1
1 852 . 3 1 1 A 74 74 PHE CA C 74 60.090 61.373 -1.283 1
1 853 . 3 1 1 A 74 74 PHE CB C 74 38.020 39.270 -1.250 1
1 854 . 3 1 1 A 74 74 PHE N N 74 121.010 121.617 -0.607 1
1 855 . 3 1 1 A 75 75 VAL H H 75 8.080 8.004 0.076 1
1 856 . 3 1 1 A 75 75 VAL HA H 75 2.860 2.865 -0.005 1
1 864 . 3 1 1 A 75 75 VAL C C 75 177.030 178.072 -1.042 1
1 865 . 3 1 1 A 75 75 VAL CA C 75 66.430 66.159 0.271 1
1 866 . 3 1 1 A 75 75 VAL CB C 75 30.600 30.800 -0.200 1
1 869 . 3 1 1 A 75 75 VAL N N 75 119.460 118.613 0.847 1
1 870 . 3 1 1 A 76 76 VAL H H 76 7.100 8.046 -0.946 1
1 871 . 3 1 1 A 76 76 VAL HA H 76 3.330 3.440 -0.110 1
1 879 . 3 1 1 A 76 76 VAL C C 76 178.670 178.039 0.631 1
1 880 . 3 1 1 A 76 76 VAL CA C 76 67.000 66.690 0.310 1
1 881 . 3 1 1 A 76 76 VAL CB C 76 31.280 31.454 -0.174 1
1 884 . 3 1 1 A 76 76 VAL N N 76 121.030 120.073 0.957 1
1 885 . 3 1 1 A 77 77 LEU H H 77 6.900 7.950 -1.050 1
1 886 . 3 1 1 A 77 77 LEU HA H 77 3.800 3.940 -0.140 1
1 896 . 3 1 1 A 77 77 LEU C C 77 177.960 178.381 -0.421 1
1 897 . 3 1 1 A 77 77 LEU CA C 77 57.710 58.163 -0.453 1
1 898 . 3 1 1 A 77 77 LEU CB C 77 40.070 41.726 -1.656 1
1 902 . 3 1 1 A 77 77 LEU N N 77 120.310 120.675 -0.365 1
1 903 . 3 1 1 A 78 78 VAL H H 78 7.240 7.480 -0.240 1
1 904 . 3 1 1 A 78 78 VAL HA H 78 3.030 3.810 -0.780 1
1 912 . 3 1 1 A 78 78 VAL C C 78 179.600 177.957 1.643 1
1 913 . 3 1 1 A 78 78 VAL CA C 78 66.420 64.992 1.428 1
1 914 . 3 1 1 A 78 78 VAL CB C 78 30.700 31.428 -0.728 1
1 917 . 3 1 1 A 78 78 VAL N N 78 117.180 116.191 0.989 1
1 918 . 3 1 1 A 79 79 ALA H H 79 9.000 8.123 0.877 1
1 919 . 3 1 1 A 79 79 ALA HA H 79 3.610 3.873 -0.263 1
1 923 . 3 1 1 A 79 79 ALA C C 79 182.260 179.877 2.383 1
1 924 . 3 1 1 A 79 79 ALA CA C 79 55.580 55.548 0.032 1
1 925 . 3 1 1 A 79 79 ALA CB C 79 18.400 17.761 0.639 1
1 926 . 3 1 1 A 79 79 ALA N N 79 126.000 124.567 1.433 1
1 927 . 3 1 1 A 80 80 ALA H H 80 8.000 7.604 0.396 1
1 928 . 3 1 1 A 80 80 ALA HA H 80 4.100 4.101 -0.001 1
1 932 . 3 1 1 A 80 80 ALA C C 80 175.460 179.890 -4.430 1
1 933 . 3 1 1 A 80 80 ALA CA C 80 56.020 54.453 1.567 1
1 934 . 3 1 1 A 80 80 ALA CB C 80 18.040 18.420 -0.380 1
1 935 . 3 1 1 A 80 80 ALA N N 80 120.730 120.812 -0.082 1
1 936 . 3 1 1 A 81 81 LEU H H 81 8.460 7.642 0.818 1
1 937 . 3 1 1 A 81 81 LEU HA H 81 4.000 4.131 -0.131 1
1 941 . 3 1 1 A 81 81 LEU C C 81 177.030 178.938 -1.908 1
1 942 . 3 1 1 A 81 81 LEU CA C 81 57.640 57.614 0.026 1
1 943 . 3 1 1 A 81 81 LEU CB C 81 40.620 41.876 -1.256 1
1 945 . 3 1 1 A 81 81 LEU N N 81 119.890 119.712 0.178 1
1 946 . 3 1 1 A 82 82 THR H H 82 8.320 7.925 0.395 1
1 947 . 3 1 1 A 82 82 THR HA H 82 3.800 4.028 -0.228 1
1 952 . 3 1 1 A 82 82 THR C C 82 181.010 176.892 4.118 1
1 953 . 3 1 1 A 82 82 THR CA C 82 68.500 66.256 2.244 1
1 954 . 3 1 1 A 82 82 THR CB C 82 67.400 69.221 -1.821 1
1 956 . 3 1 1 A 82 82 THR N N 82 117.120 113.062 4.058 1
1 957 . 3 1 1 A 83 83 VAL H H 83 8.530 7.488 1.042 1
1 958 . 3 1 1 A 83 83 VAL HA H 83 3.890 3.829 0.061 1
1 966 . 3 1 1 A 83 83 VAL C C 83 178.120 178.210 -0.090 1
1 967 . 3 1 1 A 83 83 VAL CA C 83 67.400 65.154 2.246 1
1 968 . 3 1 1 A 83 83 VAL CB C 83 31.590 31.546 0.044 1
1 971 . 3 1 1 A 83 83 VAL N N 83 119.760 118.187 1.573 1
1 972 . 3 1 1 A 84 84 ALA H H 84 7.910 8.330 -0.420 1
1 973 . 3 1 1 A 84 84 ALA HA H 84 4.060 4.196 -0.136 1
1 977 . 3 1 1 A 84 84 ALA C C 84 180.560 179.708 0.852 1
1 978 . 3 1 1 A 84 84 ALA CA C 84 55.000 55.227 -0.227 1
1 979 . 3 1 1 A 84 84 ALA CB C 84 17.230 18.348 -1.118 1
1 980 . 3 1 1 A 84 84 ALA N N 84 122.620 124.485 -1.865 1
1 981 . 3 1 1 A 85 85 CYS H H 85 8.580 7.846 0.734 1
1 982 . 3 1 1 A 85 85 CYS HA H 85 4.080 4.482 -0.402 1
1 985 . 3 1 1 A 85 85 CYS C C 85 179.060 177.042 2.018 1
1 986 . 3 1 1 A 85 85 CYS CA C 85 63.210 61.598 1.612 1
1 987 . 3 1 1 A 85 85 CYS CB C 85 26.310 27.416 -1.106 1
1 988 . 3 1 1 A 85 85 CYS N N 85 118.730 117.552 1.178 1
1 989 . 3 1 1 A 86 86 ASN H H 86 8.430 8.127 0.303 1
1 990 . 3 1 1 A 86 86 ASN CA C 86 55.860 56.856 -0.996 1
1 991 . 3 1 1 A 86 86 ASN CB C 86 37.440 39.986 -2.546 1
1 992 . 3 1 1 A 86 86 ASN N N 86 119.360 119.216 0.144 1
1 993 . 3 1 1 A 87 87 ASN H H 87 7.880 8.112 -0.232 1
1 994 . 3 1 1 A 87 87 ASN HA H 87 4.600 4.500 0.100 1
1 997 . 3 1 1 A 87 87 ASN C C 87 178.510 177.511 0.999 1
1 998 . 3 1 1 A 87 87 ASN CA C 87 56.470 56.373 0.097 1
1 999 . 3 1 1 A 87 87 ASN CB C 87 37.500 39.328 -1.828 1
1 1000 . 3 1 1 A 87 87 ASN N N 87 119.480 117.400 2.080 1
1 1001 . 3 1 1 A 88 88 PHE H H 88 8.050 7.506 0.544 1
1 1002 . 3 1 1 A 88 88 PHE HA H 88 4.200 4.505 -0.305 1
1 1005 . 3 1 1 A 88 88 PHE C C 88 178.510 177.154 1.356 1
1 1006 . 3 1 1 A 88 88 PHE CA C 88 56.460 58.672 -2.212 1
1 1007 . 3 1 1 A 88 88 PHE CB C 88 38.500 38.672 -0.172 1
1 1008 . 3 1 1 A 88 88 PHE N N 88 120.280 116.416 3.864 1
1 1009 . 3 1 1 A 89 89 PHE H H 89 8.020 8.256 -0.236 1
1 1010 . 3 1 1 A 89 89 PHE HA H 89 4.000 4.279 -0.279 1
1 1013 . 3 1 1 A 89 89 PHE C C 89 177.340 177.939 -0.599 1
1 1014 . 3 1 1 A 89 89 PHE CA C 89 59.000 60.095 -1.095 1
1 1015 . 3 1 1 A 89 89 PHE CB C 89 37.430 39.775 -2.345 1
1 1016 . 3 1 1 A 89 89 PHE N N 89 120.910 120.304 0.606 1
1 1017 . 3 1 1 A 90 90 TRP H H 90 7.800 8.084 -0.284 1
1 1018 . 3 1 1 A 90 90 TRP HA H 90 4.460 4.467 -0.007 1
1 1021 . 3 1 1 A 90 90 TRP C C 90 177.340 177.932 -0.592 1
1 1022 . 3 1 1 A 90 90 TRP CA C 90 57.930 58.996 -1.066 1
1 1023 . 3 1 1 A 90 90 TRP CB C 90 42.000 30.006 11.994 1
1 1024 . 3 1 1 A 90 90 TRP N N 90 120.050 120.548 -0.498 1
1 1025 . 3 1 1 A 91 91 GLU H H 91 7.800 8.607 -0.807 1
1 1026 . 3 1 1 A 91 91 GLU HA H 91 4.050 3.971 0.079 1
1 1031 . 3 1 1 A 91 91 GLU C C 91 177.570 177.391 0.179 1
1 1032 . 3 1 1 A 91 91 GLU CA C 91 57.350 58.821 -1.471 1
1 1033 . 3 1 1 A 91 91 GLU CB C 91 29.530 29.072 0.458 1
1 1035 . 3 1 1 A 91 91 GLU N N 91 120.730 118.066 2.664 1
1 1036 . 3 1 1 A 92 92 ASN H H 92 7.800 7.797 0.003 1
1 1037 . 3 1 1 A 92 92 ASN HA H 92 4.630 4.711 -0.081 1
1 1040 . 3 1 1 A 92 92 ASN C C 92 174.450 174.262 0.188 1
1 1041 . 3 1 1 A 92 92 ASN CA C 92 52.960 52.592 0.368 1
1 1042 . 3 1 1 A 92 92 ASN CB C 92 29.530 38.772 -9.242 1
1 1043 . 3 1 1 A 92 92 ASN N N 92 119.410 117.130 2.280 1
1 5 . 4 1 1 A 2 2 SER H H 2 9.000 8.032 0.968 1
1 6 . 4 1 1 A 2 2 SER HA H 2 4.690 4.474 0.216 1
1 9 . 4 1 1 A 2 2 SER C C 2 176.170 175.118 1.052 1
1 10 . 4 1 1 A 2 2 SER CA C 2 57.340 58.126 -0.786 1
1 11 . 4 1 1 A 2 2 SER CB C 2 65.550 65.138 0.412 1
1 12 . 4 1 1 A 2 2 SER N N 2 119.330 115.767 3.563 1
1 13 . 4 1 1 A 3 3 GLU H H 3 9.350 8.983 0.367 1
1 14 . 4 1 1 A 3 3 GLU HA H 3 4.060 3.942 0.118 1
1 17 . 4 1 1 A 3 3 GLU C C 3 180.150 178.272 1.878 1
1 18 . 4 1 1 A 3 3 GLU CA C 3 60.280 59.727 0.553 1
1 19 . 4 1 1 A 3 3 GLU CB C 3 29.230 29.500 -0.270 1
1 21 . 4 1 1 A 3 3 GLU N N 3 125.350 121.304 4.046 1
1 22 . 4 1 1 A 4 4 LEU H H 4 9.060 8.225 0.835 1
1 23 . 4 1 1 A 4 4 LEU HA H 4 4.080 3.994 0.086 1
1 33 . 4 1 1 A 4 4 LEU C C 4 177.890 179.234 -1.344 1
1 34 . 4 1 1 A 4 4 LEU CA C 4 58.090 58.007 0.083 1
1 35 . 4 1 1 A 4 4 LEU CB C 4 42.120 41.299 0.821 1
1 39 . 4 1 1 A 4 4 LEU N N 4 121.090 119.983 1.107 1
1 40 . 4 1 1 A 5 5 GLU H H 5 8.340 8.155 0.185 1
1 41 . 4 1 1 A 5 5 GLU HA H 5 4.050 3.893 0.157 1
1 46 . 4 1 1 A 5 5 GLU C C 5 177.030 179.130 -2.100 1
1 47 . 4 1 1 A 5 5 GLU CA C 5 59.840 59.593 0.247 1
1 48 . 4 1 1 A 5 5 GLU CB C 5 28.940 29.312 -0.372 1
1 50 . 4 1 1 A 5 5 GLU N N 5 119.780 119.923 -0.143 1
1 51 . 4 1 1 A 6 6 THR H H 6 8.370 8.551 -0.181 1
1 52 . 4 1 1 A 6 6 THR HA H 6 4.310 3.869 0.441 1
1 57 . 4 1 1 A 6 6 THR C C 6 177.340 177.170 0.170 1
1 58 . 4 1 1 A 6 6 THR CA C 6 66.630 66.435 0.195 1
1 59 . 4 1 1 A 6 6 THR CB C 6 68.650 68.640 0.010 1
1 61 . 4 1 1 A 6 6 THR N N 6 116.940 116.844 0.096 1
1 62 . 4 1 1 A 7 7 ALA H H 7 8.270 7.763 0.507 1
1 63 . 4 1 1 A 7 7 ALA HA H 7 4.190 4.362 -0.172 1
1 67 . 4 1 1 A 7 7 ALA C C 7 179.760 179.561 0.199 1
1 68 . 4 1 1 A 7 7 ALA CA C 7 55.880 54.940 0.940 1
1 69 . 4 1 1 A 7 7 ALA CB C 7 17.720 18.219 -0.499 1
1 70 . 4 1 1 A 7 7 ALA N N 7 127.400 124.377 3.023 1
1 71 . 4 1 1 A 8 8 MET H H 8 8.110 7.703 0.407 1
1 72 . 4 1 1 A 8 8 MET HA H 8 4.020 4.204 -0.184 1
1 80 . 4 1 1 A 8 8 MET C C 8 178.510 178.166 0.344 1
1 81 . 4 1 1 A 8 8 MET CA C 8 60.580 58.036 2.544 1
1 82 . 4 1 1 A 8 8 MET CB C 8 33.630 32.317 1.313 1
1 85 . 4 1 1 A 8 8 MET N N 8 117.520 118.331 -0.811 1
1 86 . 4 1 1 A 9 9 GLU H H 9 8.210 7.670 0.540 1
1 87 . 4 1 1 A 9 9 GLU HA H 9 3.830 4.145 -0.315 1
1 92 . 4 1 1 A 9 9 GLU C C 9 179.140 179.056 0.084 1
1 93 . 4 1 1 A 9 9 GLU CA C 9 59.690 59.106 0.584 1
1 94 . 4 1 1 A 9 9 GLU CB C 9 29.530 28.955 0.575 1
1 96 . 4 1 1 A 9 9 GLU N N 9 118.560 118.257 0.303 1
1 97 . 4 1 1 A 10 10 THR H H 10 8.490 7.639 0.851 1
1 98 . 4 1 1 A 10 10 THR HA H 10 4.000 3.972 0.028 1
1 103 . 4 1 1 A 10 10 THR C C 10 176.010 176.733 -0.723 1
1 104 . 4 1 1 A 10 10 THR CA C 10 67.110 67.065 0.045 1
1 105 . 4 1 1 A 10 10 THR CB C 10 67.770 68.592 -0.822 1
1 107 . 4 1 1 A 10 10 THR N N 10 118.310 116.513 1.797 1
1 108 . 4 1 1 A 11 11 LEU H H 11 7.920 7.984 -0.064 1
1 109 . 4 1 1 A 11 11 LEU HA H 11 3.930 4.178 -0.248 1
1 119 . 4 1 1 A 11 11 LEU C C 11 178.820 178.971 -0.151 1
1 120 . 4 1 1 A 11 11 LEU CA C 11 59.690 58.270 1.420 1
1 121 . 4 1 1 A 11 11 LEU CB C 11 41.920 41.464 0.456 1
1 125 . 4 1 1 A 11 11 LEU N N 11 121.150 121.177 -0.027 1
1 126 . 4 1 1 A 12 12 ILE H H 12 7.440 7.879 -0.439 1
1 127 . 4 1 1 A 12 12 ILE HA H 12 3.640 3.876 -0.236 1
1 137 . 4 1 1 A 12 12 ILE C C 12 179.530 178.998 0.532 1
1 138 . 4 1 1 A 12 12 ILE CA C 12 63.740 65.343 -1.603 1
1 139 . 4 1 1 A 12 12 ILE CB C 12 38.800 37.787 1.013 1
1 143 . 4 1 1 A 12 12 ILE N N 12 118.010 120.255 -2.245 1
1 144 . 4 1 1 A 13 13 ASN H H 13 8.930 7.960 0.970 1
1 145 . 4 1 1 A 13 13 ASN HA H 13 4.520 4.671 -0.151 1
1 148 . 4 1 1 A 13 13 ASN C C 13 179.450 177.843 1.607 1
1 149 . 4 1 1 A 13 13 ASN CA C 13 56.470 55.971 0.499 1
1 150 . 4 1 1 A 13 13 ASN CB C 13 37.930 38.741 -0.811 1
1 151 . 4 1 1 A 13 13 ASN N N 13 121.820 119.430 2.390 1
1 152 . 4 1 1 A 14 14 VAL H H 14 9.180 8.267 0.913 1
1 153 . 4 1 1 A 14 14 VAL HA H 14 3.830 3.879 -0.049 1
1 161 . 4 1 1 A 14 14 VAL CA C 14 65.840 65.345 0.495 1
1 162 . 4 1 1 A 14 14 VAL CB C 14 31.290 31.500 -0.210 1
1 165 . 4 1 1 A 14 14 VAL N N 14 122.040 119.277 2.763 1
1 166 . 4 1 1 A 15 15 PHE H H 15 7.590 8.295 -0.705 1
1 167 . 4 1 1 A 15 15 PHE HA H 15 3.360 3.940 -0.580 1
1 170 . 4 1 1 A 15 15 PHE C C 15 177.890 177.573 0.317 1
1 171 . 4 1 1 A 15 15 PHE CA C 15 62.030 62.063 -0.033 1
1 172 . 4 1 1 A 15 15 PHE CB C 15 38.900 39.057 -0.157 1
1 173 . 4 1 1 A 15 15 PHE N N 15 118.290 122.183 -3.893 1
1 174 . 4 1 1 A 16 16 HIS H H 16 7.790 8.115 -0.325 1
1 175 . 4 1 1 A 16 16 HIS HA H 16 4.890 4.523 0.367 1
1 178 . 4 1 1 A 16 16 HIS C C 16 177.810 177.479 0.331 1
1 179 . 4 1 1 A 16 16 HIS CA C 16 59.100 59.870 -0.770 1
1 180 . 4 1 1 A 16 16 HIS CB C 16 28.060 29.301 -1.241 1
1 181 . 4 1 1 A 16 16 HIS N N 16 118.290 117.920 0.370 1
1 182 . 4 1 1 A 17 17 ALA H H 17 8.040 8.061 -0.021 1
1 183 . 4 1 1 A 17 17 ALA HA H 17 4.050 3.931 0.119 1
1 187 . 4 1 1 A 17 17 ALA C C 17 179.600 179.751 -0.151 1
1 188 . 4 1 1 A 17 17 ALA CA C 17 54.000 55.296 -1.296 1
1 189 . 4 1 1 A 17 17 ALA CB C 17 17.520 18.777 -1.257 1
1 190 . 4 1 1 A 17 17 ALA N N 17 124.410 121.827 2.583 1
1 191 . 4 1 1 A 18 18 HIS H H 18 7.000 7.415 -0.415 1
1 192 . 4 1 1 A 18 18 HIS HA H 18 4.330 4.327 0.003 1
1 195 . 4 1 1 A 18 18 HIS C C 18 176.320 178.016 -1.696 1
1 196 . 4 1 1 A 18 18 HIS CA C 18 57.350 58.860 -1.510 1
1 197 . 4 1 1 A 18 18 HIS CB C 18 32.920 30.342 2.578 1
1 198 . 4 1 1 A 18 18 HIS N N 18 115.160 115.878 -0.718 1
1 199 . 4 1 1 A 19 19 SER H H 19 8.380 8.112 0.268 1
1 200 . 4 1 1 A 19 19 SER HA H 19 3.640 3.833 -0.193 1
1 203 . 4 1 1 A 19 19 SER C C 19 177.340 175.885 1.455 1
1 204 . 4 1 1 A 19 19 SER CA C 19 60.160 60.916 -0.756 1
1 205 . 4 1 1 A 19 19 SER CB C 19 61.000 61.638 -0.638 1
1 206 . 4 1 1 A 19 19 SER N N 19 114.380 115.802 -1.422 1
1 207 . 4 1 1 A 20 20 GLY H H 20 7.600 7.706 -0.106 1
1 208 . 4 1 1 A 20 20 GLY HA2 H 20 3.680 3.878 -0.198 1
1 209 . 4 1 1 A 20 20 GLY HA3 H 20 4.000 3.891 0.109 1
1 210 . 4 1 1 A 20 20 GLY C C 20 174.140 174.424 -0.284 1
1 211 . 4 1 1 A 20 20 GLY CA C 20 47.000 45.183 1.817 1
1 212 . 4 1 1 A 20 20 GLY N N 20 112.550 108.755 3.795 1
1 213 . 4 1 1 A 21 21 LYS H H 21 7.230 7.223 0.007 1
1 214 . 4 1 1 A 21 21 LYS HA H 21 3.860 4.329 -0.469 1
1 223 . 4 1 1 A 21 21 LYS C C 21 177.730 178.052 -0.322 1
1 224 . 4 1 1 A 21 21 LYS CA C 21 59.110 56.911 2.199 1
1 225 . 4 1 1 A 21 21 LYS CB C 21 32.460 34.555 -2.095 1
1 229 . 4 1 1 A 21 21 LYS N N 21 123.240 118.222 5.018 1
1 230 . 4 1 1 A 22 22 GLU H H 22 9.350 8.347 1.003 1
1 231 . 4 1 1 A 22 22 GLU HA H 22 4.610 4.445 0.165 1
1 236 . 4 1 1 A 22 22 GLU C C 22 177.420 175.620 1.800 1
1 237 . 4 1 1 A 22 22 GLU CA C 22 53.700 56.115 -2.415 1
1 238 . 4 1 1 A 22 22 GLU CB C 22 32.000 30.093 1.907 1
1 240 . 4 1 1 A 22 22 GLU N N 22 116.770 115.956 0.814 1
1 241 . 4 1 1 A 23 23 GLY H H 23 7.570 7.630 -0.060 1
1 242 . 4 1 1 A 23 23 GLY HA2 H 23 3.630 3.972 -0.342 1
1 243 . 4 1 1 A 23 23 GLY HA3 H 23 3.880 3.995 -0.115 1
1 244 . 4 1 1 A 23 23 GLY C C 23 173.980 171.633 2.347 1
1 245 . 4 1 1 A 23 23 GLY CA C 23 45.250 45.638 -0.388 1
1 246 . 4 1 1 A 23 23 GLY N N 23 112.180 107.882 4.298 1
1 247 . 4 1 1 A 24 24 ASP H H 24 8.680 8.507 0.173 1
1 248 . 4 1 1 A 24 24 ASP HA H 24 4.380 4.566 -0.186 1
1 251 . 4 1 1 A 24 24 ASP C C 24 178.590 177.736 0.854 1
1 252 . 4 1 1 A 24 24 ASP CA C 24 60.000 54.940 5.060 1
1 253 . 4 1 1 A 24 24 ASP CB C 24 27.480 41.128 -13.648 1
1 254 . 4 1 1 A 24 24 ASP N N 24 127.470 121.026 6.444 1
1 255 . 4 1 1 A 25 25 LYS H H 25 9.270 8.621 0.649 1
1 256 . 4 1 1 A 25 25 LYS HA H 25 4.250 3.794 0.456 1
1 265 . 4 1 1 A 25 25 LYS C C 25 177.030 177.068 -0.038 1
1 266 . 4 1 1 A 25 25 LYS CA C 25 60.000 60.042 -0.042 1
1 267 . 4 1 1 A 25 25 LYS CB C 25 31.170 32.114 -0.944 1
1 271 . 4 1 1 A 25 25 LYS N N 25 132.960 123.246 9.714 1
1 272 . 4 1 1 A 26 26 TYR H H 26 9.430 7.956 1.474 1
1 273 . 4 1 1 A 26 26 TYR HA H 26 4.640 4.876 -0.236 1
1 276 . 4 1 1 A 26 26 TYR C C 26 174.290 174.852 -0.562 1
1 277 . 4 1 1 A 26 26 TYR CA C 26 56.010 57.179 -1.169 1
1 278 . 4 1 1 A 26 26 TYR CB C 26 37.730 38.550 -0.820 1
1 279 . 4 1 1 A 26 26 TYR N N 26 120.650 114.208 6.442 1
1 280 . 4 1 1 A 27 27 LYS H H 27 7.110 7.219 -0.109 1
1 281 . 4 1 1 A 27 27 LYS HA H 27 5.110 5.025 0.085 1
1 290 . 4 1 1 A 27 27 LYS C C 27 175.150 174.817 0.333 1
1 291 . 4 1 1 A 27 27 LYS CA C 27 55.070 54.946 0.124 1
1 292 . 4 1 1 A 27 27 LYS CB C 27 38.900 36.604 2.296 1
1 296 . 4 1 1 A 27 27 LYS N N 27 115.830 117.729 -1.899 1
1 297 . 4 1 1 A 28 28 LEU H H 28 9.820 8.538 1.282 1
1 298 . 4 1 1 A 28 28 LEU HA H 28 5.080 4.943 0.137 1
1 308 . 4 1 1 A 28 28 LEU C C 28 176.640 176.416 0.224 1
1 309 . 4 1 1 A 28 28 LEU CA C 28 52.660 53.470 -0.810 1
1 310 . 4 1 1 A 28 28 LEU CB C 28 42.710 43.007 -0.297 1
1 314 . 4 1 1 A 28 28 LEU N N 28 126.930 124.894 2.036 1
1 315 . 4 1 1 A 29 29 SER H H 29 9.890 8.959 0.931 1
1 316 . 4 1 1 A 29 29 SER HA H 29 4.530 4.508 0.022 1
1 319 . 4 1 1 A 29 29 SER C C 29 174.990 175.470 -0.480 1
1 320 . 4 1 1 A 29 29 SER CA C 29 56.180 57.853 -1.673 1
1 321 . 4 1 1 A 29 29 SER CB C 29 65.550 64.302 1.248 1
1 322 . 4 1 1 A 29 29 SER N N 29 121.600 122.220 -0.620 1
1 323 . 4 1 1 A 30 30 LYS H H 30 8.850 9.003 -0.153 1
1 324 . 4 1 1 A 30 30 LYS HA H 30 3.850 3.932 -0.082 1
1 333 . 4 1 1 A 30 30 LYS C C 30 175.620 178.422 -2.802 1
1 334 . 4 1 1 A 30 30 LYS CA C 30 60.860 60.119 0.741 1
1 335 . 4 1 1 A 30 30 LYS CB C 30 31.290 32.136 -0.846 1
1 339 . 4 1 1 A 30 30 LYS N N 30 121.260 124.694 -3.434 1
1 340 . 4 1 1 A 31 31 LYS H H 31 7.970 8.029 -0.059 1
1 341 . 4 1 1 A 31 31 LYS HA H 31 3.880 4.056 -0.176 1
1 350 . 4 1 1 A 31 31 LYS C C 31 179.290 178.720 0.570 1
1 351 . 4 1 1 A 31 31 LYS CA C 31 59.110 58.963 0.147 1
1 352 . 4 1 1 A 31 31 LYS CB C 31 32.640 31.932 0.708 1
1 356 . 4 1 1 A 31 31 LYS N N 31 121.260 118.203 3.057 1
1 357 . 4 1 1 A 32 32 GLU H H 32 7.510 8.217 -0.707 1
1 358 . 4 1 1 A 32 32 GLU HA H 32 3.830 4.014 -0.184 1
1 363 . 4 1 1 A 32 32 GLU C C 32 179.290 179.469 -0.179 1
1 364 . 4 1 1 A 32 32 GLU CA C 32 58.590 58.830 -0.240 1
1 365 . 4 1 1 A 32 32 GLU CB C 32 30.120 29.677 0.443 1
1 367 . 4 1 1 A 32 32 GLU N N 32 120.090 119.535 0.555 1
1 368 . 4 1 1 A 33 33 LEU H H 33 8.970 7.699 1.271 1
1 369 . 4 1 1 A 33 33 LEU HA H 33 3.830 3.726 0.104 1
1 379 . 4 1 1 A 33 33 LEU C C 33 178.200 178.701 -0.501 1
1 380 . 4 1 1 A 33 33 LEU CA C 33 57.930 57.924 0.006 1
1 381 . 4 1 1 A 33 33 LEU CB C 33 40.660 41.376 -0.716 1
1 385 . 4 1 1 A 33 33 LEU N N 33 120.200 119.322 0.878 1
1 386 . 4 1 1 A 34 34 LYS H H 34 8.230 7.520 0.710 1
1 387 . 4 1 1 A 34 34 LYS HA H 34 3.550 3.875 -0.325 1
1 396 . 4 1 1 A 34 34 LYS C C 34 178.040 178.700 -0.660 1
1 397 . 4 1 1 A 34 34 LYS CA C 34 60.720 58.901 1.819 1
1 398 . 4 1 1 A 34 34 LYS CB C 34 31.980 31.906 0.074 1
1 402 . 4 1 1 A 34 34 LYS N N 34 120.780 119.164 1.616 1
1 403 . 4 1 1 A 35 35 ASP H H 35 7.990 7.856 0.134 1
1 404 . 4 1 1 A 35 35 ASP HA H 35 4.250 4.417 -0.167 1
1 407 . 4 1 1 A 35 35 ASP C C 35 179.060 178.506 0.554 1
1 408 . 4 1 1 A 35 35 ASP CA C 35 56.830 57.350 -0.520 1
1 409 . 4 1 1 A 35 35 ASP CB C 35 40.440 40.428 0.012 1
1 410 . 4 1 1 A 35 35 ASP N N 35 119.550 119.589 -0.039 1
1 411 . 4 1 1 A 36 36 LEU H H 36 8.130 7.566 0.564 1
1 412 . 4 1 1 A 36 36 LEU HA H 36 2.580 3.409 -0.829 1
1 422 . 4 1 1 A 36 36 LEU C C 36 179.450 178.170 1.280 1
1 423 . 4 1 1 A 36 36 LEU CA C 36 59.980 57.934 2.046 1
1 424 . 4 1 1 A 36 36 LEU CB C 36 42.180 41.179 1.001 1
1 428 . 4 1 1 A 36 36 LEU N N 36 125.560 121.380 4.180 1
1 429 . 4 1 1 A 37 37 LEU H H 37 8.740 7.829 0.911 1
1 430 . 4 1 1 A 37 37 LEU HA H 37 3.580 3.880 -0.300 1
1 440 . 4 1 1 A 37 37 LEU C C 37 179.290 178.838 0.452 1
1 441 . 4 1 1 A 37 37 LEU CA C 37 58.230 58.093 0.137 1
1 442 . 4 1 1 A 37 37 LEU CB C 37 41.590 41.206 0.384 1
1 446 . 4 1 1 A 37 37 LEU N N 37 120.520 118.479 2.041 1
1 447 . 4 1 1 A 38 38 GLN H H 38 8.520 8.065 0.455 1
1 448 . 4 1 1 A 38 38 GLN HA H 38 4.000 4.045 -0.045 1
1 453 . 4 1 1 A 38 38 GLN C C 38 177.960 178.329 -0.369 1
1 454 . 4 1 1 A 38 38 GLN CA C 38 58.210 58.203 0.007 1
1 455 . 4 1 1 A 38 38 GLN CB C 38 28.650 28.101 0.549 1
1 457 . 4 1 1 A 38 38 GLN N N 38 116.740 117.586 -0.846 1
1 458 . 4 1 1 A 39 39 THR H H 39 7.910 7.793 0.117 1
1 459 . 4 1 1 A 39 39 THR HA H 39 4.210 3.847 0.363 1
1 464 . 4 1 1 A 39 39 THR C C 39 177.180 175.955 1.225 1
1 465 . 4 1 1 A 39 39 THR CA C 39 64.730 67.160 -2.430 1
1 466 . 4 1 1 A 39 39 THR CB C 39 69.650 68.487 1.163 1
1 468 . 4 1 1 A 39 39 THR N N 39 111.400 117.039 -5.639 1
1 469 . 4 1 1 A 40 40 GLU H H 40 8.590 7.852 0.738 1
1 470 . 4 1 1 A 40 40 GLU HA H 40 4.680 4.430 0.250 1
1 475 . 4 1 1 A 40 40 GLU C C 40 178.280 177.176 1.104 1
1 476 . 4 1 1 A 40 40 GLU CA C 40 55.880 56.576 -0.696 1
1 477 . 4 1 1 A 40 40 GLU CB C 40 30.990 30.289 0.701 1
1 479 . 4 1 1 A 40 40 GLU N N 40 117.840 116.381 1.459 1
1 480 . 4 1 1 A 41 41 LEU H H 41 7.680 7.435 0.245 1
1 481 . 4 1 1 A 41 41 LEU HA H 41 5.080 4.882 0.198 1
1 491 . 4 1 1 A 41 41 LEU C C 41 179.450 177.399 2.051 1
1 492 . 4 1 1 A 41 41 LEU CA C 41 53.830 54.088 -0.258 1
1 493 . 4 1 1 A 41 41 LEU CB C 41 41.360 42.856 -1.496 1
1 497 . 4 1 1 A 41 41 LEU N N 41 121.410 119.535 1.875 1
1 498 . 4 1 1 A 42 42 SER H H 42 8.380 7.875 0.505 1
1 499 . 4 1 1 A 42 42 SER HA H 42 4.130 4.103 0.027 1
1 502 . 4 1 1 A 42 42 SER C C 42 176.640 176.911 -0.271 1
1 503 . 4 1 1 A 42 42 SER CA C 42 61.280 61.642 -0.362 1
1 504 . 4 1 1 A 42 42 SER CB C 42 63.040 63.029 0.011 1
1 505 . 4 1 1 A 42 42 SER N N 42 117.420 117.253 0.167 1
1 506 . 4 1 1 A 43 43 SER H H 43 8.900 8.148 0.752 1
1 507 . 4 1 1 A 43 43 SER HA H 43 4.290 4.507 -0.217 1
1 510 . 4 1 1 A 43 43 SER C C 43 175.620 176.448 -0.828 1
1 511 . 4 1 1 A 43 43 SER CA C 43 60.860 60.705 0.155 1
1 512 . 4 1 1 A 43 43 SER CB C 43 62.910 63.492 -0.582 1
1 513 . 4 1 1 A 43 43 SER N N 43 117.580 117.101 0.479 1
1 514 . 4 1 1 A 44 44 PHE H H 44 7.880 8.061 -0.181 1
1 515 . 4 1 1 A 44 44 PHE HA H 44 4.240 4.198 0.042 1
1 518 . 4 1 1 A 44 44 PHE C C 44 176.950 175.782 1.168 1
1 519 . 4 1 1 A 44 44 PHE CA C 44 62.710 61.328 1.382 1
1 520 . 4 1 1 A 44 44 PHE CB C 44 39.020 38.999 0.021 1
1 521 . 4 1 1 A 44 44 PHE N N 44 119.480 122.510 -3.030 1
1 522 . 4 1 1 A 45 45 LEU H H 45 8.060 7.662 0.398 1
1 523 . 4 1 1 A 45 45 LEU HA H 45 3.810 3.643 0.167 1
1 533 . 4 1 1 A 45 45 LEU C C 45 177.500 176.414 1.086 1
1 534 . 4 1 1 A 45 45 LEU CA C 45 59.980 55.361 4.619 1
1 535 . 4 1 1 A 45 45 LEU CB C 45 39.640 42.048 -2.408 1
1 538 . 4 1 1 A 45 45 LEU N N 45 118.010 121.918 -3.908 1
1 539 . 4 1 1 A 46 46 ASP H H 46 8.150 8.452 -0.302 1
1 540 . 4 1 1 A 46 46 ASP HA H 46 4.470 4.676 -0.206 1
1 543 . 4 1 1 A 46 46 ASP C C 46 179.920 175.874 4.046 1
1 544 . 4 1 1 A 46 46 ASP CA C 46 52.950 53.197 -0.247 1
1 545 . 4 1 1 A 46 46 ASP CB C 46 40.000 40.794 -0.794 1
1 546 . 4 1 1 A 46 46 ASP N N 46 119.460 124.437 -4.977 1
1 547 . 4 1 1 A 47 47 VAL H H 47 8.010 8.482 -0.472 1
1 548 . 4 1 1 A 47 47 VAL HA H 47 3.800 4.407 -0.607 1
1 556 . 4 1 1 A 47 47 VAL C C 47 175.460 176.884 -1.424 1
1 557 . 4 1 1 A 47 47 VAL CA C 47 60.000 62.804 -2.804 1
1 558 . 4 1 1 A 47 47 VAL CB C 47 31.580 33.568 -1.988 1
1 561 . 4 1 1 A 47 47 VAL N N 47 117.720 120.796 -3.076 1
1 562 . 4 1 1 A 48 48 GLN H H 48 7.960 8.710 -0.750 1
1 563 . 4 1 1 A 48 48 GLN HA H 48 4.060 3.978 0.082 1
1 568 . 4 1 1 A 48 48 GLN C C 48 179.370 178.831 0.539 1
1 569 . 4 1 1 A 48 48 GLN CA C 48 57.350 58.942 -1.592 1
1 570 . 4 1 1 A 48 48 GLN CB C 48 28.990 28.171 0.819 1
1 572 . 4 1 1 A 48 48 GLN N N 48 119.900 122.048 -2.148 1
1 573 . 4 1 1 A 49 49 LYS H H 49 7.810 7.744 0.066 1
1 574 . 4 1 1 A 49 49 LYS HA H 49 3.860 4.188 -0.328 1
1 583 . 4 1 1 A 49 49 LYS C C 49 177.890 176.417 1.473 1
1 584 . 4 1 1 A 49 49 LYS CA C 49 58.230 58.706 -0.476 1
1 585 . 4 1 1 A 49 49 LYS CB C 49 30.990 32.432 -1.442 1
1 587 . 4 1 1 A 49 49 LYS N N 49 120.030 119.514 0.516 1
1 588 . 4 1 1 A 50 50 ASP H H 50 7.570 7.826 -0.256 1
1 589 . 4 1 1 A 50 50 ASP HA H 50 4.700 4.818 -0.118 1
1 590 . 4 1 1 A 50 50 ASP CA C 50 52.950 53.018 -0.068 1
1 591 . 4 1 1 A 50 50 ASP CB C 50 38.900 41.230 -2.330 1
1 592 . 4 1 1 A 50 50 ASP N N 50 116.730 119.619 -2.889 1
1 593 . 4 1 1 A 51 51 ALA H H 51 7.570 8.784 -1.214 1
1 594 . 4 1 1 A 51 51 ALA HA H 51 4.200 4.092 0.108 1
1 598 . 4 1 1 A 51 51 ALA C C 51 179.760 179.311 0.449 1
1 599 . 4 1 1 A 51 51 ALA CA C 51 54.200 55.263 -1.063 1
1 600 . 4 1 1 A 51 51 ALA CB C 51 18.110 18.465 -0.355 1
1 601 . 4 1 1 A 51 51 ALA N N 51 118.390 127.391 -9.001 1
1 602 . 4 1 1 A 52 52 ASP H H 52 8.430 8.352 0.078 1
1 603 . 4 1 1 A 52 52 ASP HA H 52 4.600 4.364 0.236 1
1 606 . 4 1 1 A 52 52 ASP C C 52 177.570 178.518 -0.948 1
1 607 . 4 1 1 A 52 52 ASP CA C 52 54.420 56.770 -2.350 1
1 608 . 4 1 1 A 52 52 ASP CB C 52 40.360 40.071 0.289 1
1 609 . 4 1 1 A 52 52 ASP N N 52 117.530 119.381 -1.851 1
1 610 . 4 1 1 A 53 53 ALA H H 53 7.660 7.782 -0.122 1
1 611 . 4 1 1 A 53 53 ALA HA H 53 3.860 4.009 -0.149 1
1 615 . 4 1 1 A 53 53 ALA C C 53 180.070 180.678 -0.608 1
1 616 . 4 1 1 A 53 53 ALA CA C 53 55.590 55.364 0.226 1
1 617 . 4 1 1 A 53 53 ALA CB C 53 18.800 18.093 0.707 1
1 618 . 4 1 1 A 53 53 ALA N N 53 123.450 122.567 0.883 1
1 619 . 4 1 1 A 54 54 VAL H H 54 8.030 7.702 0.328 1
1 620 . 4 1 1 A 54 54 VAL HA H 54 3.240 3.675 -0.435 1
1 628 . 4 1 1 A 54 54 VAL C C 54 177.340 177.494 -0.154 1
1 629 . 4 1 1 A 54 54 VAL CA C 54 66.620 65.589 1.031 1
1 630 . 4 1 1 A 54 54 VAL CB C 54 30.480 31.020 -0.540 1
1 633 . 4 1 1 A 54 54 VAL N N 54 116.150 117.278 -1.128 1
1 634 . 4 1 1 A 55 55 ASP H H 55 7.660 7.772 -0.112 1
1 635 . 4 1 1 A 55 55 ASP HA H 55 4.080 4.385 -0.305 1
1 638 . 4 1 1 A 55 55 ASP C C 55 177.260 179.353 -2.093 1
1 639 . 4 1 1 A 55 55 ASP CA C 55 57.640 57.346 0.294 1
1 640 . 4 1 1 A 55 55 ASP CB C 55 40.360 40.066 0.294 1
1 641 . 4 1 1 A 55 55 ASP N N 55 120.830 122.399 -1.569 1
1 642 . 4 1 1 A 56 56 LYS H H 56 7.780 7.642 0.138 1
1 643 . 4 1 1 A 56 56 LYS HA H 56 3.860 4.051 -0.191 1
1 652 . 4 1 1 A 56 56 LYS C C 56 179.530 179.441 0.089 1
1 653 . 4 1 1 A 56 56 LYS CA C 56 59.690 59.859 -0.169 1
1 654 . 4 1 1 A 56 56 LYS CB C 56 31.870 32.474 -0.604 1
1 658 . 4 1 1 A 56 56 LYS N N 56 120.010 119.066 0.944 1
1 659 . 4 1 1 A 57 57 ILE H H 57 8.090 7.673 0.417 1
1 660 . 4 1 1 A 57 57 ILE HA H 57 3.390 3.695 -0.305 1
1 670 . 4 1 1 A 57 57 ILE C C 57 176.710 177.674 -0.964 1
1 671 . 4 1 1 A 57 57 ILE CA C 57 64.960 65.037 -0.077 1
1 672 . 4 1 1 A 57 57 ILE CB C 57 38.080 37.550 0.530 1
1 676 . 4 1 1 A 57 57 ILE N N 57 120.960 119.912 1.048 1
1 677 . 4 1 1 A 58 58 MET H H 58 8.480 8.168 0.312 1
1 678 . 4 1 1 A 58 58 MET HA H 58 3.800 4.116 -0.316 1
1 686 . 4 1 1 A 58 58 MET C C 58 177.570 177.955 -0.385 1
1 687 . 4 1 1 A 58 58 MET CA C 58 58.570 58.425 0.145 1
1 688 . 4 1 1 A 58 58 MET CB C 58 32.570 31.905 0.665 1
1 691 . 4 1 1 A 58 58 MET N N 58 119.160 120.066 -0.906 1
1 692 . 4 1 1 A 59 59 LYS H H 59 7.550 8.013 -0.463 1
1 693 . 4 1 1 A 59 59 LYS HA H 59 3.930 4.034 -0.104 1
1 702 . 4 1 1 A 59 59 LYS C C 59 179.530 178.913 0.617 1
1 703 . 4 1 1 A 59 59 LYS CA C 59 58.820 59.411 -0.591 1
1 704 . 4 1 1 A 59 59 LYS CB C 59 32.450 32.056 0.394 1
1 708 . 4 1 1 A 59 59 LYS N N 59 116.730 117.640 -0.910 1
1 709 . 4 1 1 A 60 60 GLU H H 60 7.470 7.442 0.028 1
1 710 . 4 1 1 A 60 60 GLU HA H 60 4.050 4.109 -0.059 1
1 715 . 4 1 1 A 60 60 GLU C C 60 178.950 178.266 0.684 1
1 716 . 4 1 1 A 60 60 GLU CA C 60 58.600 58.802 -0.202 1
1 717 . 4 1 1 A 60 60 GLU CB C 60 31.700 29.697 2.003 1
1 719 . 4 1 1 A 60 60 GLU N N 60 116.820 119.362 -2.542 1
1 720 . 4 1 1 A 61 61 LEU H H 61 8.030 7.633 0.397 1
1 721 . 4 1 1 A 61 61 LEU HA H 61 4.310 4.354 -0.044 1
1 731 . 4 1 1 A 61 61 LEU C C 61 179.450 177.018 2.432 1
1 732 . 4 1 1 A 61 61 LEU CA C 61 54.840 55.320 -0.480 1
1 733 . 4 1 1 A 61 61 LEU CB C 61 43.820 42.360 1.460 1
1 737 . 4 1 1 A 61 61 LEU N N 61 116.000 118.706 -2.706 1
1 738 . 4 1 1 A 62 62 ASP H H 62 7.890 8.207 -0.317 1
1 739 . 4 1 1 A 62 62 ASP HA H 62 4.660 4.916 -0.256 1
1 742 . 4 1 1 A 62 62 ASP C C 62 177.030 176.145 0.885 1
1 743 . 4 1 1 A 62 62 ASP CA C 62 53.660 53.870 -0.210 1
1 744 . 4 1 1 A 62 62 ASP CB C 62 38.700 39.853 -1.153 1
1 745 . 4 1 1 A 62 62 ASP N N 62 117.550 119.215 -1.665 1
1 746 . 4 1 1 A 63 63 GLU H H 63 8.430 8.616 -0.186 1
1 747 . 4 1 1 A 63 63 GLU HA H 63 4.020 4.033 -0.013 1
1 752 . 4 1 1 A 63 63 GLU C C 63 178.120 178.734 -0.614 1
1 753 . 4 1 1 A 63 63 GLU CA C 63 58.470 59.259 -0.789 1
1 754 . 4 1 1 A 63 63 GLU CB C 63 30.120 29.418 0.702 1
1 756 . 4 1 1 A 63 63 GLU N N 63 130.230 120.256 9.974 1
1 757 . 4 1 1 A 64 64 ASN H H 64 8.010 7.732 0.278 1
1 758 . 4 1 1 A 64 64 ASN HA H 64 4.680 4.807 -0.127 1
1 761 . 4 1 1 A 64 64 ASN C C 64 177.100 175.637 1.463 1
1 762 . 4 1 1 A 64 64 ASN CA C 64 51.780 53.299 -1.519 1
1 763 . 4 1 1 A 64 64 ASN CB C 64 37.260 39.114 -1.854 1
1 764 . 4 1 1 A 64 64 ASN N N 64 113.640 115.149 -1.509 1
1 765 . 4 1 1 A 65 65 GLY H H 65 7.550 7.919 -0.369 1
1 766 . 4 1 1 A 65 65 GLY HA2 H 65 3.770 3.956 -0.186 1
1 767 . 4 1 1 A 65 65 GLY HA3 H 65 3.770 3.956 -0.186 1
1 768 . 4 1 1 A 65 65 GLY C C 65 178.980 175.006 3.974 1
1 769 . 4 1 1 A 65 65 GLY CA C 65 47.200 46.621 0.579 1
1 770 . 4 1 1 A 65 65 GLY N N 65 113.640 107.362 6.278 1
1 771 . 4 1 1 A 66 66 ASP H H 66 8.110 8.216 -0.106 1
1 772 . 4 1 1 A 66 66 ASP HA H 66 4.490 4.571 -0.081 1
1 775 . 4 1 1 A 66 66 ASP C C 66 177.960 177.548 0.412 1
1 776 . 4 1 1 A 66 66 ASP CA C 66 52.960 53.585 -0.625 1
1 777 . 4 1 1 A 66 66 ASP CB C 66 40.540 40.489 0.051 1
1 778 . 4 1 1 A 66 66 ASP N N 66 120.030 120.258 -0.228 1
1 779 . 4 1 1 A 67 67 GLY H H 67 10.260 9.618 0.642 1
1 780 . 4 1 1 A 67 67 GLY HA2 H 67 3.360 3.839 -0.479 1
1 781 . 4 1 1 A 67 67 GLY HA3 H 67 4.000 3.839 0.161 1
1 782 . 4 1 1 A 67 67 GLY C C 67 173.120 173.396 -0.276 1
1 783 . 4 1 1 A 67 67 GLY CA C 67 45.460 45.751 -0.291 1
1 784 . 4 1 1 A 67 67 GLY N N 67 114.100 111.745 2.355 1
1 785 . 4 1 1 A 68 68 GLU H H 68 7.750 8.242 -0.492 1
1 786 . 4 1 1 A 68 68 GLU HA H 68 4.780 4.943 -0.163 1
1 791 . 4 1 1 A 68 68 GLU C C 68 175.930 174.865 1.065 1
1 792 . 4 1 1 A 68 68 GLU CA C 68 54.430 54.420 0.010 1
1 793 . 4 1 1 A 68 68 GLU CB C 68 35.850 33.827 2.023 1
1 795 . 4 1 1 A 68 68 GLU N N 68 118.000 119.267 -1.267 1
1 796 . 4 1 1 A 69 69 VAL H H 69 9.380 8.631 0.749 1
1 797 . 4 1 1 A 69 69 VAL HA H 69 5.260 4.956 0.304 1
1 805 . 4 1 1 A 69 69 VAL C C 69 176.710 174.678 2.032 1
1 806 . 4 1 1 A 69 69 VAL CA C 69 61.280 61.303 -0.023 1
1 807 . 4 1 1 A 69 69 VAL CB C 69 33.980 33.897 0.083 1
1 810 . 4 1 1 A 69 69 VAL N N 69 125.970 121.311 4.659 1
1 811 . 4 1 1 A 70 70 ASP H H 70 9.100 8.995 0.105 1
1 812 . 4 1 1 A 70 70 ASP HA H 70 5.190 4.897 0.293 1
1 815 . 4 1 1 A 70 70 ASP C C 70 175.700 177.839 -2.139 1
1 816 . 4 1 1 A 70 70 ASP CA C 70 52.370 53.530 -1.160 1
1 817 . 4 1 1 A 70 70 ASP CB C 70 40.950 41.595 -0.645 1
1 818 . 4 1 1 A 70 70 ASP N N 70 130.320 127.285 3.035 1
1 819 . 4 1 1 A 71 71 PHE H H 71 9.090 9.334 -0.244 1
1 820 . 4 1 1 A 71 71 PHE HA H 71 4.100 4.138 -0.038 1
1 823 . 4 1 1 A 71 71 PHE C C 71 177.000 177.464 -0.464 1
1 824 . 4 1 1 A 71 71 PHE CA C 71 58.230 62.083 -3.853 1
1 825 . 4 1 1 A 71 71 PHE CB C 71 36.910 39.270 -2.360 1
1 826 . 4 1 1 A 71 71 PHE N N 71 119.760 123.381 -3.621 1
1 827 . 4 1 1 A 72 72 GLN H H 72 8.440 8.499 -0.059 1
1 828 . 4 1 1 A 72 72 GLN HA H 72 3.600 4.049 -0.449 1
1 831 . 4 1 1 A 72 72 GLN C C 72 178.820 178.096 0.724 1
1 832 . 4 1 1 A 72 72 GLN CA C 72 59.500 58.638 0.862 1
1 833 . 4 1 1 A 72 72 GLN CB C 72 29.553 27.844 1.709 1
1 835 . 4 1 1 A 72 72 GLN N N 72 121.820 116.815 5.005 1
1 836 . 4 1 1 A 73 73 GLU H H 73 8.290 9.002 -0.712 1
1 837 . 4 1 1 A 73 73 GLU HA H 73 4.070 4.119 -0.049 1
1 842 . 4 1 1 A 73 73 GLU C C 73 179.370 178.783 0.587 1
1 843 . 4 1 1 A 73 73 GLU CA C 73 58.030 58.957 -0.927 1
1 844 . 4 1 1 A 73 73 GLU CB C 73 29.530 29.884 -0.354 1
1 846 . 4 1 1 A 73 73 GLU N N 73 120.550 119.528 1.022 1
1 847 . 4 1 1 A 74 74 PHE H H 74 8.630 8.249 0.381 1
1 848 . 4 1 1 A 74 74 PHE HA H 74 4.020 4.107 -0.087 1
1 851 . 4 1 1 A 74 74 PHE C C 74 177.890 177.412 0.478 1
1 852 . 4 1 1 A 74 74 PHE CA C 74 60.090 61.492 -1.402 1
1 853 . 4 1 1 A 74 74 PHE CB C 74 38.020 39.181 -1.161 1
1 854 . 4 1 1 A 74 74 PHE N N 74 121.010 121.792 -0.782 1
1 855 . 4 1 1 A 75 75 VAL H H 75 8.080 8.148 -0.068 1
1 856 . 4 1 1 A 75 75 VAL HA H 75 2.860 3.286 -0.426 1
1 864 . 4 1 1 A 75 75 VAL C C 75 177.030 177.443 -0.413 1
1 865 . 4 1 1 A 75 75 VAL CA C 75 66.430 64.666 1.764 1
1 866 . 4 1 1 A 75 75 VAL CB C 75 30.600 31.059 -0.459 1
1 869 . 4 1 1 A 75 75 VAL N N 75 119.460 118.650 0.810 1
1 870 . 4 1 1 A 76 76 VAL H H 76 7.100 8.038 -0.938 1
1 871 . 4 1 1 A 76 76 VAL HA H 76 3.330 3.639 -0.309 1
1 879 . 4 1 1 A 76 76 VAL C C 76 178.670 177.687 0.983 1
1 880 . 4 1 1 A 76 76 VAL CA C 76 67.000 65.946 1.054 1
1 881 . 4 1 1 A 76 76 VAL CB C 76 31.280 31.089 0.191 1
1 884 . 4 1 1 A 76 76 VAL N N 76 121.030 119.511 1.519 1
1 885 . 4 1 1 A 77 77 LEU H H 77 6.900 7.906 -1.006 1
1 886 . 4 1 1 A 77 77 LEU HA H 77 3.800 4.042 -0.242 1
1 896 . 4 1 1 A 77 77 LEU C C 77 177.960 178.534 -0.574 1
1 897 . 4 1 1 A 77 77 LEU CA C 77 57.710 58.162 -0.452 1
1 898 . 4 1 1 A 77 77 LEU CB C 77 40.070 41.828 -1.758 1
1 902 . 4 1 1 A 77 77 LEU N N 77 120.310 122.427 -2.117 1
1 903 . 4 1 1 A 78 78 VAL H H 78 7.240 7.479 -0.239 1
1 904 . 4 1 1 A 78 78 VAL HA H 78 3.030 3.837 -0.807 1
1 912 . 4 1 1 A 78 78 VAL C C 78 179.600 178.020 1.580 1
1 913 . 4 1 1 A 78 78 VAL CA C 78 66.420 64.776 1.644 1
1 914 . 4 1 1 A 78 78 VAL CB C 78 30.700 31.534 -0.834 1
1 917 . 4 1 1 A 78 78 VAL N N 78 117.180 116.544 0.636 1
1 918 . 4 1 1 A 79 79 ALA H H 79 9.000 8.186 0.814 1
1 919 . 4 1 1 A 79 79 ALA HA H 79 3.610 3.933 -0.323 1
1 923 . 4 1 1 A 79 79 ALA C C 79 182.260 179.920 2.340 1
1 924 . 4 1 1 A 79 79 ALA CA C 79 55.580 55.426 0.154 1
1 925 . 4 1 1 A 79 79 ALA CB C 79 18.400 18.019 0.381 1
1 926 . 4 1 1 A 79 79 ALA N N 79 126.000 125.165 0.835 1
1 927 . 4 1 1 A 80 80 ALA H H 80 8.000 7.662 0.338 1
1 928 . 4 1 1 A 80 80 ALA HA H 80 4.100 4.081 0.019 1
1 932 . 4 1 1 A 80 80 ALA C C 80 175.460 179.908 -4.448 1
1 933 . 4 1 1 A 80 80 ALA CA C 80 56.020 54.936 1.084 1
1 934 . 4 1 1 A 80 80 ALA CB C 80 18.040 18.625 -0.585 1
1 935 . 4 1 1 A 80 80 ALA N N 80 120.730 120.917 -0.187 1
1 936 . 4 1 1 A 81 81 LEU H H 81 8.460 7.678 0.782 1
1 937 . 4 1 1 A 81 81 LEU HA H 81 4.000 3.957 0.043 1
1 941 . 4 1 1 A 81 81 LEU C C 81 177.030 178.616 -1.586 1
1 942 . 4 1 1 A 81 81 LEU CA C 81 57.640 57.767 -0.127 1
1 943 . 4 1 1 A 81 81 LEU CB C 81 40.620 40.934 -0.314 1
1 945 . 4 1 1 A 81 81 LEU N N 81 119.890 117.266 2.624 1
1 946 . 4 1 1 A 82 82 THR H H 82 8.320 7.637 0.683 1
1 947 . 4 1 1 A 82 82 THR HA H 82 3.800 3.983 -0.183 1
1 952 . 4 1 1 A 82 82 THR C C 82 181.010 176.781 4.229 1
1 953 . 4 1 1 A 82 82 THR CA C 82 68.500 66.203 2.297 1
1 954 . 4 1 1 A 82 82 THR CB C 82 67.400 69.013 -1.613 1
1 956 . 4 1 1 A 82 82 THR N N 82 117.120 114.739 2.381 1
1 957 . 4 1 1 A 83 83 VAL H H 83 8.530 7.553 0.977 1
1 958 . 4 1 1 A 83 83 VAL HA H 83 3.890 3.792 0.098 1
1 966 . 4 1 1 A 83 83 VAL C C 83 178.120 178.159 -0.039 1
1 967 . 4 1 1 A 83 83 VAL CA C 83 67.400 65.086 2.314 1
1 968 . 4 1 1 A 83 83 VAL CB C 83 31.590 31.532 0.058 1
1 971 . 4 1 1 A 83 83 VAL N N 83 119.760 117.955 1.805 1
1 972 . 4 1 1 A 84 84 ALA H H 84 7.910 8.231 -0.321 1
1 973 . 4 1 1 A 84 84 ALA HA H 84 4.060 4.107 -0.047 1
1 977 . 4 1 1 A 84 84 ALA C C 84 180.560 179.690 0.870 1
1 978 . 4 1 1 A 84 84 ALA CA C 84 55.000 55.171 -0.171 1
1 979 . 4 1 1 A 84 84 ALA CB C 84 17.230 18.136 -0.906 1
1 980 . 4 1 1 A 84 84 ALA N N 84 122.620 124.632 -2.012 1
1 981 . 4 1 1 A 85 85 CYS H H 85 8.580 7.834 0.746 1
1 982 . 4 1 1 A 85 85 CYS HA H 85 4.080 4.449 -0.369 1
1 985 . 4 1 1 A 85 85 CYS C C 85 179.060 176.755 2.305 1
1 986 . 4 1 1 A 85 85 CYS CA C 85 63.210 61.516 1.694 1
1 987 . 4 1 1 A 85 85 CYS CB C 85 26.310 26.976 -0.666 1
1 988 . 4 1 1 A 85 85 CYS N N 85 118.730 117.437 1.293 1
1 989 . 4 1 1 A 86 86 ASN H H 86 8.430 7.679 0.751 1
1 990 . 4 1 1 A 86 86 ASN CA C 86 55.860 56.348 -0.488 1
1 991 . 4 1 1 A 86 86 ASN CB C 86 37.440 37.798 -0.358 1
1 992 . 4 1 1 A 86 86 ASN N N 86 119.360 118.933 0.427 1
1 993 . 4 1 1 A 87 87 ASN H H 87 7.880 7.863 0.017 1
1 994 . 4 1 1 A 87 87 ASN HA H 87 4.600 4.569 0.031 1
1 997 . 4 1 1 A 87 87 ASN C C 87 178.510 177.624 0.886 1
1 998 . 4 1 1 A 87 87 ASN CA C 87 56.470 56.413 0.057 1
1 999 . 4 1 1 A 87 87 ASN CB C 87 37.500 38.986 -1.486 1
1 1000 . 4 1 1 A 87 87 ASN N N 87 119.480 117.907 1.573 1
1 1001 . 4 1 1 A 88 88 PHE H H 88 8.050 7.863 0.187 1
1 1002 . 4 1 1 A 88 88 PHE HA H 88 4.200 4.341 -0.141 1
1 1005 . 4 1 1 A 88 88 PHE C C 88 178.510 177.259 1.251 1
1 1006 . 4 1 1 A 88 88 PHE CA C 88 56.460 59.918 -3.458 1
1 1007 . 4 1 1 A 88 88 PHE CB C 88 38.500 40.015 -1.515 1
1 1008 . 4 1 1 A 88 88 PHE N N 88 120.280 119.881 0.399 1
1 1009 . 4 1 1 A 89 89 PHE H H 89 8.020 7.976 0.044 1
1 1010 . 4 1 1 A 89 89 PHE HA H 89 4.000 4.492 -0.492 1
1 1013 . 4 1 1 A 89 89 PHE C C 89 177.340 177.393 -0.053 1
1 1014 . 4 1 1 A 89 89 PHE CA C 89 59.000 60.333 -1.333 1
1 1015 . 4 1 1 A 89 89 PHE CB C 89 37.430 39.971 -2.541 1
1 1016 . 4 1 1 A 89 89 PHE N N 89 120.910 115.304 5.606 1
1 1017 . 4 1 1 A 90 90 TRP H H 90 7.800 7.830 -0.030 1
1 1018 . 4 1 1 A 90 90 TRP HA H 90 4.460 4.414 0.046 1
1 1021 . 4 1 1 A 90 90 TRP C C 90 177.340 178.262 -0.922 1
1 1022 . 4 1 1 A 90 90 TRP CA C 90 57.930 59.464 -1.534 1
1 1023 . 4 1 1 A 90 90 TRP CB C 90 42.000 30.307 11.693 1
1 1024 . 4 1 1 A 90 90 TRP N N 90 120.050 121.776 -1.726 1
1 1025 . 4 1 1 A 91 91 GLU H H 91 7.800 8.709 -0.909 1
1 1026 . 4 1 1 A 91 91 GLU HA H 91 4.050 3.894 0.156 1
1 1031 . 4 1 1 A 91 91 GLU C C 91 177.570 178.160 -0.590 1
1 1032 . 4 1 1 A 91 91 GLU CA C 91 57.350 58.902 -1.552 1
1 1033 . 4 1 1 A 91 91 GLU CB C 91 29.530 28.912 0.618 1
1 1035 . 4 1 1 A 91 91 GLU N N 91 120.730 117.723 3.007 1
1 1036 . 4 1 1 A 92 92 ASN H H 92 7.800 7.535 0.265 1
1 1037 . 4 1 1 A 92 92 ASN HA H 92 4.630 4.647 -0.017 1
1 1040 . 4 1 1 A 92 92 ASN C C 92 174.450 174.611 -0.161 1
1 1041 . 4 1 1 A 92 92 ASN CA C 92 52.960 52.362 0.598 1
1 1042 . 4 1 1 A 92 92 ASN CB C 92 29.530 38.563 -9.033 1
1 1043 . 4 1 1 A 92 92 ASN N N 92 119.410 118.867 0.543 1
1 5 . 5 1 1 A 2 2 SER H H 2 9.000 7.490 1.510 1
1 6 . 5 1 1 A 2 2 SER HA H 2 4.690 4.563 0.127 1
1 9 . 5 1 1 A 2 2 SER C C 2 176.170 175.297 0.873 1
1 10 . 5 1 1 A 2 2 SER CA C 2 57.340 58.331 -0.991 1
1 11 . 5 1 1 A 2 2 SER CB C 2 65.550 64.379 1.171 1
1 12 . 5 1 1 A 2 2 SER N N 2 119.330 116.426 2.904 1
1 13 . 5 1 1 A 3 3 GLU H H 3 9.350 8.998 0.352 1
1 14 . 5 1 1 A 3 3 GLU HA H 3 4.060 3.979 0.081 1
1 17 . 5 1 1 A 3 3 GLU C C 3 180.150 178.823 1.327 1
1 18 . 5 1 1 A 3 3 GLU CA C 3 60.280 59.569 0.711 1
1 19 . 5 1 1 A 3 3 GLU CB C 3 29.230 29.413 -0.183 1
1 21 . 5 1 1 A 3 3 GLU N N 3 125.350 124.453 0.897 1
1 22 . 5 1 1 A 4 4 LEU H H 4 9.060 8.140 0.920 1
1 23 . 5 1 1 A 4 4 LEU HA H 4 4.080 4.106 -0.026 1
1 33 . 5 1 1 A 4 4 LEU C C 4 177.890 178.301 -0.411 1
1 34 . 5 1 1 A 4 4 LEU CA C 4 58.090 57.779 0.311 1
1 35 . 5 1 1 A 4 4 LEU CB C 4 42.120 41.704 0.416 1
1 39 . 5 1 1 A 4 4 LEU N N 4 121.090 121.399 -0.309 1
1 40 . 5 1 1 A 5 5 GLU H H 5 8.340 8.289 0.051 1
1 41 . 5 1 1 A 5 5 GLU HA H 5 4.050 3.927 0.123 1
1 46 . 5 1 1 A 5 5 GLU C C 5 177.030 178.949 -1.919 1
1 47 . 5 1 1 A 5 5 GLU CA C 5 59.840 59.605 0.235 1
1 48 . 5 1 1 A 5 5 GLU CB C 5 28.940 29.424 -0.484 1
1 50 . 5 1 1 A 5 5 GLU N N 5 119.780 118.586 1.194 1
1 51 . 5 1 1 A 6 6 THR H H 6 8.370 9.397 -1.027 1
1 52 . 5 1 1 A 6 6 THR HA H 6 4.310 3.904 0.406 1
1 57 . 5 1 1 A 6 6 THR C C 6 177.340 177.080 0.260 1
1 58 . 5 1 1 A 6 6 THR CA C 6 66.630 66.094 0.536 1
1 59 . 5 1 1 A 6 6 THR CB C 6 68.650 68.608 0.042 1
1 61 . 5 1 1 A 6 6 THR N N 6 116.940 116.181 0.759 1
1 62 . 5 1 1 A 7 7 ALA H H 7 8.270 7.770 0.500 1
1 63 . 5 1 1 A 7 7 ALA HA H 7 4.190 4.329 -0.139 1
1 67 . 5 1 1 A 7 7 ALA C C 7 179.760 179.435 0.325 1
1 68 . 5 1 1 A 7 7 ALA CA C 7 55.880 55.122 0.758 1
1 69 . 5 1 1 A 7 7 ALA CB C 7 17.720 18.112 -0.392 1
1 70 . 5 1 1 A 7 7 ALA N N 7 127.400 124.108 3.292 1
1 71 . 5 1 1 A 8 8 MET H H 8 8.110 7.982 0.128 1
1 72 . 5 1 1 A 8 8 MET HA H 8 4.020 4.212 -0.192 1
1 80 . 5 1 1 A 8 8 MET C C 8 178.510 178.180 0.330 1
1 81 . 5 1 1 A 8 8 MET CA C 8 60.580 58.215 2.365 1
1 82 . 5 1 1 A 8 8 MET CB C 8 33.630 32.266 1.364 1
1 85 . 5 1 1 A 8 8 MET N N 8 117.520 118.395 -0.875 1
1 86 . 5 1 1 A 9 9 GLU H H 9 8.210 7.722 0.488 1
1 87 . 5 1 1 A 9 9 GLU HA H 9 3.830 4.172 -0.342 1
1 92 . 5 1 1 A 9 9 GLU C C 9 179.140 179.081 0.059 1
1 93 . 5 1 1 A 9 9 GLU CA C 9 59.690 59.190 0.500 1
1 94 . 5 1 1 A 9 9 GLU CB C 9 29.530 29.292 0.238 1
1 96 . 5 1 1 A 9 9 GLU N N 9 118.560 118.181 0.379 1
1 97 . 5 1 1 A 10 10 THR H H 10 8.490 7.641 0.849 1
1 98 . 5 1 1 A 10 10 THR HA H 10 4.000 4.015 -0.015 1
1 103 . 5 1 1 A 10 10 THR C C 10 176.010 176.896 -0.886 1
1 104 . 5 1 1 A 10 10 THR CA C 10 67.110 66.106 1.004 1
1 105 . 5 1 1 A 10 10 THR CB C 10 67.770 68.410 -0.640 1
1 107 . 5 1 1 A 10 10 THR N N 10 118.310 115.533 2.777 1
1 108 . 5 1 1 A 11 11 LEU H H 11 7.920 7.944 -0.024 1
1 109 . 5 1 1 A 11 11 LEU HA H 11 3.930 4.219 -0.289 1
1 119 . 5 1 1 A 11 11 LEU C C 11 178.820 179.263 -0.443 1
1 120 . 5 1 1 A 11 11 LEU CA C 11 59.690 58.279 1.411 1
1 121 . 5 1 1 A 11 11 LEU CB C 11 41.920 41.338 0.582 1
1 125 . 5 1 1 A 11 11 LEU N N 11 121.150 121.874 -0.724 1
1 126 . 5 1 1 A 12 12 ILE H H 12 7.440 7.807 -0.367 1
1 127 . 5 1 1 A 12 12 ILE HA H 12 3.640 3.599 0.041 1
1 137 . 5 1 1 A 12 12 ILE C C 12 179.530 178.495 1.035 1
1 138 . 5 1 1 A 12 12 ILE CA C 12 63.740 65.249 -1.509 1
1 139 . 5 1 1 A 12 12 ILE CB C 12 38.800 37.623 1.177 1
1 143 . 5 1 1 A 12 12 ILE N N 12 118.010 120.887 -2.877 1
1 144 . 5 1 1 A 13 13 ASN H H 13 8.930 8.223 0.707 1
1 145 . 5 1 1 A 13 13 ASN HA H 13 4.520 4.582 -0.062 1
1 148 . 5 1 1 A 13 13 ASN C C 13 179.450 177.640 1.810 1
1 149 . 5 1 1 A 13 13 ASN CA C 13 56.470 56.326 0.144 1
1 150 . 5 1 1 A 13 13 ASN CB C 13 37.930 38.594 -0.664 1
1 151 . 5 1 1 A 13 13 ASN N N 13 121.820 119.916 1.904 1
1 152 . 5 1 1 A 14 14 VAL H H 14 9.180 8.263 0.917 1
1 153 . 5 1 1 A 14 14 VAL HA H 14 3.830 3.883 -0.053 1
1 161 . 5 1 1 A 14 14 VAL CA C 14 65.840 65.349 0.491 1
1 162 . 5 1 1 A 14 14 VAL CB C 14 31.290 31.474 -0.184 1
1 165 . 5 1 1 A 14 14 VAL N N 14 122.040 118.795 3.245 1
1 166 . 5 1 1 A 15 15 PHE H H 15 7.590 8.249 -0.659 1
1 167 . 5 1 1 A 15 15 PHE HA H 15 3.360 4.050 -0.690 1
1 170 . 5 1 1 A 15 15 PHE C C 15 177.890 177.449 0.441 1
1 171 . 5 1 1 A 15 15 PHE CA C 15 62.030 61.971 0.059 1
1 172 . 5 1 1 A 15 15 PHE CB C 15 38.900 39.220 -0.320 1
1 173 . 5 1 1 A 15 15 PHE N N 15 118.290 122.188 -3.898 1
1 174 . 5 1 1 A 16 16 HIS H H 16 7.790 7.929 -0.139 1
1 175 . 5 1 1 A 16 16 HIS HA H 16 4.890 4.243 0.647 1
1 178 . 5 1 1 A 16 16 HIS C C 16 177.810 176.926 0.884 1
1 179 . 5 1 1 A 16 16 HIS CA C 16 59.100 60.106 -1.006 1
1 180 . 5 1 1 A 16 16 HIS CB C 16 28.060 29.213 -1.153 1
1 181 . 5 1 1 A 16 16 HIS N N 16 118.290 118.374 -0.084 1
1 182 . 5 1 1 A 17 17 ALA H H 17 8.040 7.987 0.053 1
1 183 . 5 1 1 A 17 17 ALA HA H 17 4.050 3.807 0.243 1
1 187 . 5 1 1 A 17 17 ALA C C 17 179.600 179.681 -0.081 1
1 188 . 5 1 1 A 17 17 ALA CA C 17 54.000 55.161 -1.161 1
1 189 . 5 1 1 A 17 17 ALA CB C 17 17.520 18.551 -1.031 1
1 190 . 5 1 1 A 17 17 ALA N N 17 124.410 120.856 3.554 1
1 191 . 5 1 1 A 18 18 HIS H H 18 7.000 7.443 -0.443 1
1 192 . 5 1 1 A 18 18 HIS HA H 18 4.330 4.265 0.065 1
1 195 . 5 1 1 A 18 18 HIS C C 18 176.320 177.791 -1.471 1
1 196 . 5 1 1 A 18 18 HIS CA C 18 57.350 59.370 -2.020 1
1 197 . 5 1 1 A 18 18 HIS CB C 18 32.920 30.206 2.714 1
1 198 . 5 1 1 A 18 18 HIS N N 18 115.160 115.900 -0.740 1
1 199 . 5 1 1 A 19 19 SER H H 19 8.380 7.977 0.403 1
1 200 . 5 1 1 A 19 19 SER HA H 19 3.640 3.957 -0.317 1
1 203 . 5 1 1 A 19 19 SER C C 19 177.340 175.535 1.805 1
1 204 . 5 1 1 A 19 19 SER CA C 19 60.160 60.837 -0.677 1
1 205 . 5 1 1 A 19 19 SER CB C 19 61.000 62.433 -1.433 1
1 206 . 5 1 1 A 19 19 SER N N 19 114.380 114.984 -0.604 1
1 207 . 5 1 1 A 20 20 GLY H H 20 7.600 7.403 0.197 1
1 208 . 5 1 1 A 20 20 GLY HA2 H 20 3.680 3.822 -0.142 1
1 209 . 5 1 1 A 20 20 GLY HA3 H 20 4.000 3.904 0.096 1
1 210 . 5 1 1 A 20 20 GLY C C 20 174.140 174.157 -0.017 1
1 211 . 5 1 1 A 20 20 GLY CA C 20 47.000 45.152 1.848 1
1 212 . 5 1 1 A 20 20 GLY N N 20 112.550 106.988 5.562 1
1 213 . 5 1 1 A 21 21 LYS H H 21 7.230 7.561 -0.331 1
1 214 . 5 1 1 A 21 21 LYS HA H 21 3.860 4.397 -0.537 1
1 223 . 5 1 1 A 21 21 LYS C C 21 177.730 177.772 -0.042 1
1 224 . 5 1 1 A 21 21 LYS CA C 21 59.110 56.924 2.186 1
1 225 . 5 1 1 A 21 21 LYS CB C 21 32.460 34.160 -1.700 1
1 229 . 5 1 1 A 21 21 LYS N N 21 123.240 118.065 5.175 1
1 230 . 5 1 1 A 22 22 GLU H H 22 9.350 8.316 1.034 1
1 231 . 5 1 1 A 22 22 GLU HA H 22 4.610 4.109 0.501 1
1 236 . 5 1 1 A 22 22 GLU C C 22 177.420 176.072 1.348 1
1 237 . 5 1 1 A 22 22 GLU CA C 22 53.700 55.956 -2.256 1
1 238 . 5 1 1 A 22 22 GLU CB C 22 32.000 28.264 3.736 1
1 240 . 5 1 1 A 22 22 GLU N N 22 116.770 117.015 -0.245 1
1 241 . 5 1 1 A 23 23 GLY H H 23 7.570 7.557 0.013 1
1 242 . 5 1 1 A 23 23 GLY HA2 H 23 3.630 3.997 -0.367 1
1 243 . 5 1 1 A 23 23 GLY HA3 H 23 3.880 4.009 -0.129 1
1 244 . 5 1 1 A 23 23 GLY C C 23 173.980 171.533 2.447 1
1 245 . 5 1 1 A 23 23 GLY CA C 23 45.250 45.646 -0.396 1
1 246 . 5 1 1 A 23 23 GLY N N 23 112.180 108.768 3.412 1
1 247 . 5 1 1 A 24 24 ASP H H 24 8.680 8.493 0.187 1
1 248 . 5 1 1 A 24 24 ASP HA H 24 4.380 4.442 -0.062 1
1 251 . 5 1 1 A 24 24 ASP C C 24 178.590 177.478 1.112 1
1 252 . 5 1 1 A 24 24 ASP CA C 24 60.000 54.629 5.371 1
1 253 . 5 1 1 A 24 24 ASP CB C 24 27.480 41.233 -13.753 1
1 254 . 5 1 1 A 24 24 ASP N N 24 127.470 121.669 5.801 1
1 255 . 5 1 1 A 25 25 LYS H H 25 9.270 8.592 0.678 1
1 256 . 5 1 1 A 25 25 LYS HA H 25 4.250 3.878 0.372 1
1 265 . 5 1 1 A 25 25 LYS C C 25 177.030 177.130 -0.100 1
1 266 . 5 1 1 A 25 25 LYS CA C 25 60.000 59.775 0.225 1
1 267 . 5 1 1 A 25 25 LYS CB C 25 31.170 32.427 -1.257 1
1 271 . 5 1 1 A 25 25 LYS N N 25 132.960 122.561 10.399 1
1 272 . 5 1 1 A 26 26 TYR H H 26 9.430 7.031 2.399 1
1 273 . 5 1 1 A 26 26 TYR HA H 26 4.640 4.850 -0.210 1
1 276 . 5 1 1 A 26 26 TYR C C 26 174.290 174.432 -0.142 1
1 277 . 5 1 1 A 26 26 TYR CA C 26 56.010 57.144 -1.134 1
1 278 . 5 1 1 A 26 26 TYR CB C 26 37.730 39.167 -1.437 1
1 279 . 5 1 1 A 26 26 TYR N N 26 120.650 111.925 8.725 1
1 280 . 5 1 1 A 27 27 LYS H H 27 7.110 7.128 -0.018 1
1 281 . 5 1 1 A 27 27 LYS HA H 27 5.110 5.236 -0.126 1
1 290 . 5 1 1 A 27 27 LYS C C 27 175.150 173.953 1.197 1
1 291 . 5 1 1 A 27 27 LYS CA C 27 55.070 54.874 0.196 1
1 292 . 5 1 1 A 27 27 LYS CB C 27 38.900 36.181 2.719 1
1 296 . 5 1 1 A 27 27 LYS N N 27 115.830 121.804 -5.974 1
1 297 . 5 1 1 A 28 28 LEU H H 28 9.820 8.924 0.896 1
1 298 . 5 1 1 A 28 28 LEU HA H 28 5.080 4.877 0.203 1
1 308 . 5 1 1 A 28 28 LEU C C 28 176.640 175.521 1.119 1
1 309 . 5 1 1 A 28 28 LEU CA C 28 52.660 53.621 -0.961 1
1 310 . 5 1 1 A 28 28 LEU CB C 28 42.710 43.949 -1.239 1
1 314 . 5 1 1 A 28 28 LEU N N 28 126.930 128.529 -1.599 1
1 315 . 5 1 1 A 29 29 SER H H 29 9.890 9.471 0.419 1
1 316 . 5 1 1 A 29 29 SER HA H 29 4.530 4.531 -0.001 1
1 319 . 5 1 1 A 29 29 SER C C 29 174.990 175.725 -0.735 1
1 320 . 5 1 1 A 29 29 SER CA C 29 56.180 57.551 -1.371 1
1 321 . 5 1 1 A 29 29 SER CB C 29 65.550 64.323 1.227 1
1 322 . 5 1 1 A 29 29 SER N N 29 121.600 123.763 -2.163 1
1 323 . 5 1 1 A 30 30 LYS H H 30 8.850 8.988 -0.138 1
1 324 . 5 1 1 A 30 30 LYS HA H 30 3.850 4.007 -0.157 1
1 333 . 5 1 1 A 30 30 LYS C C 30 175.620 178.489 -2.869 1
1 334 . 5 1 1 A 30 30 LYS CA C 30 60.860 59.871 0.989 1
1 335 . 5 1 1 A 30 30 LYS CB C 30 31.290 32.184 -0.894 1
1 339 . 5 1 1 A 30 30 LYS N N 30 121.260 124.616 -3.356 1
1 340 . 5 1 1 A 31 31 LYS H H 31 7.970 8.023 -0.053 1
1 341 . 5 1 1 A 31 31 LYS HA H 31 3.880 4.083 -0.203 1
1 350 . 5 1 1 A 31 31 LYS C C 31 179.290 178.698 0.592 1
1 351 . 5 1 1 A 31 31 LYS CA C 31 59.110 59.032 0.078 1
1 352 . 5 1 1 A 31 31 LYS CB C 31 32.640 32.101 0.539 1
1 356 . 5 1 1 A 31 31 LYS N N 31 121.260 118.194 3.066 1
1 357 . 5 1 1 A 32 32 GLU H H 32 7.510 8.264 -0.754 1
1 358 . 5 1 1 A 32 32 GLU HA H 32 3.830 4.288 -0.458 1
1 363 . 5 1 1 A 32 32 GLU C C 32 179.290 179.479 -0.189 1
1 364 . 5 1 1 A 32 32 GLU CA C 32 58.590 58.869 -0.279 1
1 365 . 5 1 1 A 32 32 GLU CB C 32 30.120 29.942 0.178 1
1 367 . 5 1 1 A 32 32 GLU N N 32 120.090 119.485 0.605 1
1 368 . 5 1 1 A 33 33 LEU H H 33 8.970 7.842 1.128 1
1 369 . 5 1 1 A 33 33 LEU HA H 33 3.830 3.859 -0.029 1
1 379 . 5 1 1 A 33 33 LEU C C 33 178.200 178.767 -0.567 1
1 380 . 5 1 1 A 33 33 LEU CA C 33 57.930 58.111 -0.181 1
1 381 . 5 1 1 A 33 33 LEU CB C 33 40.660 41.504 -0.844 1
1 385 . 5 1 1 A 33 33 LEU N N 33 120.200 119.207 0.993 1
1 386 . 5 1 1 A 34 34 LYS H H 34 8.230 7.715 0.515 1
1 387 . 5 1 1 A 34 34 LYS HA H 34 3.550 3.913 -0.363 1
1 396 . 5 1 1 A 34 34 LYS C C 34 178.040 177.725 0.315 1
1 397 . 5 1 1 A 34 34 LYS CA C 34 60.720 59.236 1.484 1
1 398 . 5 1 1 A 34 34 LYS CB C 34 31.980 31.910 0.070 1
1 402 . 5 1 1 A 34 34 LYS N N 34 120.780 119.130 1.650 1
1 403 . 5 1 1 A 35 35 ASP H H 35 7.990 7.728 0.262 1
1 404 . 5 1 1 A 35 35 ASP HA H 35 4.250 4.386 -0.136 1
1 407 . 5 1 1 A 35 35 ASP C C 35 179.060 178.158 0.902 1
1 408 . 5 1 1 A 35 35 ASP CA C 35 56.830 57.161 -0.331 1
1 409 . 5 1 1 A 35 35 ASP CB C 35 40.440 40.976 -0.536 1
1 410 . 5 1 1 A 35 35 ASP N N 35 119.550 119.411 0.139 1
1 411 . 5 1 1 A 36 36 LEU H H 36 8.130 7.593 0.537 1
1 412 . 5 1 1 A 36 36 LEU HA H 36 2.580 3.253 -0.673 1
1 422 . 5 1 1 A 36 36 LEU C C 36 179.450 178.167 1.283 1
1 423 . 5 1 1 A 36 36 LEU CA C 36 59.980 58.056 1.924 1
1 424 . 5 1 1 A 36 36 LEU CB C 36 42.180 41.426 0.754 1
1 428 . 5 1 1 A 36 36 LEU N N 36 125.560 120.494 5.066 1
1 429 . 5 1 1 A 37 37 LEU H H 37 8.740 7.985 0.755 1
1 430 . 5 1 1 A 37 37 LEU HA H 37 3.580 3.939 -0.359 1
1 440 . 5 1 1 A 37 37 LEU C C 37 179.290 179.239 0.051 1
1 441 . 5 1 1 A 37 37 LEU CA C 37 58.230 58.087 0.143 1
1 442 . 5 1 1 A 37 37 LEU CB C 37 41.590 40.788 0.802 1
1 446 . 5 1 1 A 37 37 LEU N N 37 120.520 118.385 2.135 1
1 447 . 5 1 1 A 38 38 GLN H H 38 8.520 8.062 0.458 1
1 448 . 5 1 1 A 38 38 GLN HA H 38 4.000 3.936 0.064 1
1 453 . 5 1 1 A 38 38 GLN C C 38 177.960 178.547 -0.587 1
1 454 . 5 1 1 A 38 38 GLN CA C 38 58.210 59.012 -0.802 1
1 455 . 5 1 1 A 38 38 GLN CB C 38 28.650 28.014 0.636 1
1 457 . 5 1 1 A 38 38 GLN N N 38 116.740 118.869 -2.129 1
1 458 . 5 1 1 A 39 39 THR H H 39 7.910 8.022 -0.112 1
1 459 . 5 1 1 A 39 39 THR HA H 39 4.210 3.804 0.406 1
1 464 . 5 1 1 A 39 39 THR C C 39 177.180 175.880 1.300 1
1 465 . 5 1 1 A 39 39 THR CA C 39 64.730 67.218 -2.488 1
1 466 . 5 1 1 A 39 39 THR CB C 39 69.650 68.757 0.893 1
1 468 . 5 1 1 A 39 39 THR N N 39 111.400 117.487 -6.087 1
1 469 . 5 1 1 A 40 40 GLU H H 40 8.590 7.920 0.670 1
1 470 . 5 1 1 A 40 40 GLU HA H 40 4.680 4.360 0.320 1
1 475 . 5 1 1 A 40 40 GLU C C 40 178.280 177.312 0.968 1
1 476 . 5 1 1 A 40 40 GLU CA C 40 55.880 57.053 -1.173 1
1 477 . 5 1 1 A 40 40 GLU CB C 40 30.990 30.414 0.576 1
1 479 . 5 1 1 A 40 40 GLU N N 40 117.840 116.272 1.568 1
1 480 . 5 1 1 A 41 41 LEU H H 41 7.680 7.478 0.202 1
1 481 . 5 1 1 A 41 41 LEU HA H 41 5.080 4.934 0.146 1
1 491 . 5 1 1 A 41 41 LEU C C 41 179.450 177.239 2.211 1
1 492 . 5 1 1 A 41 41 LEU CA C 41 53.830 54.165 -0.335 1
1 493 . 5 1 1 A 41 41 LEU CB C 41 41.360 43.030 -1.670 1
1 497 . 5 1 1 A 41 41 LEU N N 41 121.410 119.346 2.064 1
1 498 . 5 1 1 A 42 42 SER H H 42 8.380 7.757 0.623 1
1 499 . 5 1 1 A 42 42 SER HA H 42 4.130 4.037 0.093 1
1 502 . 5 1 1 A 42 42 SER C C 42 176.640 177.252 -0.612 1
1 503 . 5 1 1 A 42 42 SER CA C 42 61.280 62.172 -0.892 1
1 504 . 5 1 1 A 42 42 SER CB C 42 63.040 62.667 0.373 1
1 505 . 5 1 1 A 42 42 SER N N 42 117.420 116.834 0.586 1
1 506 . 5 1 1 A 43 43 SER H H 43 8.900 8.634 0.266 1
1 507 . 5 1 1 A 43 43 SER HA H 43 4.290 4.319 -0.029 1
1 510 . 5 1 1 A 43 43 SER C C 43 175.620 176.693 -1.073 1
1 511 . 5 1 1 A 43 43 SER CA C 43 60.860 60.689 0.171 1
1 512 . 5 1 1 A 43 43 SER CB C 43 62.910 62.859 0.051 1
1 513 . 5 1 1 A 43 43 SER N N 43 117.580 116.168 1.412 1
1 514 . 5 1 1 A 44 44 PHE H H 44 7.880 8.157 -0.277 1
1 515 . 5 1 1 A 44 44 PHE HA H 44 4.240 4.149 0.091 1
1 518 . 5 1 1 A 44 44 PHE C C 44 176.950 175.803 1.147 1
1 519 . 5 1 1 A 44 44 PHE CA C 44 62.710 61.331 1.379 1
1 520 . 5 1 1 A 44 44 PHE CB C 44 39.020 39.031 -0.011 1
1 521 . 5 1 1 A 44 44 PHE N N 44 119.480 122.804 -3.324 1
1 522 . 5 1 1 A 45 45 LEU H H 45 8.060 7.705 0.355 1
1 523 . 5 1 1 A 45 45 LEU HA H 45 3.810 3.570 0.240 1
1 533 . 5 1 1 A 45 45 LEU C C 45 177.500 176.404 1.096 1
1 534 . 5 1 1 A 45 45 LEU CA C 45 59.980 55.317 4.663 1
1 535 . 5 1 1 A 45 45 LEU CB C 45 39.640 42.094 -2.454 1
1 538 . 5 1 1 A 45 45 LEU N N 45 118.010 121.154 -3.144 1
1 539 . 5 1 1 A 46 46 ASP H H 46 8.150 8.533 -0.383 1
1 540 . 5 1 1 A 46 46 ASP HA H 46 4.470 4.662 -0.192 1
1 543 . 5 1 1 A 46 46 ASP C C 46 179.920 176.109 3.811 1
1 544 . 5 1 1 A 46 46 ASP CA C 46 52.950 52.989 -0.039 1
1 545 . 5 1 1 A 46 46 ASP CB C 46 40.000 40.651 -0.651 1
1 546 . 5 1 1 A 46 46 ASP N N 46 119.460 124.949 -5.489 1
1 547 . 5 1 1 A 47 47 VAL H H 47 8.010 8.376 -0.366 1
1 548 . 5 1 1 A 47 47 VAL HA H 47 3.800 4.332 -0.532 1
1 556 . 5 1 1 A 47 47 VAL C C 47 175.460 177.110 -1.650 1
1 557 . 5 1 1 A 47 47 VAL CA C 47 60.000 62.633 -2.633 1
1 558 . 5 1 1 A 47 47 VAL CB C 47 31.580 33.502 -1.922 1
1 561 . 5 1 1 A 47 47 VAL N N 47 117.720 119.966 -2.246 1
1 562 . 5 1 1 A 48 48 GLN H H 48 7.960 8.353 -0.393 1
1 563 . 5 1 1 A 48 48 GLN HA H 48 4.060 4.172 -0.112 1
1 568 . 5 1 1 A 48 48 GLN C C 48 179.370 178.441 0.929 1
1 569 . 5 1 1 A 48 48 GLN CA C 48 57.350 58.467 -1.117 1
1 570 . 5 1 1 A 48 48 GLN CB C 48 28.990 28.831 0.159 1
1 572 . 5 1 1 A 48 48 GLN N N 48 119.900 121.899 -1.999 1
1 573 . 5 1 1 A 49 49 LYS H H 49 7.810 7.976 -0.166 1
1 574 . 5 1 1 A 49 49 LYS HA H 49 3.860 4.037 -0.177 1
1 583 . 5 1 1 A 49 49 LYS C C 49 177.890 177.192 0.698 1
1 584 . 5 1 1 A 49 49 LYS CA C 49 58.230 59.261 -1.031 1
1 585 . 5 1 1 A 49 49 LYS CB C 49 30.990 32.149 -1.159 1
1 587 . 5 1 1 A 49 49 LYS N N 49 120.030 120.176 -0.146 1
1 588 . 5 1 1 A 50 50 ASP H H 50 7.570 7.733 -0.163 1
1 589 . 5 1 1 A 50 50 ASP HA H 50 4.700 4.928 -0.228 1
1 590 . 5 1 1 A 50 50 ASP CA C 50 52.950 52.692 0.258 1
1 591 . 5 1 1 A 50 50 ASP CB C 50 38.900 39.245 -0.345 1
1 592 . 5 1 1 A 50 50 ASP N N 50 116.730 119.147 -2.417 1
1 593 . 5 1 1 A 51 51 ALA H H 51 7.570 8.505 -0.935 1
1 594 . 5 1 1 A 51 51 ALA HA H 51 4.200 4.076 0.124 1
1 598 . 5 1 1 A 51 51 ALA C C 51 179.760 179.346 0.414 1
1 599 . 5 1 1 A 51 51 ALA CA C 51 54.200 55.169 -0.969 1
1 600 . 5 1 1 A 51 51 ALA CB C 51 18.110 18.504 -0.394 1
1 601 . 5 1 1 A 51 51 ALA N N 51 118.390 127.655 -9.265 1
1 602 . 5 1 1 A 52 52 ASP H H 52 8.430 8.184 0.246 1
1 603 . 5 1 1 A 52 52 ASP HA H 52 4.600 4.395 0.205 1
1 606 . 5 1 1 A 52 52 ASP C C 52 177.570 178.353 -0.783 1
1 607 . 5 1 1 A 52 52 ASP CA C 52 54.420 56.709 -2.289 1
1 608 . 5 1 1 A 52 52 ASP CB C 52 40.360 40.076 0.284 1
1 609 . 5 1 1 A 52 52 ASP N N 52 117.530 118.713 -1.183 1
1 610 . 5 1 1 A 53 53 ALA H H 53 7.660 8.423 -0.763 1
1 611 . 5 1 1 A 53 53 ALA HA H 53 3.860 4.002 -0.142 1
1 615 . 5 1 1 A 53 53 ALA C C 53 180.070 180.691 -0.621 1
1 616 . 5 1 1 A 53 53 ALA CA C 53 55.590 55.426 0.164 1
1 617 . 5 1 1 A 53 53 ALA CB C 53 18.800 18.077 0.723 1
1 618 . 5 1 1 A 53 53 ALA N N 53 123.450 122.674 0.776 1
1 619 . 5 1 1 A 54 54 VAL H H 54 8.030 7.794 0.236 1
1 620 . 5 1 1 A 54 54 VAL HA H 54 3.240 3.608 -0.368 1
1 628 . 5 1 1 A 54 54 VAL C C 54 177.340 177.824 -0.484 1
1 629 . 5 1 1 A 54 54 VAL CA C 54 66.620 66.121 0.499 1
1 630 . 5 1 1 A 54 54 VAL CB C 54 30.480 31.018 -0.538 1
1 633 . 5 1 1 A 54 54 VAL N N 54 116.150 117.879 -1.729 1
1 634 . 5 1 1 A 55 55 ASP H H 55 7.660 7.644 0.016 1
1 635 . 5 1 1 A 55 55 ASP HA H 55 4.080 4.382 -0.302 1
1 638 . 5 1 1 A 55 55 ASP C C 55 177.260 179.436 -2.176 1
1 639 . 5 1 1 A 55 55 ASP CA C 55 57.640 57.322 0.318 1
1 640 . 5 1 1 A 55 55 ASP CB C 55 40.360 40.228 0.132 1
1 641 . 5 1 1 A 55 55 ASP N N 55 120.830 121.484 -0.654 1
1 642 . 5 1 1 A 56 56 LYS H H 56 7.780 7.605 0.175 1
1 643 . 5 1 1 A 56 56 LYS HA H 56 3.860 4.017 -0.157 1
1 652 . 5 1 1 A 56 56 LYS C C 56 179.530 179.574 -0.044 1
1 653 . 5 1 1 A 56 56 LYS CA C 56 59.690 59.650 0.040 1
1 654 . 5 1 1 A 56 56 LYS CB C 56 31.870 32.511 -0.641 1
1 658 . 5 1 1 A 56 56 LYS N N 56 120.010 119.941 0.069 1
1 659 . 5 1 1 A 57 57 ILE H H 57 8.090 7.907 0.183 1
1 660 . 5 1 1 A 57 57 ILE HA H 57 3.390 3.596 -0.206 1
1 670 . 5 1 1 A 57 57 ILE C C 57 176.710 177.626 -0.916 1
1 671 . 5 1 1 A 57 57 ILE CA C 57 64.960 65.259 -0.299 1
1 672 . 5 1 1 A 57 57 ILE CB C 57 38.080 38.456 -0.376 1
1 676 . 5 1 1 A 57 57 ILE N N 57 120.960 120.394 0.566 1
1 677 . 5 1 1 A 58 58 MET H H 58 8.480 8.355 0.125 1
1 678 . 5 1 1 A 58 58 MET HA H 58 3.800 4.095 -0.295 1
1 686 . 5 1 1 A 58 58 MET C C 58 177.570 178.167 -0.597 1
1 687 . 5 1 1 A 58 58 MET CA C 58 58.570 58.465 0.105 1
1 688 . 5 1 1 A 58 58 MET CB C 58 32.570 31.838 0.732 1
1 691 . 5 1 1 A 58 58 MET N N 58 119.160 120.586 -1.426 1
1 692 . 5 1 1 A 59 59 LYS H H 59 7.550 7.961 -0.411 1
1 693 . 5 1 1 A 59 59 LYS HA H 59 3.930 3.945 -0.015 1
1 702 . 5 1 1 A 59 59 LYS C C 59 179.530 179.215 0.315 1
1 703 . 5 1 1 A 59 59 LYS CA C 59 58.820 59.709 -0.889 1
1 704 . 5 1 1 A 59 59 LYS CB C 59 32.450 32.445 0.005 1
1 708 . 5 1 1 A 59 59 LYS N N 59 116.730 119.828 -3.098 1
1 709 . 5 1 1 A 60 60 GLU H H 60 7.470 7.990 -0.520 1
1 710 . 5 1 1 A 60 60 GLU HA H 60 4.050 4.091 -0.041 1
1 715 . 5 1 1 A 60 60 GLU C C 60 178.950 177.902 1.048 1
1 716 . 5 1 1 A 60 60 GLU CA C 60 58.600 58.991 -0.391 1
1 717 . 5 1 1 A 60 60 GLU CB C 60 31.700 29.421 2.279 1
1 719 . 5 1 1 A 60 60 GLU N N 60 116.820 119.394 -2.574 1
1 720 . 5 1 1 A 61 61 LEU H H 61 8.030 7.648 0.382 1
1 721 . 5 1 1 A 61 61 LEU HA H 61 4.310 4.331 -0.021 1
1 731 . 5 1 1 A 61 61 LEU C C 61 179.450 177.150 2.300 1
1 732 . 5 1 1 A 61 61 LEU CA C 61 54.840 55.430 -0.590 1
1 733 . 5 1 1 A 61 61 LEU CB C 61 43.820 42.465 1.355 1
1 737 . 5 1 1 A 61 61 LEU N N 61 116.000 117.882 -1.882 1
1 738 . 5 1 1 A 62 62 ASP H H 62 7.890 8.619 -0.729 1
1 739 . 5 1 1 A 62 62 ASP HA H 62 4.660 4.860 -0.200 1
1 742 . 5 1 1 A 62 62 ASP C C 62 177.030 176.160 0.870 1
1 743 . 5 1 1 A 62 62 ASP CA C 62 53.660 53.833 -0.173 1
1 744 . 5 1 1 A 62 62 ASP CB C 62 38.700 39.701 -1.001 1
1 745 . 5 1 1 A 62 62 ASP N N 62 117.550 118.992 -1.442 1
1 746 . 5 1 1 A 63 63 GLU H H 63 8.430 9.039 -0.609 1
1 747 . 5 1 1 A 63 63 GLU HA H 63 4.020 4.046 -0.026 1
1 752 . 5 1 1 A 63 63 GLU C C 63 178.120 178.797 -0.677 1
1 753 . 5 1 1 A 63 63 GLU CA C 63 58.470 59.313 -0.843 1
1 754 . 5 1 1 A 63 63 GLU CB C 63 30.120 29.390 0.730 1
1 756 . 5 1 1 A 63 63 GLU N N 63 130.230 120.543 9.687 1
1 757 . 5 1 1 A 64 64 ASN H H 64 8.010 7.718 0.292 1
1 758 . 5 1 1 A 64 64 ASN HA H 64 4.680 4.807 -0.127 1
1 761 . 5 1 1 A 64 64 ASN C C 64 177.100 175.626 1.474 1
1 762 . 5 1 1 A 64 64 ASN CA C 64 51.780 53.296 -1.516 1
1 763 . 5 1 1 A 64 64 ASN CB C 64 37.260 39.117 -1.857 1
1 764 . 5 1 1 A 64 64 ASN N N 64 113.640 115.128 -1.488 1
1 765 . 5 1 1 A 65 65 GLY H H 65 7.550 7.916 -0.366 1
1 766 . 5 1 1 A 65 65 GLY HA2 H 65 3.770 3.975 -0.205 1
1 767 . 5 1 1 A 65 65 GLY HA3 H 65 3.770 3.976 -0.206 1
1 768 . 5 1 1 A 65 65 GLY C C 65 178.980 175.001 3.979 1
1 769 . 5 1 1 A 65 65 GLY CA C 65 47.200 46.505 0.695 1
1 770 . 5 1 1 A 65 65 GLY N N 65 113.640 107.345 6.295 1
1 771 . 5 1 1 A 66 66 ASP H H 66 8.110 8.191 -0.081 1
1 772 . 5 1 1 A 66 66 ASP HA H 66 4.490 4.584 -0.094 1
1 775 . 5 1 1 A 66 66 ASP C C 66 177.960 177.548 0.412 1
1 776 . 5 1 1 A 66 66 ASP CA C 66 52.960 53.577 -0.617 1
1 777 . 5 1 1 A 66 66 ASP CB C 66 40.540 40.505 0.035 1
1 778 . 5 1 1 A 66 66 ASP N N 66 120.030 120.295 -0.265 1
1 779 . 5 1 1 A 67 67 GLY H H 67 10.260 9.545 0.715 1
1 780 . 5 1 1 A 67 67 GLY HA2 H 67 3.360 3.857 -0.497 1
1 781 . 5 1 1 A 67 67 GLY HA3 H 67 4.000 3.859 0.141 1
1 782 . 5 1 1 A 67 67 GLY C C 67 173.120 173.424 -0.304 1
1 783 . 5 1 1 A 67 67 GLY CA C 67 45.460 45.768 -0.308 1
1 784 . 5 1 1 A 67 67 GLY N N 67 114.100 111.108 2.992 1
1 785 . 5 1 1 A 68 68 GLU H H 68 7.750 7.834 -0.084 1
1 786 . 5 1 1 A 68 68 GLU HA H 68 4.780 5.107 -0.327 1
1 791 . 5 1 1 A 68 68 GLU C C 68 175.930 174.846 1.084 1
1 792 . 5 1 1 A 68 68 GLU CA C 68 54.430 54.428 0.002 1
1 793 . 5 1 1 A 68 68 GLU CB C 68 35.850 33.688 2.162 1
1 795 . 5 1 1 A 68 68 GLU N N 68 118.000 119.203 -1.203 1
1 796 . 5 1 1 A 69 69 VAL H H 69 9.380 8.670 0.710 1
1 797 . 5 1 1 A 69 69 VAL HA H 69 5.260 5.174 0.086 1
1 805 . 5 1 1 A 69 69 VAL C C 69 176.710 173.554 3.156 1
1 806 . 5 1 1 A 69 69 VAL CA C 69 61.280 60.907 0.373 1
1 807 . 5 1 1 A 69 69 VAL CB C 69 33.980 34.754 -0.774 1
1 810 . 5 1 1 A 69 69 VAL N N 69 125.970 120.902 5.068 1
1 811 . 5 1 1 A 70 70 ASP H H 70 9.100 8.882 0.218 1
1 812 . 5 1 1 A 70 70 ASP HA H 70 5.190 5.266 -0.076 1
1 815 . 5 1 1 A 70 70 ASP C C 70 175.700 176.933 -1.233 1
1 816 . 5 1 1 A 70 70 ASP CA C 70 52.370 53.507 -1.137 1
1 817 . 5 1 1 A 70 70 ASP CB C 70 40.950 42.761 -1.811 1
1 818 . 5 1 1 A 70 70 ASP N N 70 130.320 127.613 2.707 1
1 819 . 5 1 1 A 71 71 PHE H H 71 9.090 9.281 -0.191 1
1 820 . 5 1 1 A 71 71 PHE HA H 71 4.100 3.923 0.177 1
1 823 . 5 1 1 A 71 71 PHE C C 71 177.000 177.163 -0.163 1
1 824 . 5 1 1 A 71 71 PHE CA C 71 58.230 61.576 -3.346 1
1 825 . 5 1 1 A 71 71 PHE CB C 71 36.910 39.130 -2.220 1
1 826 . 5 1 1 A 71 71 PHE N N 71 119.760 127.334 -7.574 1
1 827 . 5 1 1 A 72 72 GLN H H 72 8.440 8.134 0.306 1
1 828 . 5 1 1 A 72 72 GLN HA H 72 3.600 3.987 -0.387 1
1 831 . 5 1 1 A 72 72 GLN C C 72 178.820 177.941 0.879 1
1 832 . 5 1 1 A 72 72 GLN CA C 72 59.500 58.682 0.818 1
1 833 . 5 1 1 A 72 72 GLN CB C 72 29.553 28.085 1.468 1
1 835 . 5 1 1 A 72 72 GLN N N 72 121.820 118.168 3.652 1
1 836 . 5 1 1 A 73 73 GLU H H 73 8.290 8.724 -0.434 1
1 837 . 5 1 1 A 73 73 GLU HA H 73 4.070 4.109 -0.039 1
1 842 . 5 1 1 A 73 73 GLU C C 73 179.370 178.843 0.527 1
1 843 . 5 1 1 A 73 73 GLU CA C 73 58.030 58.861 -0.831 1
1 844 . 5 1 1 A 73 73 GLU CB C 73 29.530 29.968 -0.438 1
1 846 . 5 1 1 A 73 73 GLU N N 73 120.550 120.199 0.351 1
1 847 . 5 1 1 A 74 74 PHE H H 74 8.630 8.177 0.453 1
1 848 . 5 1 1 A 74 74 PHE HA H 74 4.020 4.096 -0.076 1
1 851 . 5 1 1 A 74 74 PHE C C 74 177.890 176.837 1.053 1
1 852 . 5 1 1 A 74 74 PHE CA C 74 60.090 61.295 -1.205 1
1 853 . 5 1 1 A 74 74 PHE CB C 74 38.020 39.168 -1.148 1
1 854 . 5 1 1 A 74 74 PHE N N 74 121.010 121.778 -0.768 1
1 855 . 5 1 1 A 75 75 VAL H H 75 8.080 7.880 0.200 1
1 856 . 5 1 1 A 75 75 VAL HA H 75 2.860 2.803 0.057 1
1 864 . 5 1 1 A 75 75 VAL C C 75 177.030 177.894 -0.864 1
1 865 . 5 1 1 A 75 75 VAL CA C 75 66.430 65.965 0.465 1
1 866 . 5 1 1 A 75 75 VAL CB C 75 30.600 30.852 -0.252 1
1 869 . 5 1 1 A 75 75 VAL N N 75 119.460 118.432 1.028 1
1 870 . 5 1 1 A 76 76 VAL H H 76 7.100 7.979 -0.879 1
1 871 . 5 1 1 A 76 76 VAL HA H 76 3.330 3.426 -0.096 1
1 879 . 5 1 1 A 76 76 VAL C C 76 178.670 177.885 0.785 1
1 880 . 5 1 1 A 76 76 VAL CA C 76 67.000 66.644 0.356 1
1 881 . 5 1 1 A 76 76 VAL CB C 76 31.280 31.385 -0.105 1
1 884 . 5 1 1 A 76 76 VAL N N 76 121.030 120.075 0.955 1
1 885 . 5 1 1 A 77 77 LEU H H 77 6.900 7.883 -0.983 1
1 886 . 5 1 1 A 77 77 LEU HA H 77 3.800 3.943 -0.143 1
1 896 . 5 1 1 A 77 77 LEU C C 77 177.960 178.624 -0.664 1
1 897 . 5 1 1 A 77 77 LEU CA C 77 57.710 58.285 -0.575 1
1 898 . 5 1 1 A 77 77 LEU CB C 77 40.070 41.961 -1.891 1
1 902 . 5 1 1 A 77 77 LEU N N 77 120.310 120.787 -0.477 1
1 903 . 5 1 1 A 78 78 VAL H H 78 7.240 7.577 -0.337 1
1 904 . 5 1 1 A 78 78 VAL HA H 78 3.030 3.590 -0.560 1
1 912 . 5 1 1 A 78 78 VAL C C 78 179.600 178.308 1.292 1
1 913 . 5 1 1 A 78 78 VAL CA C 78 66.420 66.606 -0.186 1
1 914 . 5 1 1 A 78 78 VAL CB C 78 30.700 31.295 -0.595 1
1 917 . 5 1 1 A 78 78 VAL N N 78 117.180 119.390 -2.210 1
1 918 . 5 1 1 A 79 79 ALA H H 79 9.000 8.108 0.892 1
1 919 . 5 1 1 A 79 79 ALA HA H 79 3.610 3.900 -0.290 1
1 923 . 5 1 1 A 79 79 ALA C C 79 182.260 179.848 2.412 1
1 924 . 5 1 1 A 79 79 ALA CA C 79 55.580 55.422 0.158 1
1 925 . 5 1 1 A 79 79 ALA CB C 79 18.400 18.017 0.383 1
1 926 . 5 1 1 A 79 79 ALA N N 79 126.000 122.040 3.960 1
1 927 . 5 1 1 A 80 80 ALA H H 80 8.000 7.634 0.366 1
1 928 . 5 1 1 A 80 80 ALA HA H 80 4.100 4.045 0.055 1
1 932 . 5 1 1 A 80 80 ALA C C 80 175.460 179.426 -3.966 1
1 933 . 5 1 1 A 80 80 ALA CA C 80 56.020 54.906 1.114 1
1 934 . 5 1 1 A 80 80 ALA CB C 80 18.040 18.643 -0.603 1
1 935 . 5 1 1 A 80 80 ALA N N 80 120.730 120.783 -0.053 1
1 936 . 5 1 1 A 81 81 LEU H H 81 8.460 7.705 0.755 1
1 937 . 5 1 1 A 81 81 LEU HA H 81 4.000 3.969 0.031 1
1 941 . 5 1 1 A 81 81 LEU C C 81 177.030 178.741 -1.711 1
1 942 . 5 1 1 A 81 81 LEU CA C 81 57.640 57.844 -0.204 1
1 943 . 5 1 1 A 81 81 LEU CB C 81 40.620 41.194 -0.574 1
1 945 . 5 1 1 A 81 81 LEU N N 81 119.890 117.309 2.581 1
1 946 . 5 1 1 A 82 82 THR H H 82 8.320 7.657 0.663 1
1 947 . 5 1 1 A 82 82 THR HA H 82 3.800 4.014 -0.214 1
1 952 . 5 1 1 A 82 82 THR C C 82 181.010 176.893 4.117 1
1 953 . 5 1 1 A 82 82 THR CA C 82 68.500 66.130 2.370 1
1 954 . 5 1 1 A 82 82 THR CB C 82 67.400 68.862 -1.462 1
1 956 . 5 1 1 A 82 82 THR N N 82 117.120 114.602 2.518 1
1 957 . 5 1 1 A 83 83 VAL H H 83 8.530 7.477 1.053 1
1 958 . 5 1 1 A 83 83 VAL HA H 83 3.890 3.815 0.075 1
1 966 . 5 1 1 A 83 83 VAL C C 83 178.120 178.237 -0.117 1
1 967 . 5 1 1 A 83 83 VAL CA C 83 67.400 65.123 2.277 1
1 968 . 5 1 1 A 83 83 VAL CB C 83 31.590 31.531 0.059 1
1 971 . 5 1 1 A 83 83 VAL N N 83 119.760 118.107 1.653 1
1 972 . 5 1 1 A 84 84 ALA H H 84 7.910 8.038 -0.128 1
1 973 . 5 1 1 A 84 84 ALA HA H 84 4.060 4.104 -0.044 1
1 977 . 5 1 1 A 84 84 ALA C C 84 180.560 179.843 0.717 1
1 978 . 5 1 1 A 84 84 ALA CA C 84 55.000 55.303 -0.303 1
1 979 . 5 1 1 A 84 84 ALA CB C 84 17.230 18.256 -1.026 1
1 980 . 5 1 1 A 84 84 ALA N N 84 122.620 124.530 -1.910 1
1 981 . 5 1 1 A 85 85 CYS H H 85 8.580 7.886 0.694 1
1 982 . 5 1 1 A 85 85 CYS HA H 85 4.080 4.450 -0.370 1
1 985 . 5 1 1 A 85 85 CYS C C 85 179.060 177.075 1.985 1
1 986 . 5 1 1 A 85 85 CYS CA C 85 63.210 61.750 1.460 1
1 987 . 5 1 1 A 85 85 CYS CB C 85 26.310 27.128 -0.818 1
1 988 . 5 1 1 A 85 85 CYS N N 85 118.730 117.621 1.109 1
1 989 . 5 1 1 A 86 86 ASN H H 86 8.430 8.180 0.250 1
1 990 . 5 1 1 A 86 86 ASN CA C 86 55.860 56.874 -1.014 1
1 991 . 5 1 1 A 86 86 ASN CB C 86 37.440 40.117 -2.677 1
1 992 . 5 1 1 A 86 86 ASN N N 86 119.360 119.311 0.049 1
1 993 . 5 1 1 A 87 87 ASN H H 87 7.880 7.919 -0.039 1
1 994 . 5 1 1 A 87 87 ASN HA H 87 4.600 4.598 0.002 1
1 997 . 5 1 1 A 87 87 ASN C C 87 178.510 177.648 0.862 1
1 998 . 5 1 1 A 87 87 ASN CA C 87 56.470 56.359 0.111 1
1 999 . 5 1 1 A 87 87 ASN CB C 87 37.500 38.926 -1.426 1
1 1000 . 5 1 1 A 87 87 ASN N N 87 119.480 117.635 1.845 1
1 1001 . 5 1 1 A 88 88 PHE H H 88 8.050 7.909 0.141 1
1 1002 . 5 1 1 A 88 88 PHE HA H 88 4.200 4.308 -0.108 1
1 1005 . 5 1 1 A 88 88 PHE C C 88 178.510 177.745 0.765 1
1 1006 . 5 1 1 A 88 88 PHE CA C 88 56.460 59.867 -3.407 1
1 1007 . 5 1 1 A 88 88 PHE CB C 88 38.500 39.947 -1.447 1
1 1008 . 5 1 1 A 88 88 PHE N N 88 120.280 120.022 0.258 1
1 1009 . 5 1 1 A 89 89 PHE H H 89 8.020 8.260 -0.240 1
1 1010 . 5 1 1 A 89 89 PHE HA H 89 4.000 4.263 -0.263 1
1 1013 . 5 1 1 A 89 89 PHE C C 89 177.340 177.600 -0.260 1
1 1014 . 5 1 1 A 89 89 PHE CA C 89 59.000 60.283 -1.283 1
1 1015 . 5 1 1 A 89 89 PHE CB C 89 37.430 39.767 -2.337 1
1 1016 . 5 1 1 A 89 89 PHE N N 89 120.910 119.027 1.883 1
1 1017 . 5 1 1 A 90 90 TRP H H 90 7.800 7.828 -0.028 1
1 1018 . 5 1 1 A 90 90 TRP HA H 90 4.460 4.403 0.057 1
1 1021 . 5 1 1 A 90 90 TRP C C 90 177.340 175.225 2.115 1
1 1022 . 5 1 1 A 90 90 TRP CA C 90 57.930 59.209 -1.279 1
1 1023 . 5 1 1 A 90 90 TRP CB C 90 42.000 30.380 11.620 1
1 1024 . 5 1 1 A 90 90 TRP N N 90 120.050 120.581 -0.531 1
1 1025 . 5 1 1 A 91 91 GLU H H 91 7.800 7.453 0.347 1
1 1026 . 5 1 1 A 91 91 GLU HA H 91 4.050 4.147 -0.097 1
1 1031 . 5 1 1 A 91 91 GLU C C 91 177.570 175.943 1.627 1
1 1032 . 5 1 1 A 91 91 GLU CA C 91 57.350 56.633 0.717 1
1 1033 . 5 1 1 A 91 91 GLU CB C 91 29.530 30.154 -0.624 1
1 1035 . 5 1 1 A 91 91 GLU N N 91 120.730 117.422 3.308 1
1 1036 . 5 1 1 A 92 92 ASN H H 92 7.800 9.170 -1.370 1
1 1037 . 5 1 1 A 92 92 ASN HA H 92 4.630 4.235 0.395 1
1 1040 . 5 1 1 A 92 92 ASN C C 92 174.450 174.297 0.153 1
1 1041 . 5 1 1 A 92 92 ASN CA C 92 52.960 54.292 -1.332 1
1 1042 . 5 1 1 A 92 92 ASN CB C 92 29.530 36.786 -7.256 1
1 1043 . 5 1 1 A 92 92 ASN N N 92 119.410 116.390 3.020 1
1 5 . 6 1 1 A 2 2 SER H H 2 9.000 8.363 0.637 1
1 6 . 6 1 1 A 2 2 SER HA H 2 4.690 4.590 0.100 1
1 9 . 6 1 1 A 2 2 SER C C 2 176.170 175.693 0.477 1
1 10 . 6 1 1 A 2 2 SER CA C 2 57.340 57.880 -0.540 1
1 11 . 6 1 1 A 2 2 SER CB C 2 65.550 63.711 1.839 1
1 12 . 6 1 1 A 2 2 SER N N 2 119.330 117.212 2.118 1
1 13 . 6 1 1 A 3 3 GLU H H 3 9.350 9.070 0.280 1
1 14 . 6 1 1 A 3 3 GLU HA H 3 4.060 3.963 0.097 1
1 17 . 6 1 1 A 3 3 GLU C C 3 180.150 178.720 1.430 1
1 18 . 6 1 1 A 3 3 GLU CA C 3 60.280 59.550 0.730 1
1 19 . 6 1 1 A 3 3 GLU CB C 3 29.230 29.432 -0.202 1
1 21 . 6 1 1 A 3 3 GLU N N 3 125.350 126.277 -0.927 1
1 22 . 6 1 1 A 4 4 LEU H H 4 9.060 8.146 0.914 1
1 23 . 6 1 1 A 4 4 LEU HA H 4 4.080 4.116 -0.036 1
1 33 . 6 1 1 A 4 4 LEU C C 4 177.890 178.279 -0.389 1
1 34 . 6 1 1 A 4 4 LEU CA C 4 58.090 57.750 0.340 1
1 35 . 6 1 1 A 4 4 LEU CB C 4 42.120 41.730 0.390 1
1 39 . 6 1 1 A 4 4 LEU N N 4 121.090 121.159 -0.069 1
1 40 . 6 1 1 A 5 5 GLU H H 5 8.340 8.538 -0.198 1
1 41 . 6 1 1 A 5 5 GLU HA H 5 4.050 3.915 0.135 1
1 46 . 6 1 1 A 5 5 GLU C C 5 177.030 179.269 -2.239 1
1 47 . 6 1 1 A 5 5 GLU CA C 5 59.840 59.669 0.171 1
1 48 . 6 1 1 A 5 5 GLU CB C 5 28.940 29.385 -0.445 1
1 50 . 6 1 1 A 5 5 GLU N N 5 119.780 118.829 0.951 1
1 51 . 6 1 1 A 6 6 THR H H 6 8.370 8.838 -0.468 1
1 52 . 6 1 1 A 6 6 THR HA H 6 4.310 3.894 0.416 1
1 57 . 6 1 1 A 6 6 THR C C 6 177.340 176.977 0.363 1
1 58 . 6 1 1 A 6 6 THR CA C 6 66.630 66.480 0.150 1
1 59 . 6 1 1 A 6 6 THR CB C 6 68.650 68.765 -0.115 1
1 61 . 6 1 1 A 6 6 THR N N 6 116.940 116.623 0.317 1
1 62 . 6 1 1 A 7 7 ALA H H 7 8.270 7.891 0.379 1
1 63 . 6 1 1 A 7 7 ALA HA H 7 4.190 4.342 -0.152 1
1 67 . 6 1 1 A 7 7 ALA C C 7 179.760 179.608 0.152 1
1 68 . 6 1 1 A 7 7 ALA CA C 7 55.880 55.057 0.823 1
1 69 . 6 1 1 A 7 7 ALA CB C 7 17.720 18.408 -0.688 1
1 70 . 6 1 1 A 7 7 ALA N N 7 127.400 123.902 3.498 1
1 71 . 6 1 1 A 8 8 MET H H 8 8.110 7.669 0.441 1
1 72 . 6 1 1 A 8 8 MET HA H 8 4.020 4.227 -0.207 1
1 80 . 6 1 1 A 8 8 MET C C 8 178.510 178.233 0.277 1
1 81 . 6 1 1 A 8 8 MET CA C 8 60.580 58.113 2.467 1
1 82 . 6 1 1 A 8 8 MET CB C 8 33.630 32.217 1.413 1
1 85 . 6 1 1 A 8 8 MET N N 8 117.520 118.406 -0.886 1
1 86 . 6 1 1 A 9 9 GLU H H 9 8.210 7.765 0.445 1
1 87 . 6 1 1 A 9 9 GLU HA H 9 3.830 4.166 -0.336 1
1 92 . 6 1 1 A 9 9 GLU C C 9 179.140 179.061 0.079 1
1 93 . 6 1 1 A 9 9 GLU CA C 9 59.690 59.201 0.489 1
1 94 . 6 1 1 A 9 9 GLU CB C 9 29.530 29.226 0.304 1
1 96 . 6 1 1 A 9 9 GLU N N 9 118.560 118.274 0.286 1
1 97 . 6 1 1 A 10 10 THR H H 10 8.490 7.748 0.742 1
1 98 . 6 1 1 A 10 10 THR HA H 10 4.000 3.999 0.001 1
1 103 . 6 1 1 A 10 10 THR C C 10 176.010 176.732 -0.722 1
1 104 . 6 1 1 A 10 10 THR CA C 10 67.110 66.445 0.665 1
1 105 . 6 1 1 A 10 10 THR CB C 10 67.770 68.365 -0.595 1
1 107 . 6 1 1 A 10 10 THR N N 10 118.310 116.184 2.126 1
1 108 . 6 1 1 A 11 11 LEU H H 11 7.920 7.891 0.029 1
1 109 . 6 1 1 A 11 11 LEU HA H 11 3.930 4.018 -0.088 1
1 119 . 6 1 1 A 11 11 LEU C C 11 178.820 178.912 -0.092 1
1 120 . 6 1 1 A 11 11 LEU CA C 11 59.690 58.264 1.426 1
1 121 . 6 1 1 A 11 11 LEU CB C 11 41.920 41.848 0.072 1
1 125 . 6 1 1 A 11 11 LEU N N 11 121.150 121.016 0.134 1
1 126 . 6 1 1 A 12 12 ILE H H 12 7.440 7.730 -0.290 1
1 127 . 6 1 1 A 12 12 ILE HA H 12 3.640 3.654 -0.014 1
1 137 . 6 1 1 A 12 12 ILE C C 12 179.530 178.741 0.789 1
1 138 . 6 1 1 A 12 12 ILE CA C 12 63.740 64.382 -0.642 1
1 139 . 6 1 1 A 12 12 ILE CB C 12 38.800 37.108 1.692 1
1 143 . 6 1 1 A 12 12 ILE N N 12 118.010 120.596 -2.586 1
1 144 . 6 1 1 A 13 13 ASN H H 13 8.930 8.566 0.364 1
1 145 . 6 1 1 A 13 13 ASN HA H 13 4.520 4.614 -0.094 1
1 148 . 6 1 1 A 13 13 ASN C C 13 179.450 177.769 1.681 1
1 149 . 6 1 1 A 13 13 ASN CA C 13 56.470 55.785 0.685 1
1 150 . 6 1 1 A 13 13 ASN CB C 13 37.930 38.913 -0.983 1
1 151 . 6 1 1 A 13 13 ASN N N 13 121.820 120.732 1.088 1
1 152 . 6 1 1 A 14 14 VAL H H 14 9.180 8.082 1.098 1
1 153 . 6 1 1 A 14 14 VAL HA H 14 3.830 3.886 -0.056 1
1 161 . 6 1 1 A 14 14 VAL CA C 14 65.840 65.385 0.455 1
1 162 . 6 1 1 A 14 14 VAL CB C 14 31.290 31.703 -0.413 1
1 165 . 6 1 1 A 14 14 VAL N N 14 122.040 119.233 2.807 1
1 166 . 6 1 1 A 15 15 PHE H H 15 7.590 8.199 -0.609 1
1 167 . 6 1 1 A 15 15 PHE HA H 15 3.360 4.133 -0.773 1
1 170 . 6 1 1 A 15 15 PHE C C 15 177.890 177.442 0.448 1
1 171 . 6 1 1 A 15 15 PHE CA C 15 62.030 62.033 -0.003 1
1 172 . 6 1 1 A 15 15 PHE CB C 15 38.900 39.273 -0.373 1
1 173 . 6 1 1 A 15 15 PHE N N 15 118.290 122.398 -4.108 1
1 174 . 6 1 1 A 16 16 HIS H H 16 7.790 8.309 -0.519 1
1 175 . 6 1 1 A 16 16 HIS HA H 16 4.890 4.405 0.485 1
1 178 . 6 1 1 A 16 16 HIS C C 16 177.810 176.899 0.911 1
1 179 . 6 1 1 A 16 16 HIS CA C 16 59.100 60.053 -0.953 1
1 180 . 6 1 1 A 16 16 HIS CB C 16 28.060 29.310 -1.250 1
1 181 . 6 1 1 A 16 16 HIS N N 16 118.290 118.501 -0.211 1
1 182 . 6 1 1 A 17 17 ALA H H 17 8.040 7.692 0.348 1
1 183 . 6 1 1 A 17 17 ALA HA H 17 4.050 3.814 0.236 1
1 187 . 6 1 1 A 17 17 ALA C C 17 179.600 180.000 -0.400 1
1 188 . 6 1 1 A 17 17 ALA CA C 17 54.000 55.195 -1.195 1
1 189 . 6 1 1 A 17 17 ALA CB C 17 17.520 18.501 -0.981 1
1 190 . 6 1 1 A 17 17 ALA N N 17 124.410 120.897 3.513 1
1 191 . 6 1 1 A 18 18 HIS H H 18 7.000 7.753 -0.753 1
1 192 . 6 1 1 A 18 18 HIS HA H 18 4.330 4.237 0.093 1
1 195 . 6 1 1 A 18 18 HIS C C 18 176.320 178.335 -2.015 1
1 196 . 6 1 1 A 18 18 HIS CA C 18 57.350 59.589 -2.239 1
1 197 . 6 1 1 A 18 18 HIS CB C 18 32.920 30.138 2.782 1
1 198 . 6 1 1 A 18 18 HIS N N 18 115.160 116.010 -0.850 1
1 199 . 6 1 1 A 19 19 SER H H 19 8.380 8.132 0.248 1
1 200 . 6 1 1 A 19 19 SER HA H 19 3.640 4.158 -0.518 1
1 203 . 6 1 1 A 19 19 SER C C 19 177.340 175.996 1.344 1
1 204 . 6 1 1 A 19 19 SER CA C 19 60.160 60.701 -0.541 1
1 205 . 6 1 1 A 19 19 SER CB C 19 61.000 62.119 -1.119 1
1 206 . 6 1 1 A 19 19 SER N N 19 114.380 115.549 -1.169 1
1 207 . 6 1 1 A 20 20 GLY H H 20 7.600 7.726 -0.126 1
1 208 . 6 1 1 A 20 20 GLY HA2 H 20 3.680 3.727 -0.047 1
1 209 . 6 1 1 A 20 20 GLY HA3 H 20 4.000 3.884 0.116 1
1 210 . 6 1 1 A 20 20 GLY C C 20 174.140 174.386 -0.246 1
1 211 . 6 1 1 A 20 20 GLY CA C 20 47.000 45.173 1.827 1
1 212 . 6 1 1 A 20 20 GLY N N 20 112.550 109.438 3.112 1
1 213 . 6 1 1 A 21 21 LYS H H 21 7.230 7.757 -0.527 1
1 214 . 6 1 1 A 21 21 LYS HA H 21 3.860 4.357 -0.497 1
1 223 . 6 1 1 A 21 21 LYS C C 21 177.730 177.549 0.181 1
1 224 . 6 1 1 A 21 21 LYS CA C 21 59.110 56.968 2.142 1
1 225 . 6 1 1 A 21 21 LYS CB C 21 32.460 34.623 -2.163 1
1 229 . 6 1 1 A 21 21 LYS N N 21 123.240 118.312 4.928 1
1 230 . 6 1 1 A 22 22 GLU H H 22 9.350 8.238 1.112 1
1 231 . 6 1 1 A 22 22 GLU HA H 22 4.610 4.312 0.298 1
1 236 . 6 1 1 A 22 22 GLU C C 22 177.420 176.176 1.244 1
1 237 . 6 1 1 A 22 22 GLU CA C 22 53.700 56.818 -3.118 1
1 238 . 6 1 1 A 22 22 GLU CB C 22 32.000 29.524 2.476 1
1 240 . 6 1 1 A 22 22 GLU N N 22 116.770 117.418 -0.648 1
1 241 . 6 1 1 A 23 23 GLY H H 23 7.570 7.288 0.282 1
1 242 . 6 1 1 A 23 23 GLY HA2 H 23 3.630 4.000 -0.370 1
1 243 . 6 1 1 A 23 23 GLY HA3 H 23 3.880 4.016 -0.136 1
1 244 . 6 1 1 A 23 23 GLY C C 23 173.980 172.228 1.752 1
1 245 . 6 1 1 A 23 23 GLY CA C 23 45.250 45.524 -0.274 1
1 246 . 6 1 1 A 23 23 GLY N N 23 112.180 107.317 4.863 1
1 247 . 6 1 1 A 24 24 ASP H H 24 8.680 8.382 0.298 1
1 248 . 6 1 1 A 24 24 ASP HA H 24 4.380 4.436 -0.056 1
1 251 . 6 1 1 A 24 24 ASP C C 24 178.590 177.662 0.928 1
1 252 . 6 1 1 A 24 24 ASP CA C 24 60.000 54.613 5.387 1
1 253 . 6 1 1 A 24 24 ASP CB C 24 27.480 42.097 -14.617 1
1 254 . 6 1 1 A 24 24 ASP N N 24 127.470 120.456 7.014 1
1 255 . 6 1 1 A 25 25 LYS H H 25 9.270 8.757 0.513 1
1 256 . 6 1 1 A 25 25 LYS HA H 25 4.250 3.896 0.354 1
1 265 . 6 1 1 A 25 25 LYS C C 25 177.030 177.122 -0.092 1
1 266 . 6 1 1 A 25 25 LYS CA C 25 60.000 59.917 0.083 1
1 267 . 6 1 1 A 25 25 LYS CB C 25 31.170 32.692 -1.522 1
1 271 . 6 1 1 A 25 25 LYS N N 25 132.960 124.823 8.137 1
1 272 . 6 1 1 A 26 26 TYR H H 26 9.430 7.513 1.917 1
1 273 . 6 1 1 A 26 26 TYR HA H 26 4.640 4.914 -0.274 1
1 276 . 6 1 1 A 26 26 TYR C C 26 174.290 174.505 -0.215 1
1 277 . 6 1 1 A 26 26 TYR CA C 26 56.010 57.484 -1.474 1
1 278 . 6 1 1 A 26 26 TYR CB C 26 37.730 39.241 -1.511 1
1 279 . 6 1 1 A 26 26 TYR N N 26 120.650 112.197 8.453 1
1 280 . 6 1 1 A 27 27 LYS H H 27 7.110 7.126 -0.016 1
1 281 . 6 1 1 A 27 27 LYS HA H 27 5.110 5.016 0.094 1
1 290 . 6 1 1 A 27 27 LYS C C 27 175.150 173.928 1.222 1
1 291 . 6 1 1 A 27 27 LYS CA C 27 55.070 54.993 0.077 1
1 292 . 6 1 1 A 27 27 LYS CB C 27 38.900 36.003 2.897 1
1 296 . 6 1 1 A 27 27 LYS N N 27 115.830 121.417 -5.587 1
1 297 . 6 1 1 A 28 28 LEU H H 28 9.820 8.656 1.164 1
1 298 . 6 1 1 A 28 28 LEU HA H 28 5.080 5.014 0.066 1
1 308 . 6 1 1 A 28 28 LEU C C 28 176.640 174.994 1.646 1
1 309 . 6 1 1 A 28 28 LEU CA C 28 52.660 53.709 -1.049 1
1 310 . 6 1 1 A 28 28 LEU CB C 28 42.710 44.072 -1.362 1
1 314 . 6 1 1 A 28 28 LEU N N 28 126.930 127.357 -0.427 1
1 315 . 6 1 1 A 29 29 SER H H 29 9.890 8.360 1.530 1
1 316 . 6 1 1 A 29 29 SER HA H 29 4.530 5.053 -0.523 1
1 319 . 6 1 1 A 29 29 SER C C 29 174.990 174.792 0.198 1
1 320 . 6 1 1 A 29 29 SER CA C 29 56.180 55.982 0.198 1
1 321 . 6 1 1 A 29 29 SER CB C 29 65.550 65.488 0.062 1
1 322 . 6 1 1 A 29 29 SER N N 29 121.600 119.798 1.802 1
1 323 . 6 1 1 A 30 30 LYS H H 30 8.850 8.852 -0.002 1
1 324 . 6 1 1 A 30 30 LYS HA H 30 3.850 3.979 -0.129 1
1 333 . 6 1 1 A 30 30 LYS C C 30 175.620 177.614 -1.994 1
1 334 . 6 1 1 A 30 30 LYS CA C 30 60.860 60.010 0.850 1
1 335 . 6 1 1 A 30 30 LYS CB C 30 31.290 32.181 -0.891 1
1 339 . 6 1 1 A 30 30 LYS N N 30 121.260 127.022 -5.762 1
1 340 . 6 1 1 A 31 31 LYS H H 31 7.970 7.868 0.102 1
1 341 . 6 1 1 A 31 31 LYS HA H 31 3.880 4.065 -0.185 1
1 350 . 6 1 1 A 31 31 LYS C C 31 179.290 179.417 -0.127 1
1 351 . 6 1 1 A 31 31 LYS CA C 31 59.110 59.032 0.078 1
1 352 . 6 1 1 A 31 31 LYS CB C 31 32.640 31.798 0.842 1
1 356 . 6 1 1 A 31 31 LYS N N 31 121.260 118.675 2.585 1
1 357 . 6 1 1 A 32 32 GLU H H 32 7.510 8.179 -0.669 1
1 358 . 6 1 1 A 32 32 GLU HA H 32 3.830 4.054 -0.224 1
1 363 . 6 1 1 A 32 32 GLU C C 32 179.290 179.468 -0.178 1
1 364 . 6 1 1 A 32 32 GLU CA C 32 58.590 58.874 -0.284 1
1 365 . 6 1 1 A 32 32 GLU CB C 32 30.120 29.827 0.293 1
1 367 . 6 1 1 A 32 32 GLU N N 32 120.090 119.189 0.901 1
1 368 . 6 1 1 A 33 33 LEU H H 33 8.970 7.574 1.396 1
1 369 . 6 1 1 A 33 33 LEU HA H 33 3.830 3.617 0.213 1
1 379 . 6 1 1 A 33 33 LEU C C 33 178.200 178.749 -0.549 1
1 380 . 6 1 1 A 33 33 LEU CA C 33 57.930 57.516 0.414 1
1 381 . 6 1 1 A 33 33 LEU CB C 33 40.660 41.386 -0.726 1
1 385 . 6 1 1 A 33 33 LEU N N 33 120.200 118.910 1.290 1
1 386 . 6 1 1 A 34 34 LYS H H 34 8.230 7.692 0.538 1
1 387 . 6 1 1 A 34 34 LYS HA H 34 3.550 3.857 -0.307 1
1 396 . 6 1 1 A 34 34 LYS C C 34 178.040 178.562 -0.522 1
1 397 . 6 1 1 A 34 34 LYS CA C 34 60.720 60.053 0.667 1
1 398 . 6 1 1 A 34 34 LYS CB C 34 31.980 32.371 -0.391 1
1 402 . 6 1 1 A 34 34 LYS N N 34 120.780 119.412 1.368 1
1 403 . 6 1 1 A 35 35 ASP H H 35 7.990 7.631 0.359 1
1 404 . 6 1 1 A 35 35 ASP HA H 35 4.250 4.426 -0.176 1
1 407 . 6 1 1 A 35 35 ASP C C 35 179.060 178.462 0.598 1
1 408 . 6 1 1 A 35 35 ASP CA C 35 56.830 56.710 0.120 1
1 409 . 6 1 1 A 35 35 ASP CB C 35 40.440 40.763 -0.323 1
1 410 . 6 1 1 A 35 35 ASP N N 35 119.550 120.000 -0.450 1
1 411 . 6 1 1 A 36 36 LEU H H 36 8.130 7.539 0.591 1
1 412 . 6 1 1 A 36 36 LEU HA H 36 2.580 3.290 -0.710 1
1 422 . 6 1 1 A 36 36 LEU C C 36 179.450 178.420 1.030 1
1 423 . 6 1 1 A 36 36 LEU CA C 36 59.980 57.983 1.997 1
1 424 . 6 1 1 A 36 36 LEU CB C 36 42.180 41.418 0.762 1
1 428 . 6 1 1 A 36 36 LEU N N 36 125.560 121.858 3.702 1
1 429 . 6 1 1 A 37 37 LEU H H 37 8.740 7.890 0.850 1
1 430 . 6 1 1 A 37 37 LEU HA H 37 3.580 4.075 -0.495 1
1 440 . 6 1 1 A 37 37 LEU C C 37 179.290 178.962 0.328 1
1 441 . 6 1 1 A 37 37 LEU CA C 37 58.230 57.921 0.309 1
1 442 . 6 1 1 A 37 37 LEU CB C 37 41.590 41.212 0.378 1
1 446 . 6 1 1 A 37 37 LEU N N 37 120.520 118.332 2.188 1
1 447 . 6 1 1 A 38 38 GLN H H 38 8.520 7.924 0.596 1
1 448 . 6 1 1 A 38 38 GLN HA H 38 4.000 3.966 0.034 1
1 453 . 6 1 1 A 38 38 GLN C C 38 177.960 178.509 -0.549 1
1 454 . 6 1 1 A 38 38 GLN CA C 38 58.210 58.985 -0.775 1
1 455 . 6 1 1 A 38 38 GLN CB C 38 28.650 28.104 0.546 1
1 457 . 6 1 1 A 38 38 GLN N N 38 116.740 118.872 -2.132 1
1 458 . 6 1 1 A 39 39 THR H H 39 7.910 8.051 -0.141 1
1 459 . 6 1 1 A 39 39 THR HA H 39 4.210 3.800 0.410 1
1 464 . 6 1 1 A 39 39 THR C C 39 177.180 175.742 1.438 1
1 465 . 6 1 1 A 39 39 THR CA C 39 64.730 67.200 -2.470 1
1 466 . 6 1 1 A 39 39 THR CB C 39 69.650 68.740 0.910 1
1 468 . 6 1 1 A 39 39 THR N N 39 111.400 117.338 -5.938 1
1 469 . 6 1 1 A 40 40 GLU H H 40 8.590 7.353 1.237 1
1 470 . 6 1 1 A 40 40 GLU HA H 40 4.680 4.458 0.222 1
1 475 . 6 1 1 A 40 40 GLU C C 40 178.280 176.701 1.579 1
1 476 . 6 1 1 A 40 40 GLU CA C 40 55.880 56.556 -0.676 1
1 477 . 6 1 1 A 40 40 GLU CB C 40 30.990 30.994 -0.004 1
1 479 . 6 1 1 A 40 40 GLU N N 40 117.840 116.446 1.394 1
1 480 . 6 1 1 A 41 41 LEU H H 41 7.680 8.124 -0.444 1
1 481 . 6 1 1 A 41 41 LEU HA H 41 5.080 4.724 0.356 1
1 491 . 6 1 1 A 41 41 LEU C C 41 179.450 176.396 3.054 1
1 492 . 6 1 1 A 41 41 LEU CA C 41 53.830 53.384 0.446 1
1 493 . 6 1 1 A 41 41 LEU CB C 41 41.360 42.635 -1.275 1
1 497 . 6 1 1 A 41 41 LEU N N 41 121.410 119.780 1.630 1
1 498 . 6 1 1 A 42 42 SER H H 42 8.380 8.363 0.017 1
1 499 . 6 1 1 A 42 42 SER HA H 42 4.130 4.259 -0.129 1
1 502 . 6 1 1 A 42 42 SER C C 42 176.640 176.768 -0.128 1
1 503 . 6 1 1 A 42 42 SER CA C 42 61.280 61.563 -0.283 1
1 504 . 6 1 1 A 42 42 SER CB C 42 63.040 62.508 0.532 1
1 505 . 6 1 1 A 42 42 SER N N 42 117.420 116.347 1.073 1
1 506 . 6 1 1 A 43 43 SER H H 43 8.900 8.497 0.403 1
1 507 . 6 1 1 A 43 43 SER HA H 43 4.290 4.277 0.013 1
1 510 . 6 1 1 A 43 43 SER C C 43 175.620 176.828 -1.208 1
1 511 . 6 1 1 A 43 43 SER CA C 43 60.860 61.229 -0.369 1
1 512 . 6 1 1 A 43 43 SER CB C 43 62.910 62.267 0.643 1
1 513 . 6 1 1 A 43 43 SER N N 43 117.580 116.268 1.312 1
1 514 . 6 1 1 A 44 44 PHE H H 44 7.880 8.017 -0.137 1
1 515 . 6 1 1 A 44 44 PHE HA H 44 4.240 4.237 0.003 1
1 518 . 6 1 1 A 44 44 PHE C C 44 176.950 175.530 1.420 1
1 519 . 6 1 1 A 44 44 PHE CA C 44 62.710 61.168 1.542 1
1 520 . 6 1 1 A 44 44 PHE CB C 44 39.020 39.134 -0.114 1
1 521 . 6 1 1 A 44 44 PHE N N 44 119.480 122.080 -2.600 1
1 522 . 6 1 1 A 45 45 LEU H H 45 8.060 8.143 -0.083 1
1 523 . 6 1 1 A 45 45 LEU HA H 45 3.810 4.071 -0.261 1
1 533 . 6 1 1 A 45 45 LEU C C 45 177.500 176.411 1.089 1
1 534 . 6 1 1 A 45 45 LEU CA C 45 59.980 55.913 4.067 1
1 535 . 6 1 1 A 45 45 LEU CB C 45 39.640 42.441 -2.801 1
1 538 . 6 1 1 A 45 45 LEU N N 45 118.010 121.693 -3.683 1
1 539 . 6 1 1 A 46 46 ASP H H 46 8.150 8.817 -0.667 1
1 540 . 6 1 1 A 46 46 ASP HA H 46 4.470 4.797 -0.327 1
1 543 . 6 1 1 A 46 46 ASP C C 46 179.920 176.347 3.573 1
1 544 . 6 1 1 A 46 46 ASP CA C 46 52.950 54.033 -1.083 1
1 545 . 6 1 1 A 46 46 ASP CB C 46 40.000 41.373 -1.373 1
1 546 . 6 1 1 A 46 46 ASP N N 46 119.460 125.509 -6.049 1
1 547 . 6 1 1 A 47 47 VAL H H 47 8.010 8.544 -0.534 1
1 548 . 6 1 1 A 47 47 VAL HA H 47 3.800 4.454 -0.654 1
1 556 . 6 1 1 A 47 47 VAL C C 47 175.460 176.509 -1.049 1
1 557 . 6 1 1 A 47 47 VAL CA C 47 60.000 62.493 -2.493 1
1 558 . 6 1 1 A 47 47 VAL CB C 47 31.580 33.797 -2.217 1
1 561 . 6 1 1 A 47 47 VAL N N 47 117.720 116.851 0.869 1
1 562 . 6 1 1 A 48 48 GLN H H 48 7.960 8.265 -0.305 1
1 563 . 6 1 1 A 48 48 GLN HA H 48 4.060 4.314 -0.254 1
1 568 . 6 1 1 A 48 48 GLN C C 48 179.370 177.901 1.469 1
1 569 . 6 1 1 A 48 48 GLN CA C 48 57.350 58.358 -1.008 1
1 570 . 6 1 1 A 48 48 GLN CB C 48 28.990 29.652 -0.662 1
1 572 . 6 1 1 A 48 48 GLN N N 48 119.900 120.548 -0.648 1
1 573 . 6 1 1 A 49 49 LYS H H 49 7.810 7.972 -0.162 1
1 574 . 6 1 1 A 49 49 LYS HA H 49 3.860 4.095 -0.235 1
1 583 . 6 1 1 A 49 49 LYS C C 49 177.890 176.994 0.896 1
1 584 . 6 1 1 A 49 49 LYS CA C 49 58.230 58.748 -0.518 1
1 585 . 6 1 1 A 49 49 LYS CB C 49 30.990 32.478 -1.488 1
1 587 . 6 1 1 A 49 49 LYS N N 49 120.030 118.318 1.712 1
1 588 . 6 1 1 A 50 50 ASP H H 50 7.570 7.792 -0.222 1
1 589 . 6 1 1 A 50 50 ASP HA H 50 4.700 4.905 -0.205 1
1 590 . 6 1 1 A 50 50 ASP CA C 50 52.950 52.784 0.166 1
1 591 . 6 1 1 A 50 50 ASP CB C 50 38.900 40.838 -1.938 1
1 592 . 6 1 1 A 50 50 ASP N N 50 116.730 115.745 0.985 1
1 593 . 6 1 1 A 51 51 ALA H H 51 7.570 8.786 -1.216 1
1 594 . 6 1 1 A 51 51 ALA HA H 51 4.200 3.968 0.232 1
1 598 . 6 1 1 A 51 51 ALA C C 51 179.760 179.280 0.480 1
1 599 . 6 1 1 A 51 51 ALA CA C 51 54.200 55.291 -1.091 1
1 600 . 6 1 1 A 51 51 ALA CB C 51 18.110 18.528 -0.418 1
1 601 . 6 1 1 A 51 51 ALA N N 51 118.390 126.918 -8.528 1
1 602 . 6 1 1 A 52 52 ASP H H 52 8.430 8.318 0.112 1
1 603 . 6 1 1 A 52 52 ASP HA H 52 4.600 4.361 0.239 1
1 606 . 6 1 1 A 52 52 ASP C C 52 177.570 178.389 -0.819 1
1 607 . 6 1 1 A 52 52 ASP CA C 52 54.420 56.732 -2.312 1
1 608 . 6 1 1 A 52 52 ASP CB C 52 40.360 40.136 0.224 1
1 609 . 6 1 1 A 52 52 ASP N N 52 117.530 119.241 -1.711 1
1 610 . 6 1 1 A 53 53 ALA H H 53 7.660 8.065 -0.405 1
1 611 . 6 1 1 A 53 53 ALA HA H 53 3.860 4.013 -0.153 1
1 615 . 6 1 1 A 53 53 ALA C C 53 180.070 180.101 -0.031 1
1 616 . 6 1 1 A 53 53 ALA CA C 53 55.590 55.332 0.258 1
1 617 . 6 1 1 A 53 53 ALA CB C 53 18.800 18.009 0.791 1
1 618 . 6 1 1 A 53 53 ALA N N 53 123.450 122.680 0.770 1
1 619 . 6 1 1 A 54 54 VAL H H 54 8.030 7.928 0.102 1
1 620 . 6 1 1 A 54 54 VAL HA H 54 3.240 3.534 -0.294 1
1 628 . 6 1 1 A 54 54 VAL C C 54 177.340 178.018 -0.678 1
1 629 . 6 1 1 A 54 54 VAL CA C 54 66.620 66.702 -0.082 1
1 630 . 6 1 1 A 54 54 VAL CB C 54 30.480 31.108 -0.628 1
1 633 . 6 1 1 A 54 54 VAL N N 54 116.150 118.241 -2.091 1
1 634 . 6 1 1 A 55 55 ASP H H 55 7.660 7.812 -0.152 1
1 635 . 6 1 1 A 55 55 ASP HA H 55 4.080 4.382 -0.302 1
1 638 . 6 1 1 A 55 55 ASP C C 55 177.260 179.313 -2.053 1
1 639 . 6 1 1 A 55 55 ASP CA C 55 57.640 57.300 0.340 1
1 640 . 6 1 1 A 55 55 ASP CB C 55 40.360 40.246 0.114 1
1 641 . 6 1 1 A 55 55 ASP N N 55 120.830 120.905 -0.075 1
1 642 . 6 1 1 A 56 56 LYS H H 56 7.780 7.568 0.212 1
1 643 . 6 1 1 A 56 56 LYS HA H 56 3.860 4.024 -0.164 1
1 652 . 6 1 1 A 56 56 LYS C C 56 179.530 179.481 0.049 1
1 653 . 6 1 1 A 56 56 LYS CA C 56 59.690 59.757 -0.067 1
1 654 . 6 1 1 A 56 56 LYS CB C 56 31.870 32.519 -0.649 1
1 658 . 6 1 1 A 56 56 LYS N N 56 120.010 119.570 0.440 1
1 659 . 6 1 1 A 57 57 ILE H H 57 8.090 7.772 0.318 1
1 660 . 6 1 1 A 57 57 ILE HA H 57 3.390 3.573 -0.183 1
1 670 . 6 1 1 A 57 57 ILE C C 57 176.710 177.695 -0.985 1
1 671 . 6 1 1 A 57 57 ILE CA C 57 64.960 65.058 -0.098 1
1 672 . 6 1 1 A 57 57 ILE CB C 57 38.080 38.287 -0.207 1
1 676 . 6 1 1 A 57 57 ILE N N 57 120.960 120.354 0.606 1
1 677 . 6 1 1 A 58 58 MET H H 58 8.480 8.230 0.250 1
1 678 . 6 1 1 A 58 58 MET HA H 58 3.800 4.136 -0.336 1
1 686 . 6 1 1 A 58 58 MET C C 58 177.570 178.034 -0.464 1
1 687 . 6 1 1 A 58 58 MET CA C 58 58.570 58.383 0.187 1
1 688 . 6 1 1 A 58 58 MET CB C 58 32.570 32.029 0.541 1
1 691 . 6 1 1 A 58 58 MET N N 58 119.160 120.629 -1.469 1
1 692 . 6 1 1 A 59 59 LYS H H 59 7.550 7.927 -0.377 1
1 693 . 6 1 1 A 59 59 LYS HA H 59 3.930 3.929 0.001 1
1 702 . 6 1 1 A 59 59 LYS C C 59 179.530 179.310 0.220 1
1 703 . 6 1 1 A 59 59 LYS CA C 59 58.820 59.539 -0.719 1
1 704 . 6 1 1 A 59 59 LYS CB C 59 32.450 32.424 0.026 1
1 708 . 6 1 1 A 59 59 LYS N N 59 116.730 119.711 -2.981 1
1 709 . 6 1 1 A 60 60 GLU H H 60 7.470 7.458 0.012 1
1 710 . 6 1 1 A 60 60 GLU HA H 60 4.050 4.091 -0.041 1
1 715 . 6 1 1 A 60 60 GLU C C 60 178.950 178.259 0.691 1
1 716 . 6 1 1 A 60 60 GLU CA C 60 58.600 58.824 -0.224 1
1 717 . 6 1 1 A 60 60 GLU CB C 60 31.700 29.520 2.180 1
1 719 . 6 1 1 A 60 60 GLU N N 60 116.820 118.905 -2.085 1
1 720 . 6 1 1 A 61 61 LEU H H 61 8.030 7.753 0.277 1
1 721 . 6 1 1 A 61 61 LEU HA H 61 4.310 4.174 0.136 1
1 731 . 6 1 1 A 61 61 LEU C C 61 179.450 177.281 2.169 1
1 732 . 6 1 1 A 61 61 LEU CA C 61 54.840 56.542 -1.702 1
1 733 . 6 1 1 A 61 61 LEU CB C 61 43.820 42.140 1.680 1
1 737 . 6 1 1 A 61 61 LEU N N 61 116.000 119.088 -3.088 1
1 738 . 6 1 1 A 62 62 ASP H H 62 7.890 8.627 -0.737 1
1 739 . 6 1 1 A 62 62 ASP HA H 62 4.660 4.902 -0.242 1
1 742 . 6 1 1 A 62 62 ASP C C 62 177.030 176.220 0.810 1
1 743 . 6 1 1 A 62 62 ASP CA C 62 53.660 53.355 0.305 1
1 744 . 6 1 1 A 62 62 ASP CB C 62 38.700 38.779 -0.079 1
1 745 . 6 1 1 A 62 62 ASP N N 62 117.550 117.537 0.013 1
1 746 . 6 1 1 A 63 63 GLU H H 63 8.430 9.923 -1.493 1
1 747 . 6 1 1 A 63 63 GLU HA H 63 4.020 4.026 -0.006 1
1 752 . 6 1 1 A 63 63 GLU C C 63 178.120 179.087 -0.967 1
1 753 . 6 1 1 A 63 63 GLU CA C 63 58.470 59.088 -0.618 1
1 754 . 6 1 1 A 63 63 GLU CB C 63 30.120 29.334 0.786 1
1 756 . 6 1 1 A 63 63 GLU N N 63 130.230 121.184 9.046 1
1 757 . 6 1 1 A 64 64 ASN H H 64 8.010 7.801 0.209 1
1 758 . 6 1 1 A 64 64 ASN HA H 64 4.680 4.769 -0.089 1
1 761 . 6 1 1 A 64 64 ASN C C 64 177.100 175.552 1.548 1
1 762 . 6 1 1 A 64 64 ASN CA C 64 51.780 53.563 -1.783 1
1 763 . 6 1 1 A 64 64 ASN CB C 64 37.260 39.038 -1.778 1
1 764 . 6 1 1 A 64 64 ASN N N 64 113.640 115.257 -1.617 1
1 765 . 6 1 1 A 65 65 GLY H H 65 7.550 7.960 -0.410 1
1 766 . 6 1 1 A 65 65 GLY HA2 H 65 3.770 3.968 -0.198 1
1 767 . 6 1 1 A 65 65 GLY HA3 H 65 3.770 3.968 -0.198 1
1 768 . 6 1 1 A 65 65 GLY C C 65 178.980 173.892 5.088 1
1 769 . 6 1 1 A 65 65 GLY CA C 65 47.200 46.233 0.967 1
1 770 . 6 1 1 A 65 65 GLY N N 65 113.640 107.222 6.418 1
1 771 . 6 1 1 A 66 66 ASP H H 66 8.110 8.046 0.064 1
1 772 . 6 1 1 A 66 66 ASP HA H 66 4.490 4.962 -0.472 1
1 775 . 6 1 1 A 66 66 ASP C C 66 177.960 175.905 2.055 1
1 776 . 6 1 1 A 66 66 ASP CA C 66 52.960 52.423 0.537 1
1 777 . 6 1 1 A 66 66 ASP CB C 66 40.540 41.115 -0.575 1
1 778 . 6 1 1 A 66 66 ASP N N 66 120.030 119.612 0.418 1
1 779 . 6 1 1 A 67 67 GLY H H 67 10.260 8.057 2.203 1
1 780 . 6 1 1 A 67 67 GLY HA2 H 67 3.360 4.103 -0.743 1
1 781 . 6 1 1 A 67 67 GLY HA3 H 67 4.000 4.108 -0.108 1
1 782 . 6 1 1 A 67 67 GLY C C 67 173.120 173.339 -0.219 1
1 783 . 6 1 1 A 67 67 GLY CA C 67 45.460 45.724 -0.264 1
1 784 . 6 1 1 A 67 67 GLY N N 67 114.100 108.608 5.492 1
1 785 . 6 1 1 A 68 68 GLU H H 68 7.750 7.803 -0.053 1
1 786 . 6 1 1 A 68 68 GLU HA H 68 4.780 4.987 -0.207 1
1 791 . 6 1 1 A 68 68 GLU C C 68 175.930 175.305 0.625 1
1 792 . 6 1 1 A 68 68 GLU CA C 68 54.430 54.422 0.008 1
1 793 . 6 1 1 A 68 68 GLU CB C 68 35.850 33.917 1.933 1
1 795 . 6 1 1 A 68 68 GLU N N 68 118.000 119.486 -1.486 1
1 796 . 6 1 1 A 69 69 VAL H H 69 9.380 8.523 0.857 1
1 797 . 6 1 1 A 69 69 VAL HA H 69 5.260 4.840 0.420 1
1 805 . 6 1 1 A 69 69 VAL C C 69 176.710 173.456 3.254 1
1 806 . 6 1 1 A 69 69 VAL CA C 69 61.280 60.561 0.719 1
1 807 . 6 1 1 A 69 69 VAL CB C 69 33.980 36.108 -2.128 1
1 810 . 6 1 1 A 69 69 VAL N N 69 125.970 120.613 5.357 1
1 811 . 6 1 1 A 70 70 ASP H H 70 9.100 9.511 -0.411 1
1 812 . 6 1 1 A 70 70 ASP HA H 70 5.190 5.179 0.011 1
1 815 . 6 1 1 A 70 70 ASP C C 70 175.700 176.961 -1.261 1
1 816 . 6 1 1 A 70 70 ASP CA C 70 52.370 52.935 -0.565 1
1 817 . 6 1 1 A 70 70 ASP CB C 70 40.950 43.050 -2.100 1
1 818 . 6 1 1 A 70 70 ASP N N 70 130.320 126.770 3.550 1
1 819 . 6 1 1 A 71 71 PHE H H 71 9.090 9.209 -0.119 1
1 820 . 6 1 1 A 71 71 PHE HA H 71 4.100 3.756 0.344 1
1 823 . 6 1 1 A 71 71 PHE C C 71 177.000 177.656 -0.656 1
1 824 . 6 1 1 A 71 71 PHE CA C 71 58.230 62.299 -4.069 1
1 825 . 6 1 1 A 71 71 PHE CB C 71 36.910 39.078 -2.168 1
1 826 . 6 1 1 A 71 71 PHE N N 71 119.760 126.053 -6.293 1
1 827 . 6 1 1 A 72 72 GLN H H 72 8.440 8.272 0.168 1
1 828 . 6 1 1 A 72 72 GLN HA H 72 3.600 3.907 -0.307 1
1 831 . 6 1 1 A 72 72 GLN C C 72 178.820 178.098 0.722 1
1 832 . 6 1 1 A 72 72 GLN CA C 72 59.500 58.649 0.851 1
1 833 . 6 1 1 A 72 72 GLN CB C 72 29.553 28.341 1.212 1
1 835 . 6 1 1 A 72 72 GLN N N 72 121.820 117.871 3.949 1
1 836 . 6 1 1 A 73 73 GLU H H 73 8.290 7.796 0.494 1
1 837 . 6 1 1 A 73 73 GLU HA H 73 4.070 4.092 -0.022 1
1 842 . 6 1 1 A 73 73 GLU C C 73 179.370 179.000 0.370 1
1 843 . 6 1 1 A 73 73 GLU CA C 73 58.030 58.816 -0.786 1
1 844 . 6 1 1 A 73 73 GLU CB C 73 29.530 30.219 -0.689 1
1 846 . 6 1 1 A 73 73 GLU N N 73 120.550 118.888 1.662 1
1 847 . 6 1 1 A 74 74 PHE H H 74 8.630 8.441 0.189 1
1 848 . 6 1 1 A 74 74 PHE HA H 74 4.020 4.111 -0.091 1
1 851 . 6 1 1 A 74 74 PHE C C 74 177.890 176.848 1.042 1
1 852 . 6 1 1 A 74 74 PHE CA C 74 60.090 60.965 -0.875 1
1 853 . 6 1 1 A 74 74 PHE CB C 74 38.020 39.050 -1.030 1
1 854 . 6 1 1 A 74 74 PHE N N 74 121.010 121.890 -0.880 1
1 855 . 6 1 1 A 75 75 VAL H H 75 8.080 8.201 -0.121 1
1 856 . 6 1 1 A 75 75 VAL HA H 75 2.860 3.423 -0.563 1
1 864 . 6 1 1 A 75 75 VAL C C 75 177.030 178.246 -1.216 1
1 865 . 6 1 1 A 75 75 VAL CA C 75 66.430 66.468 -0.038 1
1 866 . 6 1 1 A 75 75 VAL CB C 75 30.600 30.846 -0.246 1
1 869 . 6 1 1 A 75 75 VAL N N 75 119.460 119.377 0.083 1
1 870 . 6 1 1 A 76 76 VAL H H 76 7.100 8.092 -0.992 1
1 871 . 6 1 1 A 76 76 VAL HA H 76 3.330 3.476 -0.146 1
1 879 . 6 1 1 A 76 76 VAL C C 76 178.670 177.992 0.678 1
1 880 . 6 1 1 A 76 76 VAL CA C 76 67.000 66.702 0.298 1
1 881 . 6 1 1 A 76 76 VAL CB C 76 31.280 31.374 -0.094 1
1 884 . 6 1 1 A 76 76 VAL N N 76 121.030 120.142 0.888 1
1 885 . 6 1 1 A 77 77 LEU H H 77 6.900 7.660 -0.760 1
1 886 . 6 1 1 A 77 77 LEU HA H 77 3.800 3.847 -0.047 1
1 896 . 6 1 1 A 77 77 LEU C C 77 177.960 178.261 -0.301 1
1 897 . 6 1 1 A 77 77 LEU CA C 77 57.710 58.167 -0.457 1
1 898 . 6 1 1 A 77 77 LEU CB C 77 40.070 41.357 -1.287 1
1 902 . 6 1 1 A 77 77 LEU N N 77 120.310 120.619 -0.309 1
1 903 . 6 1 1 A 78 78 VAL H H 78 7.240 7.771 -0.531 1
1 904 . 6 1 1 A 78 78 VAL HA H 78 3.030 3.944 -0.914 1
1 912 . 6 1 1 A 78 78 VAL C C 78 179.600 178.114 1.486 1
1 913 . 6 1 1 A 78 78 VAL CA C 78 66.420 64.778 1.642 1
1 914 . 6 1 1 A 78 78 VAL CB C 78 30.700 31.646 -0.946 1
1 917 . 6 1 1 A 78 78 VAL N N 78 117.180 116.130 1.050 1
1 918 . 6 1 1 A 79 79 ALA H H 79 9.000 7.998 1.002 1
1 919 . 6 1 1 A 79 79 ALA HA H 79 3.610 4.016 -0.406 1
1 923 . 6 1 1 A 79 79 ALA C C 79 182.260 180.207 2.053 1
1 924 . 6 1 1 A 79 79 ALA CA C 79 55.580 55.366 0.214 1
1 925 . 6 1 1 A 79 79 ALA CB C 79 18.400 18.046 0.354 1
1 926 . 6 1 1 A 79 79 ALA N N 79 126.000 125.164 0.836 1
1 927 . 6 1 1 A 80 80 ALA H H 80 8.000 7.738 0.262 1
1 928 . 6 1 1 A 80 80 ALA HA H 80 4.100 4.060 0.040 1
1 932 . 6 1 1 A 80 80 ALA C C 80 175.460 179.630 -4.170 1
1 933 . 6 1 1 A 80 80 ALA CA C 80 56.020 54.475 1.545 1
1 934 . 6 1 1 A 80 80 ALA CB C 80 18.040 18.220 -0.180 1
1 935 . 6 1 1 A 80 80 ALA N N 80 120.730 120.901 -0.171 1
1 936 . 6 1 1 A 81 81 LEU H H 81 8.460 7.797 0.663 1
1 937 . 6 1 1 A 81 81 LEU HA H 81 4.000 4.162 -0.162 1
1 941 . 6 1 1 A 81 81 LEU C C 81 177.030 179.306 -2.276 1
1 942 . 6 1 1 A 81 81 LEU CA C 81 57.640 57.570 0.070 1
1 943 . 6 1 1 A 81 81 LEU CB C 81 40.620 42.467 -1.847 1
1 945 . 6 1 1 A 81 81 LEU N N 81 119.890 119.692 0.198 1
1 946 . 6 1 1 A 82 82 THR H H 82 8.320 7.862 0.458 1
1 947 . 6 1 1 A 82 82 THR HA H 82 3.800 3.928 -0.128 1
1 952 . 6 1 1 A 82 82 THR C C 82 181.010 176.982 4.028 1
1 953 . 6 1 1 A 82 82 THR CA C 82 68.500 66.237 2.263 1
1 954 . 6 1 1 A 82 82 THR CB C 82 67.400 69.143 -1.743 1
1 956 . 6 1 1 A 82 82 THR N N 82 117.120 113.798 3.322 1
1 957 . 6 1 1 A 83 83 VAL H H 83 8.530 7.529 1.001 1
1 958 . 6 1 1 A 83 83 VAL HA H 83 3.890 3.835 0.055 1
1 966 . 6 1 1 A 83 83 VAL C C 83 178.120 178.218 -0.098 1
1 967 . 6 1 1 A 83 83 VAL CA C 83 67.400 65.147 2.253 1
1 968 . 6 1 1 A 83 83 VAL CB C 83 31.590 31.551 0.039 1
1 971 . 6 1 1 A 83 83 VAL N N 83 119.760 118.102 1.658 1
1 972 . 6 1 1 A 84 84 ALA H H 84 7.910 8.153 -0.243 1
1 973 . 6 1 1 A 84 84 ALA HA H 84 4.060 4.114 -0.054 1
1 977 . 6 1 1 A 84 84 ALA C C 84 180.560 180.012 0.548 1
1 978 . 6 1 1 A 84 84 ALA CA C 84 55.000 55.121 -0.121 1
1 979 . 6 1 1 A 84 84 ALA CB C 84 17.230 18.286 -1.056 1
1 980 . 6 1 1 A 84 84 ALA N N 84 122.620 124.503 -1.883 1
1 981 . 6 1 1 A 85 85 CYS H H 85 8.580 7.967 0.613 1
1 982 . 6 1 1 A 85 85 CYS HA H 85 4.080 4.571 -0.491 1
1 985 . 6 1 1 A 85 85 CYS C C 85 179.060 176.989 2.071 1
1 986 . 6 1 1 A 85 85 CYS CA C 85 63.210 61.596 1.614 1
1 987 . 6 1 1 A 85 85 CYS CB C 85 26.310 27.389 -1.079 1
1 988 . 6 1 1 A 85 85 CYS N N 85 118.730 117.489 1.241 1
1 989 . 6 1 1 A 86 86 ASN H H 86 8.430 8.020 0.410 1
1 990 . 6 1 1 A 86 86 ASN CA C 86 55.860 56.445 -0.585 1
1 991 . 6 1 1 A 86 86 ASN CB C 86 37.440 37.811 -0.371 1
1 992 . 6 1 1 A 86 86 ASN N N 86 119.360 119.291 0.069 1
1 993 . 6 1 1 A 87 87 ASN H H 87 7.880 7.970 -0.090 1
1 994 . 6 1 1 A 87 87 ASN HA H 87 4.600 4.510 0.090 1
1 997 . 6 1 1 A 87 87 ASN C C 87 178.510 177.216 1.294 1
1 998 . 6 1 1 A 87 87 ASN CA C 87 56.470 56.321 0.149 1
1 999 . 6 1 1 A 87 87 ASN CB C 87 37.500 39.213 -1.713 1
1 1000 . 6 1 1 A 87 87 ASN N N 87 119.480 117.772 1.708 1
1 1001 . 6 1 1 A 88 88 PHE H H 88 8.050 7.648 0.402 1
1 1002 . 6 1 1 A 88 88 PHE HA H 88 4.200 4.512 -0.312 1
1 1005 . 6 1 1 A 88 88 PHE C C 88 178.510 177.383 1.127 1
1 1006 . 6 1 1 A 88 88 PHE CA C 88 56.460 60.330 -3.870 1
1 1007 . 6 1 1 A 88 88 PHE CB C 88 38.500 38.321 0.179 1
1 1008 . 6 1 1 A 88 88 PHE N N 88 120.280 118.148 2.132 1
1 1009 . 6 1 1 A 89 89 PHE H H 89 8.020 8.816 -0.796 1
1 1010 . 6 1 1 A 89 89 PHE HA H 89 4.000 4.312 -0.312 1
1 1013 . 6 1 1 A 89 89 PHE C C 89 177.340 177.577 -0.237 1
1 1014 . 6 1 1 A 89 89 PHE CA C 89 59.000 59.856 -0.856 1
1 1015 . 6 1 1 A 89 89 PHE CB C 89 37.430 39.907 -2.477 1
1 1016 . 6 1 1 A 89 89 PHE N N 89 120.910 119.758 1.152 1
1 1017 . 6 1 1 A 90 90 TRP H H 90 7.800 7.970 -0.170 1
1 1018 . 6 1 1 A 90 90 TRP HA H 90 4.460 4.323 0.137 1
1 1021 . 6 1 1 A 90 90 TRP C C 90 177.340 178.498 -1.158 1
1 1022 . 6 1 1 A 90 90 TRP CA C 90 57.930 60.407 -2.477 1
1 1023 . 6 1 1 A 90 90 TRP CB C 90 42.000 29.771 12.229 1
1 1024 . 6 1 1 A 90 90 TRP N N 90 120.050 120.969 -0.919 1
1 1025 . 6 1 1 A 91 91 GLU H H 91 7.800 8.872 -1.072 1
1 1026 . 6 1 1 A 91 91 GLU HA H 91 4.050 3.872 0.178 1
1 1031 . 6 1 1 A 91 91 GLU C C 91 177.570 178.511 -0.941 1
1 1032 . 6 1 1 A 91 91 GLU CA C 91 57.350 59.948 -2.598 1
1 1033 . 6 1 1 A 91 91 GLU CB C 91 29.530 29.032 0.498 1
1 1035 . 6 1 1 A 91 91 GLU N N 91 120.730 118.288 2.442 1
1 1036 . 6 1 1 A 92 92 ASN H H 92 7.800 7.591 0.209 1
1 1037 . 6 1 1 A 92 92 ASN HA H 92 4.630 4.533 0.097 1
1 1040 . 6 1 1 A 92 92 ASN C C 92 174.450 174.570 -0.120 1
1 1041 . 6 1 1 A 92 92 ASN CA C 92 52.960 52.541 0.419 1
1 1042 . 6 1 1 A 92 92 ASN CB C 92 29.530 37.712 -8.182 1
1 1043 . 6 1 1 A 92 92 ASN N N 92 119.410 115.679 3.731 1
1 5 . 7 1 1 A 2 2 SER H H 2 9.000 8.161 0.839 1
1 6 . 7 1 1 A 2 2 SER HA H 2 4.690 4.270 0.420 1
1 9 . 7 1 1 A 2 2 SER C C 2 176.170 174.813 1.357 1
1 10 . 7 1 1 A 2 2 SER CA C 2 57.340 59.298 -1.958 1
1 11 . 7 1 1 A 2 2 SER CB C 2 65.550 62.316 3.234 1
1 12 . 7 1 1 A 2 2 SER N N 2 119.330 114.985 4.345 1
1 13 . 7 1 1 A 3 3 GLU H H 3 9.350 9.047 0.303 1
1 14 . 7 1 1 A 3 3 GLU HA H 3 4.060 4.016 0.044 1
1 17 . 7 1 1 A 3 3 GLU C C 3 180.150 179.044 1.106 1
1 18 . 7 1 1 A 3 3 GLU CA C 3 60.280 59.002 1.278 1
1 19 . 7 1 1 A 3 3 GLU CB C 3 29.230 29.480 -0.250 1
1 21 . 7 1 1 A 3 3 GLU N N 3 125.350 123.036 2.314 1
1 22 . 7 1 1 A 4 4 LEU H H 4 9.060 8.070 0.990 1
1 23 . 7 1 1 A 4 4 LEU HA H 4 4.080 4.077 0.003 1
1 33 . 7 1 1 A 4 4 LEU C C 4 177.890 178.530 -0.640 1
1 34 . 7 1 1 A 4 4 LEU CA C 4 58.090 57.956 0.134 1
1 35 . 7 1 1 A 4 4 LEU CB C 4 42.120 41.791 0.329 1
1 39 . 7 1 1 A 4 4 LEU N N 4 121.090 121.065 0.025 1
1 40 . 7 1 1 A 5 5 GLU H H 5 8.340 8.317 0.023 1
1 41 . 7 1 1 A 5 5 GLU HA H 5 4.050 3.935 0.115 1
1 46 . 7 1 1 A 5 5 GLU C C 5 177.030 179.115 -2.085 1
1 47 . 7 1 1 A 5 5 GLU CA C 5 59.840 59.621 0.219 1
1 48 . 7 1 1 A 5 5 GLU CB C 5 28.940 29.414 -0.474 1
1 50 . 7 1 1 A 5 5 GLU N N 5 119.780 119.056 0.724 1
1 51 . 7 1 1 A 6 6 THR H H 6 8.370 8.223 0.147 1
1 52 . 7 1 1 A 6 6 THR HA H 6 4.310 3.911 0.399 1
1 57 . 7 1 1 A 6 6 THR C C 6 177.340 177.103 0.237 1
1 58 . 7 1 1 A 6 6 THR CA C 6 66.630 65.984 0.646 1
1 59 . 7 1 1 A 6 6 THR CB C 6 68.650 68.723 -0.073 1
1 61 . 7 1 1 A 6 6 THR N N 6 116.940 116.421 0.519 1
1 62 . 7 1 1 A 7 7 ALA H H 7 8.270 8.076 0.194 1
1 63 . 7 1 1 A 7 7 ALA HA H 7 4.190 4.066 0.124 1
1 67 . 7 1 1 A 7 7 ALA C C 7 179.760 180.225 -0.465 1
1 68 . 7 1 1 A 7 7 ALA CA C 7 55.880 55.207 0.673 1
1 69 . 7 1 1 A 7 7 ALA CB C 7 17.720 18.149 -0.429 1
1 70 . 7 1 1 A 7 7 ALA N N 7 127.400 123.497 3.903 1
1 71 . 7 1 1 A 8 8 MET H H 8 8.110 7.743 0.367 1
1 72 . 7 1 1 A 8 8 MET HA H 8 4.020 4.351 -0.331 1
1 80 . 7 1 1 A 8 8 MET C C 8 178.510 178.101 0.409 1
1 81 . 7 1 1 A 8 8 MET CA C 8 60.580 58.233 2.347 1
1 82 . 7 1 1 A 8 8 MET CB C 8 33.630 33.366 0.264 1
1 85 . 7 1 1 A 8 8 MET N N 8 117.520 116.600 0.920 1
1 86 . 7 1 1 A 9 9 GLU H H 9 8.210 8.137 0.073 1
1 87 . 7 1 1 A 9 9 GLU HA H 9 3.830 4.118 -0.288 1
1 92 . 7 1 1 A 9 9 GLU C C 9 179.140 178.683 0.457 1
1 93 . 7 1 1 A 9 9 GLU CA C 9 59.690 59.319 0.371 1
1 94 . 7 1 1 A 9 9 GLU CB C 9 29.530 28.979 0.551 1
1 96 . 7 1 1 A 9 9 GLU N N 9 118.560 118.873 -0.313 1
1 97 . 7 1 1 A 10 10 THR H H 10 8.490 7.676 0.814 1
1 98 . 7 1 1 A 10 10 THR HA H 10 4.000 4.341 -0.341 1
1 103 . 7 1 1 A 10 10 THR C C 10 176.010 176.266 -0.256 1
1 104 . 7 1 1 A 10 10 THR CA C 10 67.110 65.886 1.224 1
1 105 . 7 1 1 A 10 10 THR CB C 10 67.770 68.866 -1.096 1
1 107 . 7 1 1 A 10 10 THR N N 10 118.310 115.420 2.890 1
1 108 . 7 1 1 A 11 11 LEU H H 11 7.920 7.798 0.122 1
1 109 . 7 1 1 A 11 11 LEU HA H 11 3.930 4.120 -0.190 1
1 119 . 7 1 1 A 11 11 LEU C C 11 178.820 179.175 -0.355 1
1 120 . 7 1 1 A 11 11 LEU CA C 11 59.690 58.437 1.253 1
1 121 . 7 1 1 A 11 11 LEU CB C 11 41.920 41.849 0.071 1
1 125 . 7 1 1 A 11 11 LEU N N 11 121.150 121.306 -0.156 1
1 126 . 7 1 1 A 12 12 ILE H H 12 7.440 7.736 -0.296 1
1 127 . 7 1 1 A 12 12 ILE HA H 12 3.640 3.315 0.325 1
1 137 . 7 1 1 A 12 12 ILE C C 12 179.530 178.605 0.925 1
1 138 . 7 1 1 A 12 12 ILE CA C 12 63.740 65.026 -1.286 1
1 139 . 7 1 1 A 12 12 ILE CB C 12 38.800 37.347 1.453 1
1 143 . 7 1 1 A 12 12 ILE N N 12 118.010 119.842 -1.832 1
1 144 . 7 1 1 A 13 13 ASN H H 13 8.930 8.513 0.417 1
1 145 . 7 1 1 A 13 13 ASN HA H 13 4.520 4.509 0.011 1
1 148 . 7 1 1 A 13 13 ASN C C 13 179.450 177.996 1.454 1
1 149 . 7 1 1 A 13 13 ASN CA C 13 56.470 56.092 0.378 1
1 150 . 7 1 1 A 13 13 ASN CB C 13 37.930 38.769 -0.839 1
1 151 . 7 1 1 A 13 13 ASN N N 13 121.820 119.544 2.276 1
1 152 . 7 1 1 A 14 14 VAL H H 14 9.180 7.926 1.254 1
1 153 . 7 1 1 A 14 14 VAL HA H 14 3.830 3.836 -0.006 1
1 161 . 7 1 1 A 14 14 VAL CA C 14 65.840 65.496 0.344 1
1 162 . 7 1 1 A 14 14 VAL CB C 14 31.290 31.180 0.110 1
1 165 . 7 1 1 A 14 14 VAL N N 14 122.040 116.302 5.738 1
1 166 . 7 1 1 A 15 15 PHE H H 15 7.590 8.235 -0.645 1
1 167 . 7 1 1 A 15 15 PHE HA H 15 3.360 4.153 -0.793 1
1 170 . 7 1 1 A 15 15 PHE C C 15 177.890 178.730 -0.840 1
1 171 . 7 1 1 A 15 15 PHE CA C 15 62.030 60.327 1.703 1
1 172 . 7 1 1 A 15 15 PHE CB C 15 38.900 38.250 0.650 1
1 173 . 7 1 1 A 15 15 PHE N N 15 118.290 120.124 -1.834 1
1 174 . 7 1 1 A 16 16 HIS H H 16 7.790 7.962 -0.172 1
1 175 . 7 1 1 A 16 16 HIS HA H 16 4.890 4.341 0.549 1
1 178 . 7 1 1 A 16 16 HIS C C 16 177.810 177.156 0.654 1
1 179 . 7 1 1 A 16 16 HIS CA C 16 59.100 60.062 -0.962 1
1 180 . 7 1 1 A 16 16 HIS CB C 16 28.060 29.280 -1.220 1
1 181 . 7 1 1 A 16 16 HIS N N 16 118.290 119.165 -0.875 1
1 182 . 7 1 1 A 17 17 ALA H H 17 8.040 7.926 0.114 1
1 183 . 7 1 1 A 17 17 ALA HA H 17 4.050 3.926 0.124 1
1 187 . 7 1 1 A 17 17 ALA C C 17 179.600 179.759 -0.159 1
1 188 . 7 1 1 A 17 17 ALA CA C 17 54.000 55.235 -1.235 1
1 189 . 7 1 1 A 17 17 ALA CB C 17 17.520 18.642 -1.122 1
1 190 . 7 1 1 A 17 17 ALA N N 17 124.410 121.012 3.398 1
1 191 . 7 1 1 A 18 18 HIS H H 18 7.000 7.513 -0.513 1
1 192 . 7 1 1 A 18 18 HIS HA H 18 4.330 4.378 -0.048 1
1 195 . 7 1 1 A 18 18 HIS C C 18 176.320 178.160 -1.840 1
1 196 . 7 1 1 A 18 18 HIS CA C 18 57.350 59.198 -1.848 1
1 197 . 7 1 1 A 18 18 HIS CB C 18 32.920 30.250 2.670 1
1 198 . 7 1 1 A 18 18 HIS N N 18 115.160 115.968 -0.808 1
1 199 . 7 1 1 A 19 19 SER H H 19 8.380 8.502 -0.122 1
1 200 . 7 1 1 A 19 19 SER HA H 19 3.640 4.150 -0.510 1
1 203 . 7 1 1 A 19 19 SER C C 19 177.340 176.002 1.338 1
1 204 . 7 1 1 A 19 19 SER CA C 19 60.160 61.270 -1.110 1
1 205 . 7 1 1 A 19 19 SER CB C 19 61.000 62.563 -1.563 1
1 206 . 7 1 1 A 19 19 SER N N 19 114.380 116.098 -1.718 1
1 207 . 7 1 1 A 20 20 GLY H H 20 7.600 7.677 -0.077 1
1 208 . 7 1 1 A 20 20 GLY HA2 H 20 3.680 3.844 -0.164 1
1 209 . 7 1 1 A 20 20 GLY HA3 H 20 4.000 3.961 0.039 1
1 210 . 7 1 1 A 20 20 GLY C C 20 174.140 174.118 0.022 1
1 211 . 7 1 1 A 20 20 GLY CA C 20 47.000 45.178 1.822 1
1 212 . 7 1 1 A 20 20 GLY N N 20 112.550 109.016 3.534 1
1 213 . 7 1 1 A 21 21 LYS H H 21 7.230 7.523 -0.293 1
1 214 . 7 1 1 A 21 21 LYS HA H 21 3.860 4.422 -0.562 1
1 223 . 7 1 1 A 21 21 LYS C C 21 177.730 177.403 0.327 1
1 224 . 7 1 1 A 21 21 LYS CA C 21 59.110 56.998 2.112 1
1 225 . 7 1 1 A 21 21 LYS CB C 21 32.460 34.436 -1.976 1
1 229 . 7 1 1 A 21 21 LYS N N 21 123.240 118.259 4.981 1
1 230 . 7 1 1 A 22 22 GLU H H 22 9.350 7.951 1.399 1
1 231 . 7 1 1 A 22 22 GLU HA H 22 4.610 4.345 0.265 1
1 236 . 7 1 1 A 22 22 GLU C C 22 177.420 175.986 1.434 1
1 237 . 7 1 1 A 22 22 GLU CA C 22 53.700 55.706 -2.006 1
1 238 . 7 1 1 A 22 22 GLU CB C 22 32.000 29.312 2.688 1
1 240 . 7 1 1 A 22 22 GLU N N 22 116.770 118.244 -1.474 1
1 241 . 7 1 1 A 23 23 GLY H H 23 7.570 7.906 -0.336 1
1 242 . 7 1 1 A 23 23 GLY HA2 H 23 3.630 4.104 -0.474 1
1 243 . 7 1 1 A 23 23 GLY HA3 H 23 3.880 4.104 -0.224 1
1 244 . 7 1 1 A 23 23 GLY C C 23 173.980 172.192 1.788 1
1 245 . 7 1 1 A 23 23 GLY CA C 23 45.250 45.462 -0.212 1
1 246 . 7 1 1 A 23 23 GLY N N 23 112.180 108.630 3.550 1
1 247 . 7 1 1 A 24 24 ASP H H 24 8.680 8.499 0.181 1
1 248 . 7 1 1 A 24 24 ASP HA H 24 4.380 4.511 -0.131 1
1 251 . 7 1 1 A 24 24 ASP C C 24 178.590 177.574 1.016 1
1 252 . 7 1 1 A 24 24 ASP CA C 24 60.000 54.755 5.245 1
1 253 . 7 1 1 A 24 24 ASP CB C 24 27.480 42.202 -14.722 1
1 254 . 7 1 1 A 24 24 ASP N N 24 127.470 120.671 6.799 1
1 255 . 7 1 1 A 25 25 LYS H H 25 9.270 8.837 0.433 1
1 256 . 7 1 1 A 25 25 LYS HA H 25 4.250 4.078 0.172 1
1 265 . 7 1 1 A 25 25 LYS C C 25 177.030 176.607 0.423 1
1 266 . 7 1 1 A 25 25 LYS CA C 25 60.000 58.934 1.066 1
1 267 . 7 1 1 A 25 25 LYS CB C 25 31.170 32.134 -0.964 1
1 271 . 7 1 1 A 25 25 LYS N N 25 132.960 123.162 9.798 1
1 272 . 7 1 1 A 26 26 TYR H H 26 9.430 7.809 1.621 1
1 273 . 7 1 1 A 26 26 TYR HA H 26 4.640 4.796 -0.156 1
1 276 . 7 1 1 A 26 26 TYR C C 26 174.290 174.315 -0.025 1
1 277 . 7 1 1 A 26 26 TYR CA C 26 56.010 56.816 -0.806 1
1 278 . 7 1 1 A 26 26 TYR CB C 26 37.730 39.495 -1.765 1
1 279 . 7 1 1 A 26 26 TYR N N 26 120.650 120.313 0.337 1
1 280 . 7 1 1 A 27 27 LYS H H 27 7.110 7.349 -0.239 1
1 281 . 7 1 1 A 27 27 LYS HA H 27 5.110 4.895 0.215 1
1 290 . 7 1 1 A 27 27 LYS C C 27 175.150 173.832 1.318 1
1 291 . 7 1 1 A 27 27 LYS CA C 27 55.070 55.140 -0.070 1
1 292 . 7 1 1 A 27 27 LYS CB C 27 38.900 36.285 2.615 1
1 296 . 7 1 1 A 27 27 LYS N N 27 115.830 123.079 -7.249 1
1 297 . 7 1 1 A 28 28 LEU H H 28 9.820 8.547 1.273 1
1 298 . 7 1 1 A 28 28 LEU HA H 28 5.080 4.884 0.196 1
1 308 . 7 1 1 A 28 28 LEU C C 28 176.640 174.954 1.686 1
1 309 . 7 1 1 A 28 28 LEU CA C 28 52.660 53.958 -1.298 1
1 310 . 7 1 1 A 28 28 LEU CB C 28 42.710 44.378 -1.668 1
1 314 . 7 1 1 A 28 28 LEU N N 28 126.930 127.261 -0.331 1
1 315 . 7 1 1 A 29 29 SER H H 29 9.890 8.404 1.486 1
1 316 . 7 1 1 A 29 29 SER HA H 29 4.530 5.078 -0.548 1
1 319 . 7 1 1 A 29 29 SER C C 29 174.990 174.728 0.262 1
1 320 . 7 1 1 A 29 29 SER CA C 29 56.180 56.050 0.130 1
1 321 . 7 1 1 A 29 29 SER CB C 29 65.550 65.788 -0.238 1
1 322 . 7 1 1 A 29 29 SER N N 29 121.600 119.965 1.635 1
1 323 . 7 1 1 A 30 30 LYS H H 30 8.850 8.854 -0.004 1
1 324 . 7 1 1 A 30 30 LYS HA H 30 3.850 4.002 -0.152 1
1 333 . 7 1 1 A 30 30 LYS C C 30 175.620 177.604 -1.984 1
1 334 . 7 1 1 A 30 30 LYS CA C 30 60.860 60.014 0.846 1
1 335 . 7 1 1 A 30 30 LYS CB C 30 31.290 32.090 -0.800 1
1 339 . 7 1 1 A 30 30 LYS N N 30 121.260 126.940 -5.680 1
1 340 . 7 1 1 A 31 31 LYS H H 31 7.970 7.947 0.023 1
1 341 . 7 1 1 A 31 31 LYS HA H 31 3.880 4.052 -0.172 1
1 350 . 7 1 1 A 31 31 LYS C C 31 179.290 179.498 -0.208 1
1 351 . 7 1 1 A 31 31 LYS CA C 31 59.110 59.010 0.100 1
1 352 . 7 1 1 A 31 31 LYS CB C 31 32.640 31.857 0.783 1
1 356 . 7 1 1 A 31 31 LYS N N 31 121.260 118.793 2.467 1
1 357 . 7 1 1 A 32 32 GLU H H 32 7.510 7.997 -0.487 1
1 358 . 7 1 1 A 32 32 GLU HA H 32 3.830 4.068 -0.238 1
1 363 . 7 1 1 A 32 32 GLU C C 32 179.290 179.509 -0.219 1
1 364 . 7 1 1 A 32 32 GLU CA C 32 58.590 58.928 -0.338 1
1 365 . 7 1 1 A 32 32 GLU CB C 32 30.120 29.825 0.295 1
1 367 . 7 1 1 A 32 32 GLU N N 32 120.090 119.245 0.845 1
1 368 . 7 1 1 A 33 33 LEU H H 33 8.970 7.739 1.231 1
1 369 . 7 1 1 A 33 33 LEU HA H 33 3.830 3.700 0.130 1
1 379 . 7 1 1 A 33 33 LEU C C 33 178.200 178.684 -0.484 1
1 380 . 7 1 1 A 33 33 LEU CA C 33 57.930 57.992 -0.062 1
1 381 . 7 1 1 A 33 33 LEU CB C 33 40.660 41.493 -0.833 1
1 385 . 7 1 1 A 33 33 LEU N N 33 120.200 119.402 0.798 1
1 386 . 7 1 1 A 34 34 LYS H H 34 8.230 7.608 0.622 1
1 387 . 7 1 1 A 34 34 LYS HA H 34 3.550 3.856 -0.306 1
1 396 . 7 1 1 A 34 34 LYS C C 34 178.040 177.787 0.253 1
1 397 . 7 1 1 A 34 34 LYS CA C 34 60.720 59.738 0.982 1
1 398 . 7 1 1 A 34 34 LYS CB C 34 31.980 32.071 -0.091 1
1 402 . 7 1 1 A 34 34 LYS N N 34 120.780 119.029 1.751 1
1 403 . 7 1 1 A 35 35 ASP H H 35 7.990 7.718 0.272 1
1 404 . 7 1 1 A 35 35 ASP HA H 35 4.250 4.346 -0.096 1
1 407 . 7 1 1 A 35 35 ASP C C 35 179.060 178.109 0.951 1
1 408 . 7 1 1 A 35 35 ASP CA C 35 56.830 56.913 -0.083 1
1 409 . 7 1 1 A 35 35 ASP CB C 35 40.440 40.625 -0.185 1
1 410 . 7 1 1 A 35 35 ASP N N 35 119.550 119.588 -0.038 1
1 411 . 7 1 1 A 36 36 LEU H H 36 8.130 7.518 0.612 1
1 412 . 7 1 1 A 36 36 LEU HA H 36 2.580 3.253 -0.673 1
1 422 . 7 1 1 A 36 36 LEU C C 36 179.450 178.306 1.144 1
1 423 . 7 1 1 A 36 36 LEU CA C 36 59.980 57.856 2.124 1
1 424 . 7 1 1 A 36 36 LEU CB C 36 42.180 40.974 1.206 1
1 428 . 7 1 1 A 36 36 LEU N N 36 125.560 120.433 5.127 1
1 429 . 7 1 1 A 37 37 LEU H H 37 8.740 7.596 1.144 1
1 430 . 7 1 1 A 37 37 LEU HA H 37 3.580 3.903 -0.323 1
1 440 . 7 1 1 A 37 37 LEU C C 37 179.290 179.207 0.083 1
1 441 . 7 1 1 A 37 37 LEU CA C 37 58.230 57.968 0.262 1
1 442 . 7 1 1 A 37 37 LEU CB C 37 41.590 40.819 0.771 1
1 446 . 7 1 1 A 37 37 LEU N N 37 120.520 118.156 2.364 1
1 447 . 7 1 1 A 38 38 GLN H H 38 8.520 7.851 0.669 1
1 448 . 7 1 1 A 38 38 GLN HA H 38 4.000 4.017 -0.017 1
1 453 . 7 1 1 A 38 38 GLN C C 38 177.960 178.269 -0.309 1
1 454 . 7 1 1 A 38 38 GLN CA C 38 58.210 58.174 0.036 1
1 455 . 7 1 1 A 38 38 GLN CB C 38 28.650 28.000 0.650 1
1 457 . 7 1 1 A 38 38 GLN N N 38 116.740 117.963 -1.223 1
1 458 . 7 1 1 A 39 39 THR H H 39 7.910 7.593 0.317 1
1 459 . 7 1 1 A 39 39 THR HA H 39 4.210 3.857 0.353 1
1 464 . 7 1 1 A 39 39 THR C C 39 177.180 175.687 1.493 1
1 465 . 7 1 1 A 39 39 THR CA C 39 64.730 67.079 -2.349 1
1 466 . 7 1 1 A 39 39 THR CB C 39 69.650 68.744 0.906 1
1 468 . 7 1 1 A 39 39 THR N N 39 111.400 116.740 -5.340 1
1 469 . 7 1 1 A 40 40 GLU H H 40 8.590 7.797 0.793 1
1 470 . 7 1 1 A 40 40 GLU HA H 40 4.680 4.422 0.258 1
1 475 . 7 1 1 A 40 40 GLU C C 40 178.280 176.646 1.634 1
1 476 . 7 1 1 A 40 40 GLU CA C 40 55.880 56.632 -0.752 1
1 477 . 7 1 1 A 40 40 GLU CB C 40 30.990 30.930 0.060 1
1 479 . 7 1 1 A 40 40 GLU N N 40 117.840 116.699 1.141 1
1 480 . 7 1 1 A 41 41 LEU H H 41 7.680 8.091 -0.411 1
1 481 . 7 1 1 A 41 41 LEU HA H 41 5.080 4.664 0.416 1
1 491 . 7 1 1 A 41 41 LEU C C 41 179.450 176.373 3.077 1
1 492 . 7 1 1 A 41 41 LEU CA C 41 53.830 53.541 0.289 1
1 493 . 7 1 1 A 41 41 LEU CB C 41 41.360 42.601 -1.241 1
1 497 . 7 1 1 A 41 41 LEU N N 41 121.410 119.959 1.451 1
1 498 . 7 1 1 A 42 42 SER H H 42 8.380 8.408 -0.028 1
1 499 . 7 1 1 A 42 42 SER HA H 42 4.130 4.384 -0.254 1
1 502 . 7 1 1 A 42 42 SER C C 42 176.640 176.255 0.385 1
1 503 . 7 1 1 A 42 42 SER CA C 42 61.280 60.838 0.442 1
1 504 . 7 1 1 A 42 42 SER CB C 42 63.040 63.294 -0.254 1
1 505 . 7 1 1 A 42 42 SER N N 42 117.420 116.269 1.151 1
1 506 . 7 1 1 A 43 43 SER H H 43 8.900 8.189 0.711 1
1 507 . 7 1 1 A 43 43 SER HA H 43 4.290 4.486 -0.196 1
1 510 . 7 1 1 A 43 43 SER C C 43 175.620 175.526 0.094 1
1 511 . 7 1 1 A 43 43 SER CA C 43 60.860 61.284 -0.424 1
1 512 . 7 1 1 A 43 43 SER CB C 43 62.910 63.356 -0.446 1
1 513 . 7 1 1 A 43 43 SER N N 43 117.580 117.477 0.103 1
1 514 . 7 1 1 A 44 44 PHE H H 44 7.880 8.154 -0.274 1
1 515 . 7 1 1 A 44 44 PHE HA H 44 4.240 4.634 -0.394 1
1 518 . 7 1 1 A 44 44 PHE C C 44 176.950 174.987 1.963 1
1 519 . 7 1 1 A 44 44 PHE CA C 44 62.710 59.443 3.267 1
1 520 . 7 1 1 A 44 44 PHE CB C 44 39.020 39.032 -0.012 1
1 521 . 7 1 1 A 44 44 PHE N N 44 119.480 121.876 -2.396 1
1 522 . 7 1 1 A 45 45 LEU H H 45 8.060 8.350 -0.290 1
1 523 . 7 1 1 A 45 45 LEU HA H 45 3.810 4.088 -0.278 1
1 533 . 7 1 1 A 45 45 LEU C C 45 177.500 176.251 1.249 1
1 534 . 7 1 1 A 45 45 LEU CA C 45 59.980 56.051 3.929 1
1 535 . 7 1 1 A 45 45 LEU CB C 45 39.640 42.333 -2.693 1
1 538 . 7 1 1 A 45 45 LEU N N 45 118.010 122.520 -4.510 1
1 539 . 7 1 1 A 46 46 ASP H H 46 8.150 8.467 -0.317 1
1 540 . 7 1 1 A 46 46 ASP HA H 46 4.470 4.653 -0.183 1
1 543 . 7 1 1 A 46 46 ASP C C 46 179.920 176.151 3.769 1
1 544 . 7 1 1 A 46 46 ASP CA C 46 52.950 54.185 -1.235 1
1 545 . 7 1 1 A 46 46 ASP CB C 46 40.000 41.215 -1.215 1
1 546 . 7 1 1 A 46 46 ASP N N 46 119.460 125.302 -5.842 1
1 547 . 7 1 1 A 47 47 VAL H H 47 8.010 8.569 -0.559 1
1 548 . 7 1 1 A 47 47 VAL HA H 47 3.800 4.364 -0.564 1
1 556 . 7 1 1 A 47 47 VAL C C 47 175.460 176.864 -1.404 1
1 557 . 7 1 1 A 47 47 VAL CA C 47 60.000 62.830 -2.830 1
1 558 . 7 1 1 A 47 47 VAL CB C 47 31.580 33.407 -1.827 1
1 561 . 7 1 1 A 47 47 VAL N N 47 117.720 117.707 0.013 1
1 562 . 7 1 1 A 48 48 GLN H H 48 7.960 8.411 -0.451 1
1 563 . 7 1 1 A 48 48 GLN HA H 48 4.060 4.394 -0.334 1
1 568 . 7 1 1 A 48 48 GLN C C 48 179.370 177.682 1.688 1
1 569 . 7 1 1 A 48 48 GLN CA C 48 57.350 57.648 -0.298 1
1 570 . 7 1 1 A 48 48 GLN CB C 48 28.990 29.352 -0.362 1
1 572 . 7 1 1 A 48 48 GLN N N 48 119.900 121.862 -1.962 1
1 573 . 7 1 1 A 49 49 LYS H H 49 7.810 8.195 -0.385 1
1 574 . 7 1 1 A 49 49 LYS HA H 49 3.860 4.120 -0.260 1
1 583 . 7 1 1 A 49 49 LYS C C 49 177.890 176.366 1.524 1
1 584 . 7 1 1 A 49 49 LYS CA C 49 58.230 59.177 -0.947 1
1 585 . 7 1 1 A 49 49 LYS CB C 49 30.990 32.118 -1.128 1
1 587 . 7 1 1 A 49 49 LYS N N 49 120.030 118.581 1.449 1
1 588 . 7 1 1 A 50 50 ASP H H 50 7.570 8.025 -0.455 1
1 589 . 7 1 1 A 50 50 ASP HA H 50 4.700 4.753 -0.053 1
1 590 . 7 1 1 A 50 50 ASP CA C 50 52.950 52.814 0.136 1
1 591 . 7 1 1 A 50 50 ASP CB C 50 38.900 40.495 -1.595 1
1 592 . 7 1 1 A 50 50 ASP N N 50 116.730 119.476 -2.746 1
1 593 . 7 1 1 A 51 51 ALA H H 51 7.570 8.751 -1.181 1
1 594 . 7 1 1 A 51 51 ALA HA H 51 4.200 3.953 0.247 1
1 598 . 7 1 1 A 51 51 ALA C C 51 179.760 179.343 0.417 1
1 599 . 7 1 1 A 51 51 ALA CA C 51 54.200 55.499 -1.299 1
1 600 . 7 1 1 A 51 51 ALA CB C 51 18.110 18.330 -0.220 1
1 601 . 7 1 1 A 51 51 ALA N N 51 118.390 128.398 -10.008 1
1 602 . 7 1 1 A 52 52 ASP H H 52 8.430 8.020 0.410 1
1 603 . 7 1 1 A 52 52 ASP HA H 52 4.600 4.351 0.249 1
1 606 . 7 1 1 A 52 52 ASP C C 52 177.570 178.475 -0.905 1
1 607 . 7 1 1 A 52 52 ASP CA C 52 54.420 56.788 -2.368 1
1 608 . 7 1 1 A 52 52 ASP CB C 52 40.360 40.063 0.297 1
1 609 . 7 1 1 A 52 52 ASP N N 52 117.530 119.739 -2.209 1
1 610 . 7 1 1 A 53 53 ALA H H 53 7.660 7.552 0.108 1
1 611 . 7 1 1 A 53 53 ALA HA H 53 3.860 4.000 -0.140 1
1 615 . 7 1 1 A 53 53 ALA C C 53 180.070 180.320 -0.250 1
1 616 . 7 1 1 A 53 53 ALA CA C 53 55.590 55.219 0.371 1
1 617 . 7 1 1 A 53 53 ALA CB C 53 18.800 18.163 0.637 1
1 618 . 7 1 1 A 53 53 ALA N N 53 123.450 122.631 0.819 1
1 619 . 7 1 1 A 54 54 VAL H H 54 8.030 7.688 0.342 1
1 620 . 7 1 1 A 54 54 VAL HA H 54 3.240 3.725 -0.485 1
1 628 . 7 1 1 A 54 54 VAL C C 54 177.340 177.316 0.024 1
1 629 . 7 1 1 A 54 54 VAL CA C 54 66.620 65.566 1.054 1
1 630 . 7 1 1 A 54 54 VAL CB C 54 30.480 30.959 -0.479 1
1 633 . 7 1 1 A 54 54 VAL N N 54 116.150 117.075 -0.925 1
1 634 . 7 1 1 A 55 55 ASP H H 55 7.660 7.983 -0.323 1
1 635 . 7 1 1 A 55 55 ASP HA H 55 4.080 4.296 -0.216 1
1 638 . 7 1 1 A 55 55 ASP C C 55 177.260 178.582 -1.322 1
1 639 . 7 1 1 A 55 55 ASP CA C 55 57.640 57.592 0.048 1
1 640 . 7 1 1 A 55 55 ASP CB C 55 40.360 41.737 -1.377 1
1 641 . 7 1 1 A 55 55 ASP N N 55 120.830 121.458 -0.628 1
1 642 . 7 1 1 A 56 56 LYS H H 56 7.780 7.544 0.236 1
1 643 . 7 1 1 A 56 56 LYS HA H 56 3.860 4.002 -0.142 1
1 652 . 7 1 1 A 56 56 LYS C C 56 179.530 179.541 -0.011 1
1 653 . 7 1 1 A 56 56 LYS CA C 56 59.690 59.656 0.034 1
1 654 . 7 1 1 A 56 56 LYS CB C 56 31.870 32.487 -0.617 1
1 658 . 7 1 1 A 56 56 LYS N N 56 120.010 118.366 1.644 1
1 659 . 7 1 1 A 57 57 ILE H H 57 8.090 7.846 0.244 1
1 660 . 7 1 1 A 57 57 ILE HA H 57 3.390 3.539 -0.149 1
1 670 . 7 1 1 A 57 57 ILE C C 57 176.710 177.645 -0.935 1
1 671 . 7 1 1 A 57 57 ILE CA C 57 64.960 65.156 -0.196 1
1 672 . 7 1 1 A 57 57 ILE CB C 57 38.080 38.339 -0.259 1
1 676 . 7 1 1 A 57 57 ILE N N 57 120.960 120.557 0.403 1
1 677 . 7 1 1 A 58 58 MET H H 58 8.480 8.310 0.170 1
1 678 . 7 1 1 A 58 58 MET HA H 58 3.800 4.047 -0.247 1
1 686 . 7 1 1 A 58 58 MET C C 58 177.570 178.010 -0.440 1
1 687 . 7 1 1 A 58 58 MET CA C 58 58.570 58.527 0.043 1
1 688 . 7 1 1 A 58 58 MET CB C 58 32.570 32.059 0.511 1
1 691 . 7 1 1 A 58 58 MET N N 58 119.160 120.787 -1.627 1
1 692 . 7 1 1 A 59 59 LYS H H 59 7.550 7.894 -0.344 1
1 693 . 7 1 1 A 59 59 LYS HA H 59 3.930 3.955 -0.025 1
1 702 . 7 1 1 A 59 59 LYS C C 59 179.530 179.225 0.305 1
1 703 . 7 1 1 A 59 59 LYS CA C 59 58.820 59.750 -0.930 1
1 704 . 7 1 1 A 59 59 LYS CB C 59 32.450 32.493 -0.043 1
1 708 . 7 1 1 A 59 59 LYS N N 59 116.730 120.298 -3.568 1
1 709 . 7 1 1 A 60 60 GLU H H 60 7.470 7.923 -0.453 1
1 710 . 7 1 1 A 60 60 GLU HA H 60 4.050 4.038 0.012 1
1 715 . 7 1 1 A 60 60 GLU C C 60 178.950 177.823 1.127 1
1 716 . 7 1 1 A 60 60 GLU CA C 60 58.600 58.889 -0.289 1
1 717 . 7 1 1 A 60 60 GLU CB C 60 31.700 29.337 2.363 1
1 719 . 7 1 1 A 60 60 GLU N N 60 116.820 119.514 -2.694 1
1 720 . 7 1 1 A 61 61 LEU H H 61 8.030 7.535 0.495 1
1 721 . 7 1 1 A 61 61 LEU HA H 61 4.310 4.235 0.075 1
1 731 . 7 1 1 A 61 61 LEU C C 61 179.450 177.136 2.314 1
1 732 . 7 1 1 A 61 61 LEU CA C 61 54.840 55.773 -0.933 1
1 733 . 7 1 1 A 61 61 LEU CB C 61 43.820 42.338 1.482 1
1 737 . 7 1 1 A 61 61 LEU N N 61 116.000 117.961 -1.961 1
1 738 . 7 1 1 A 62 62 ASP H H 62 7.890 8.375 -0.485 1
1 739 . 7 1 1 A 62 62 ASP HA H 62 4.660 4.894 -0.234 1
1 742 . 7 1 1 A 62 62 ASP C C 62 177.030 176.250 0.780 1
1 743 . 7 1 1 A 62 62 ASP CA C 62 53.660 53.430 0.230 1
1 744 . 7 1 1 A 62 62 ASP CB C 62 38.700 39.212 -0.512 1
1 745 . 7 1 1 A 62 62 ASP N N 62 117.550 118.450 -0.900 1
1 746 . 7 1 1 A 63 63 GLU H H 63 8.430 9.320 -0.890 1
1 747 . 7 1 1 A 63 63 GLU HA H 63 4.020 4.016 0.004 1
1 752 . 7 1 1 A 63 63 GLU C C 63 178.120 178.969 -0.849 1
1 753 . 7 1 1 A 63 63 GLU CA C 63 58.470 59.217 -0.747 1
1 754 . 7 1 1 A 63 63 GLU CB C 63 30.120 29.397 0.723 1
1 756 . 7 1 1 A 63 63 GLU N N 63 130.230 120.496 9.734 1
1 757 . 7 1 1 A 64 64 ASN H H 64 8.010 8.100 -0.090 1
1 758 . 7 1 1 A 64 64 ASN HA H 64 4.680 4.685 -0.005 1
1 761 . 7 1 1 A 64 64 ASN C C 64 177.100 176.027 1.073 1
1 762 . 7 1 1 A 64 64 ASN CA C 64 51.780 53.279 -1.499 1
1 763 . 7 1 1 A 64 64 ASN CB C 64 37.260 38.932 -1.672 1
1 764 . 7 1 1 A 64 64 ASN N N 64 113.640 115.626 -1.986 1
1 765 . 7 1 1 A 65 65 GLY H H 65 7.550 7.887 -0.337 1
1 766 . 7 1 1 A 65 65 GLY HA2 H 65 3.770 3.982 -0.212 1
1 767 . 7 1 1 A 65 65 GLY HA3 H 65 3.770 3.982 -0.212 1
1 768 . 7 1 1 A 65 65 GLY C C 65 178.980 174.987 3.993 1
1 769 . 7 1 1 A 65 65 GLY CA C 65 47.200 46.420 0.780 1
1 770 . 7 1 1 A 65 65 GLY N N 65 113.640 107.517 6.123 1
1 771 . 7 1 1 A 66 66 ASP H H 66 8.110 8.072 0.038 1
1 772 . 7 1 1 A 66 66 ASP HA H 66 4.490 4.583 -0.093 1
1 775 . 7 1 1 A 66 66 ASP C C 66 177.960 177.533 0.427 1
1 776 . 7 1 1 A 66 66 ASP CA C 66 52.960 53.441 -0.481 1
1 777 . 7 1 1 A 66 66 ASP CB C 66 40.540 40.489 0.051 1
1 778 . 7 1 1 A 66 66 ASP N N 66 120.030 120.316 -0.286 1
1 779 . 7 1 1 A 67 67 GLY H H 67 10.260 9.546 0.714 1
1 780 . 7 1 1 A 67 67 GLY HA2 H 67 3.360 3.867 -0.507 1
1 781 . 7 1 1 A 67 67 GLY HA3 H 67 4.000 3.868 0.132 1
1 782 . 7 1 1 A 67 67 GLY C C 67 173.120 173.391 -0.271 1
1 783 . 7 1 1 A 67 67 GLY CA C 67 45.460 45.794 -0.334 1
1 784 . 7 1 1 A 67 67 GLY N N 67 114.100 111.032 3.068 1
1 785 . 7 1 1 A 68 68 GLU H H 68 7.750 8.144 -0.394 1
1 786 . 7 1 1 A 68 68 GLU HA H 68 4.780 4.958 -0.178 1
1 791 . 7 1 1 A 68 68 GLU C C 68 175.930 174.963 0.967 1
1 792 . 7 1 1 A 68 68 GLU CA C 68 54.430 54.402 0.028 1
1 793 . 7 1 1 A 68 68 GLU CB C 68 35.850 33.688 2.162 1
1 795 . 7 1 1 A 68 68 GLU N N 68 118.000 119.249 -1.249 1
1 796 . 7 1 1 A 69 69 VAL H H 69 9.380 8.527 0.853 1
1 797 . 7 1 1 A 69 69 VAL HA H 69 5.260 4.920 0.340 1
1 805 . 7 1 1 A 69 69 VAL C C 69 176.710 174.579 2.131 1
1 806 . 7 1 1 A 69 69 VAL CA C 69 61.280 60.534 0.746 1
1 807 . 7 1 1 A 69 69 VAL CB C 69 33.980 36.011 -2.031 1
1 810 . 7 1 1 A 69 69 VAL N N 69 125.970 120.708 5.262 1
1 811 . 7 1 1 A 70 70 ASP H H 70 9.100 8.881 0.219 1
1 812 . 7 1 1 A 70 70 ASP HA H 70 5.190 4.866 0.324 1
1 815 . 7 1 1 A 70 70 ASP C C 70 175.700 177.997 -2.297 1
1 816 . 7 1 1 A 70 70 ASP CA C 70 52.370 53.093 -0.723 1
1 817 . 7 1 1 A 70 70 ASP CB C 70 40.950 41.916 -0.966 1
1 818 . 7 1 1 A 70 70 ASP N N 70 130.320 126.131 4.189 1
1 819 . 7 1 1 A 71 71 PHE H H 71 9.090 8.994 0.096 1
1 820 . 7 1 1 A 71 71 PHE HA H 71 4.100 3.959 0.141 1
1 823 . 7 1 1 A 71 71 PHE C C 71 177.000 177.688 -0.688 1
1 824 . 7 1 1 A 71 71 PHE CA C 71 58.230 62.027 -3.797 1
1 825 . 7 1 1 A 71 71 PHE CB C 71 36.910 39.191 -2.281 1
1 826 . 7 1 1 A 71 71 PHE N N 71 119.760 123.162 -3.402 1
1 827 . 7 1 1 A 72 72 GLN H H 72 8.440 8.341 0.099 1
1 828 . 7 1 1 A 72 72 GLN HA H 72 3.600 3.885 -0.285 1
1 831 . 7 1 1 A 72 72 GLN C C 72 178.820 178.193 0.627 1
1 832 . 7 1 1 A 72 72 GLN CA C 72 59.500 58.587 0.913 1
1 833 . 7 1 1 A 72 72 GLN CB C 72 29.553 28.201 1.352 1
1 835 . 7 1 1 A 72 72 GLN N N 72 121.820 117.878 3.942 1
1 836 . 7 1 1 A 73 73 GLU H H 73 8.290 7.844 0.446 1
1 837 . 7 1 1 A 73 73 GLU HA H 73 4.070 4.053 0.017 1
1 842 . 7 1 1 A 73 73 GLU C C 73 179.370 178.941 0.429 1
1 843 . 7 1 1 A 73 73 GLU CA C 73 58.030 58.722 -0.692 1
1 844 . 7 1 1 A 73 73 GLU CB C 73 29.530 30.099 -0.569 1
1 846 . 7 1 1 A 73 73 GLU N N 73 120.550 118.906 1.644 1
1 847 . 7 1 1 A 74 74 PHE H H 74 8.630 8.173 0.457 1
1 848 . 7 1 1 A 74 74 PHE HA H 74 4.020 4.104 -0.084 1
1 851 . 7 1 1 A 74 74 PHE C C 74 177.890 176.784 1.106 1
1 852 . 7 1 1 A 74 74 PHE CA C 74 60.090 60.888 -0.798 1
1 853 . 7 1 1 A 74 74 PHE CB C 74 38.020 38.924 -0.904 1
1 854 . 7 1 1 A 74 74 PHE N N 74 121.010 121.764 -0.754 1
1 855 . 7 1 1 A 75 75 VAL H H 75 8.080 8.059 0.021 1
1 856 . 7 1 1 A 75 75 VAL HA H 75 2.860 3.319 -0.459 1
1 864 . 7 1 1 A 75 75 VAL C C 75 177.030 178.219 -1.189 1
1 865 . 7 1 1 A 75 75 VAL CA C 75 66.430 66.426 0.004 1
1 866 . 7 1 1 A 75 75 VAL CB C 75 30.600 30.692 -0.092 1
1 869 . 7 1 1 A 75 75 VAL N N 75 119.460 119.280 0.180 1
1 870 . 7 1 1 A 76 76 VAL H H 76 7.100 8.062 -0.962 1
1 871 . 7 1 1 A 76 76 VAL HA H 76 3.330 3.463 -0.133 1
1 879 . 7 1 1 A 76 76 VAL C C 76 178.670 177.712 0.958 1
1 880 . 7 1 1 A 76 76 VAL CA C 76 67.000 66.681 0.319 1
1 881 . 7 1 1 A 76 76 VAL CB C 76 31.280 31.357 -0.077 1
1 884 . 7 1 1 A 76 76 VAL N N 76 121.030 120.092 0.938 1
1 885 . 7 1 1 A 77 77 LEU H H 77 6.900 7.623 -0.723 1
1 886 . 7 1 1 A 77 77 LEU HA H 77 3.800 3.862 -0.062 1
1 896 . 7 1 1 A 77 77 LEU C C 77 177.960 178.262 -0.302 1
1 897 . 7 1 1 A 77 77 LEU CA C 77 57.710 58.202 -0.492 1
1 898 . 7 1 1 A 77 77 LEU CB C 77 40.070 41.596 -1.526 1
1 902 . 7 1 1 A 77 77 LEU N N 77 120.310 120.610 -0.300 1
1 903 . 7 1 1 A 78 78 VAL H H 78 7.240 7.937 -0.697 1
1 904 . 7 1 1 A 78 78 VAL HA H 78 3.030 3.935 -0.905 1
1 912 . 7 1 1 A 78 78 VAL C C 78 179.600 177.983 1.617 1
1 913 . 7 1 1 A 78 78 VAL CA C 78 66.420 65.041 1.379 1
1 914 . 7 1 1 A 78 78 VAL CB C 78 30.700 31.612 -0.912 1
1 917 . 7 1 1 A 78 78 VAL N N 78 117.180 116.489 0.691 1
1 918 . 7 1 1 A 79 79 ALA H H 79 9.000 8.123 0.877 1
1 919 . 7 1 1 A 79 79 ALA HA H 79 3.610 3.979 -0.369 1
1 923 . 7 1 1 A 79 79 ALA C C 79 182.260 179.989 2.271 1
1 924 . 7 1 1 A 79 79 ALA CA C 79 55.580 55.462 0.118 1
1 925 . 7 1 1 A 79 79 ALA CB C 79 18.400 18.027 0.373 1
1 926 . 7 1 1 A 79 79 ALA N N 79 126.000 124.936 1.064 1
1 927 . 7 1 1 A 80 80 ALA H H 80 8.000 7.894 0.106 1
1 928 . 7 1 1 A 80 80 ALA HA H 80 4.100 4.080 0.020 1
1 932 . 7 1 1 A 80 80 ALA C C 80 175.460 180.239 -4.779 1
1 933 . 7 1 1 A 80 80 ALA CA C 80 56.020 54.805 1.215 1
1 934 . 7 1 1 A 80 80 ALA CB C 80 18.040 18.577 -0.537 1
1 935 . 7 1 1 A 80 80 ALA N N 80 120.730 120.878 -0.148 1
1 936 . 7 1 1 A 81 81 LEU H H 81 8.460 7.900 0.560 1
1 937 . 7 1 1 A 81 81 LEU HA H 81 4.000 4.084 -0.084 1
1 941 . 7 1 1 A 81 81 LEU C C 81 177.030 179.296 -2.266 1
1 942 . 7 1 1 A 81 81 LEU CA C 81 57.640 57.796 -0.156 1
1 943 . 7 1 1 A 81 81 LEU CB C 81 40.620 41.722 -1.102 1
1 945 . 7 1 1 A 81 81 LEU N N 81 119.890 120.254 -0.364 1
1 946 . 7 1 1 A 82 82 THR H H 82 8.320 7.791 0.529 1
1 947 . 7 1 1 A 82 82 THR HA H 82 3.800 4.018 -0.218 1
1 952 . 7 1 1 A 82 82 THR C C 82 181.010 176.975 4.035 1
1 953 . 7 1 1 A 82 82 THR CA C 82 68.500 66.153 2.347 1
1 954 . 7 1 1 A 82 82 THR CB C 82 67.400 68.842 -1.442 1
1 956 . 7 1 1 A 82 82 THR N N 82 117.120 112.953 4.167 1
1 957 . 7 1 1 A 83 83 VAL H H 83 8.530 7.516 1.014 1
1 958 . 7 1 1 A 83 83 VAL HA H 83 3.890 3.848 0.042 1
1 966 . 7 1 1 A 83 83 VAL C C 83 178.120 178.229 -0.109 1
1 967 . 7 1 1 A 83 83 VAL CA C 83 67.400 65.154 2.246 1
1 968 . 7 1 1 A 83 83 VAL CB C 83 31.590 31.641 -0.051 1
1 971 . 7 1 1 A 83 83 VAL N N 83 119.760 118.113 1.647 1
1 972 . 7 1 1 A 84 84 ALA H H 84 7.910 8.189 -0.279 1
1 973 . 7 1 1 A 84 84 ALA HA H 84 4.060 4.133 -0.073 1
1 977 . 7 1 1 A 84 84 ALA C C 84 180.560 179.807 0.753 1
1 978 . 7 1 1 A 84 84 ALA CA C 84 55.000 55.151 -0.151 1
1 979 . 7 1 1 A 84 84 ALA CB C 84 17.230 18.178 -0.948 1
1 980 . 7 1 1 A 84 84 ALA N N 84 122.620 124.510 -1.890 1
1 981 . 7 1 1 A 85 85 CYS H H 85 8.580 7.922 0.658 1
1 982 . 7 1 1 A 85 85 CYS HA H 85 4.080 4.532 -0.452 1
1 985 . 7 1 1 A 85 85 CYS C C 85 179.060 177.090 1.970 1
1 986 . 7 1 1 A 85 85 CYS CA C 85 63.210 61.549 1.661 1
1 987 . 7 1 1 A 85 85 CYS CB C 85 26.310 27.470 -1.160 1
1 988 . 7 1 1 A 85 85 CYS N N 85 118.730 117.362 1.368 1
1 989 . 7 1 1 A 86 86 ASN H H 86 8.430 8.142 0.288 1
1 990 . 7 1 1 A 86 86 ASN CA C 86 55.860 56.862 -1.002 1
1 991 . 7 1 1 A 86 86 ASN CB C 86 37.440 39.660 -2.220 1
1 992 . 7 1 1 A 86 86 ASN N N 86 119.360 119.286 0.074 1
1 993 . 7 1 1 A 87 87 ASN H H 87 7.880 8.025 -0.145 1
1 994 . 7 1 1 A 87 87 ASN HA H 87 4.600 4.644 -0.044 1
1 997 . 7 1 1 A 87 87 ASN C C 87 178.510 177.479 1.031 1
1 998 . 7 1 1 A 87 87 ASN CA C 87 56.470 56.432 0.038 1
1 999 . 7 1 1 A 87 87 ASN CB C 87 37.500 39.385 -1.885 1
1 1000 . 7 1 1 A 87 87 ASN N N 87 119.480 117.439 2.041 1
1 1001 . 7 1 1 A 88 88 PHE H H 88 8.050 7.655 0.395 1
1 1002 . 7 1 1 A 88 88 PHE HA H 88 4.200 4.323 -0.123 1
1 1005 . 7 1 1 A 88 88 PHE C C 88 178.510 177.335 1.175 1
1 1006 . 7 1 1 A 88 88 PHE CA C 88 56.460 59.771 -3.311 1
1 1007 . 7 1 1 A 88 88 PHE CB C 88 38.500 39.684 -1.184 1
1 1008 . 7 1 1 A 88 88 PHE N N 88 120.280 120.027 0.253 1
1 1009 . 7 1 1 A 89 89 PHE H H 89 8.020 8.110 -0.090 1
1 1010 . 7 1 1 A 89 89 PHE HA H 89 4.000 4.080 -0.080 1
1 1013 . 7 1 1 A 89 89 PHE C C 89 177.340 177.153 0.187 1
1 1014 . 7 1 1 A 89 89 PHE CA C 89 59.000 60.557 -1.557 1
1 1015 . 7 1 1 A 89 89 PHE CB C 89 37.430 38.994 -1.564 1
1 1016 . 7 1 1 A 89 89 PHE N N 89 120.910 119.310 1.600 1
1 1017 . 7 1 1 A 90 90 TRP H H 90 7.800 7.405 0.395 1
1 1018 . 7 1 1 A 90 90 TRP HA H 90 4.460 4.537 -0.077 1
1 1021 . 7 1 1 A 90 90 TRP C C 90 177.340 178.136 -0.796 1
1 1022 . 7 1 1 A 90 90 TRP CA C 90 57.930 60.126 -2.196 1
1 1023 . 7 1 1 A 90 90 TRP CB C 90 42.000 29.484 12.516 1
1 1024 . 7 1 1 A 90 90 TRP N N 90 120.050 115.883 4.167 1
1 1025 . 7 1 1 A 91 91 GLU H H 91 7.800 8.663 -0.863 1
1 1026 . 7 1 1 A 91 91 GLU HA H 91 4.050 3.825 0.225 1
1 1031 . 7 1 1 A 91 91 GLU C C 91 177.570 177.820 -0.250 1
1 1032 . 7 1 1 A 91 91 GLU CA C 91 57.350 59.976 -2.626 1
1 1033 . 7 1 1 A 91 91 GLU CB C 91 29.530 29.055 0.475 1
1 1035 . 7 1 1 A 91 91 GLU N N 91 120.730 120.547 0.183 1
1 1036 . 7 1 1 A 92 92 ASN H H 92 7.800 7.491 0.309 1
1 1037 . 7 1 1 A 92 92 ASN HA H 92 4.630 4.708 -0.078 1
1 1040 . 7 1 1 A 92 92 ASN C C 92 174.450 174.729 -0.279 1
1 1041 . 7 1 1 A 92 92 ASN CA C 92 52.960 52.358 0.602 1
1 1042 . 7 1 1 A 92 92 ASN CB C 92 29.530 38.528 -8.998 1
1 1043 . 7 1 1 A 92 92 ASN N N 92 119.410 116.365 3.045 1
1 5 . 8 1 1 A 2 2 SER H H 2 9.000 8.365 0.635 1
1 6 . 8 1 1 A 2 2 SER HA H 2 4.690 4.702 -0.012 1
1 9 . 8 1 1 A 2 2 SER C C 2 176.170 175.766 0.404 1
1 10 . 8 1 1 A 2 2 SER CA C 2 57.340 57.624 -0.284 1
1 11 . 8 1 1 A 2 2 SER CB C 2 65.550 65.499 0.051 1
1 12 . 8 1 1 A 2 2 SER N N 2 119.330 113.350 5.980 1
1 13 . 8 1 1 A 3 3 GLU H H 3 9.350 9.083 0.267 1
1 14 . 8 1 1 A 3 3 GLU HA H 3 4.060 4.040 0.020 1
1 17 . 8 1 1 A 3 3 GLU C C 3 180.150 178.369 1.781 1
1 18 . 8 1 1 A 3 3 GLU CA C 3 60.280 59.342 0.938 1
1 19 . 8 1 1 A 3 3 GLU CB C 3 29.230 29.404 -0.174 1
1 21 . 8 1 1 A 3 3 GLU N N 3 125.350 120.736 4.614 1
1 22 . 8 1 1 A 4 4 LEU H H 4 9.060 8.342 0.718 1
1 23 . 8 1 1 A 4 4 LEU HA H 4 4.080 4.004 0.076 1
1 33 . 8 1 1 A 4 4 LEU C C 4 177.890 179.365 -1.475 1
1 34 . 8 1 1 A 4 4 LEU CA C 4 58.090 58.147 -0.057 1
1 35 . 8 1 1 A 4 4 LEU CB C 4 42.120 41.596 0.524 1
1 39 . 8 1 1 A 4 4 LEU N N 4 121.090 120.407 0.683 1
1 40 . 8 1 1 A 5 5 GLU H H 5 8.340 8.119 0.221 1
1 41 . 8 1 1 A 5 5 GLU HA H 5 4.050 4.065 -0.015 1
1 46 . 8 1 1 A 5 5 GLU C C 5 177.030 179.430 -2.400 1
1 47 . 8 1 1 A 5 5 GLU CA C 5 59.840 59.467 0.373 1
1 48 . 8 1 1 A 5 5 GLU CB C 5 28.940 29.259 -0.319 1
1 50 . 8 1 1 A 5 5 GLU N N 5 119.780 120.724 -0.944 1
1 51 . 8 1 1 A 6 6 THR H H 6 8.370 8.462 -0.092 1
1 52 . 8 1 1 A 6 6 THR HA H 6 4.310 3.914 0.396 1
1 57 . 8 1 1 A 6 6 THR C C 6 177.340 176.798 0.542 1
1 58 . 8 1 1 A 6 6 THR CA C 6 66.630 66.415 0.215 1
1 59 . 8 1 1 A 6 6 THR CB C 6 68.650 68.624 0.026 1
1 61 . 8 1 1 A 6 6 THR N N 6 116.940 117.274 -0.334 1
1 62 . 8 1 1 A 7 7 ALA H H 7 8.270 7.879 0.391 1
1 63 . 8 1 1 A 7 7 ALA HA H 7 4.190 4.075 0.115 1
1 67 . 8 1 1 A 7 7 ALA C C 7 179.760 179.467 0.293 1
1 68 . 8 1 1 A 7 7 ALA CA C 7 55.880 55.214 0.666 1
1 69 . 8 1 1 A 7 7 ALA CB C 7 17.720 18.122 -0.402 1
1 70 . 8 1 1 A 7 7 ALA N N 7 127.400 124.004 3.396 1
1 71 . 8 1 1 A 8 8 MET H H 8 8.110 7.682 0.428 1
1 72 . 8 1 1 A 8 8 MET HA H 8 4.020 4.241 -0.221 1
1 80 . 8 1 1 A 8 8 MET C C 8 178.510 178.245 0.265 1
1 81 . 8 1 1 A 8 8 MET CA C 8 60.580 58.130 2.450 1
1 82 . 8 1 1 A 8 8 MET CB C 8 33.630 32.220 1.410 1
1 85 . 8 1 1 A 8 8 MET N N 8 117.520 118.431 -0.911 1
1 86 . 8 1 1 A 9 9 GLU H H 9 8.210 7.779 0.431 1
1 87 . 8 1 1 A 9 9 GLU HA H 9 3.830 4.175 -0.345 1
1 92 . 8 1 1 A 9 9 GLU C C 9 179.140 178.675 0.465 1
1 93 . 8 1 1 A 9 9 GLU CA C 9 59.690 59.248 0.442 1
1 94 . 8 1 1 A 9 9 GLU CB C 9 29.530 29.240 0.290 1
1 96 . 8 1 1 A 9 9 GLU N N 9 118.560 118.302 0.258 1
1 97 . 8 1 1 A 10 10 THR H H 10 8.490 7.586 0.904 1
1 98 . 8 1 1 A 10 10 THR HA H 10 4.000 4.115 -0.115 1
1 103 . 8 1 1 A 10 10 THR C C 10 176.010 176.309 -0.299 1
1 104 . 8 1 1 A 10 10 THR CA C 10 67.110 65.891 1.219 1
1 105 . 8 1 1 A 10 10 THR CB C 10 67.770 69.100 -1.330 1
1 107 . 8 1 1 A 10 10 THR N N 10 118.310 116.380 1.930 1
1 108 . 8 1 1 A 11 11 LEU H H 11 7.920 7.890 0.030 1
1 109 . 8 1 1 A 11 11 LEU HA H 11 3.930 4.030 -0.100 1
1 119 . 8 1 1 A 11 11 LEU C C 11 178.820 179.315 -0.495 1
1 120 . 8 1 1 A 11 11 LEU CA C 11 59.690 58.306 1.384 1
1 121 . 8 1 1 A 11 11 LEU CB C 11 41.920 41.811 0.109 1
1 125 . 8 1 1 A 11 11 LEU N N 11 121.150 121.113 0.037 1
1 126 . 8 1 1 A 12 12 ILE H H 12 7.440 7.863 -0.423 1
1 127 . 8 1 1 A 12 12 ILE HA H 12 3.640 3.595 0.045 1
1 137 . 8 1 1 A 12 12 ILE C C 12 179.530 178.686 0.844 1
1 138 . 8 1 1 A 12 12 ILE CA C 12 63.740 65.134 -1.394 1
1 139 . 8 1 1 A 12 12 ILE CB C 12 38.800 37.491 1.309 1
1 143 . 8 1 1 A 12 12 ILE N N 12 118.010 120.095 -2.085 1
1 144 . 8 1 1 A 13 13 ASN H H 13 8.930 8.273 0.657 1
1 145 . 8 1 1 A 13 13 ASN HA H 13 4.520 4.572 -0.052 1
1 148 . 8 1 1 A 13 13 ASN C C 13 179.450 177.337 2.113 1
1 149 . 8 1 1 A 13 13 ASN CA C 13 56.470 56.522 -0.052 1
1 150 . 8 1 1 A 13 13 ASN CB C 13 37.930 38.785 -0.855 1
1 151 . 8 1 1 A 13 13 ASN N N 13 121.820 119.921 1.899 1
1 152 . 8 1 1 A 14 14 VAL H H 14 9.180 7.992 1.188 1
1 153 . 8 1 1 A 14 14 VAL HA H 14 3.830 3.895 -0.065 1
1 161 . 8 1 1 A 14 14 VAL CA C 14 65.840 65.508 0.332 1
1 162 . 8 1 1 A 14 14 VAL CB C 14 31.290 31.554 -0.264 1
1 165 . 8 1 1 A 14 14 VAL N N 14 122.040 117.609 4.431 1
1 166 . 8 1 1 A 15 15 PHE H H 15 7.590 8.155 -0.565 1
1 167 . 8 1 1 A 15 15 PHE HA H 15 3.360 3.994 -0.634 1
1 170 . 8 1 1 A 15 15 PHE C C 15 177.890 177.383 0.507 1
1 171 . 8 1 1 A 15 15 PHE CA C 15 62.030 61.591 0.439 1
1 172 . 8 1 1 A 15 15 PHE CB C 15 38.900 38.940 -0.040 1
1 173 . 8 1 1 A 15 15 PHE N N 15 118.290 123.882 -5.592 1
1 174 . 8 1 1 A 16 16 HIS H H 16 7.790 7.884 -0.094 1
1 175 . 8 1 1 A 16 16 HIS HA H 16 4.890 4.231 0.659 1
1 178 . 8 1 1 A 16 16 HIS C C 16 177.810 176.893 0.917 1
1 179 . 8 1 1 A 16 16 HIS CA C 16 59.100 60.021 -0.921 1
1 180 . 8 1 1 A 16 16 HIS CB C 16 28.060 29.298 -1.238 1
1 181 . 8 1 1 A 16 16 HIS N N 16 118.290 118.445 -0.155 1
1 182 . 8 1 1 A 17 17 ALA H H 17 8.040 7.811 0.229 1
1 183 . 8 1 1 A 17 17 ALA HA H 17 4.050 3.832 0.218 1
1 187 . 8 1 1 A 17 17 ALA C C 17 179.600 179.998 -0.398 1
1 188 . 8 1 1 A 17 17 ALA CA C 17 54.000 55.202 -1.202 1
1 189 . 8 1 1 A 17 17 ALA CB C 17 17.520 18.506 -0.986 1
1 190 . 8 1 1 A 17 17 ALA N N 17 124.410 120.904 3.506 1
1 191 . 8 1 1 A 18 18 HIS H H 18 7.000 7.727 -0.727 1
1 192 . 8 1 1 A 18 18 HIS HA H 18 4.330 4.227 0.103 1
1 195 . 8 1 1 A 18 18 HIS C C 18 176.320 177.903 -1.583 1
1 196 . 8 1 1 A 18 18 HIS CA C 18 57.350 59.577 -2.227 1
1 197 . 8 1 1 A 18 18 HIS CB C 18 32.920 29.857 3.063 1
1 198 . 8 1 1 A 18 18 HIS N N 18 115.160 115.934 -0.774 1
1 199 . 8 1 1 A 19 19 SER H H 19 8.380 7.897 0.483 1
1 200 . 8 1 1 A 19 19 SER HA H 19 3.640 3.743 -0.103 1
1 203 . 8 1 1 A 19 19 SER C C 19 177.340 175.681 1.659 1
1 204 . 8 1 1 A 19 19 SER CA C 19 60.160 60.783 -0.623 1
1 205 . 8 1 1 A 19 19 SER CB C 19 61.000 62.302 -1.302 1
1 206 . 8 1 1 A 19 19 SER N N 19 114.380 114.911 -0.531 1
1 207 . 8 1 1 A 20 20 GLY H H 20 7.600 7.478 0.122 1
1 208 . 8 1 1 A 20 20 GLY HA2 H 20 3.680 3.813 -0.133 1
1 209 . 8 1 1 A 20 20 GLY HA3 H 20 4.000 3.904 0.096 1
1 210 . 8 1 1 A 20 20 GLY C C 20 174.140 174.255 -0.115 1
1 211 . 8 1 1 A 20 20 GLY CA C 20 47.000 45.089 1.911 1
1 212 . 8 1 1 A 20 20 GLY N N 20 112.550 106.950 5.600 1
1 213 . 8 1 1 A 21 21 LYS H H 21 7.230 8.058 -0.828 1
1 214 . 8 1 1 A 21 21 LYS HA H 21 3.860 4.576 -0.716 1
1 223 . 8 1 1 A 21 21 LYS C C 21 177.730 176.930 0.800 1
1 224 . 8 1 1 A 21 21 LYS CA C 21 59.110 57.447 1.663 1
1 225 . 8 1 1 A 21 21 LYS CB C 21 32.460 34.394 -1.934 1
1 229 . 8 1 1 A 21 21 LYS N N 21 123.240 119.252 3.988 1
1 230 . 8 1 1 A 22 22 GLU H H 22 9.350 8.205 1.145 1
1 231 . 8 1 1 A 22 22 GLU HA H 22 4.610 4.271 0.339 1
1 236 . 8 1 1 A 22 22 GLU C C 22 177.420 175.853 1.567 1
1 237 . 8 1 1 A 22 22 GLU CA C 22 53.700 56.381 -2.681 1
1 238 . 8 1 1 A 22 22 GLU CB C 22 32.000 28.369 3.631 1
1 240 . 8 1 1 A 22 22 GLU N N 22 116.770 118.892 -2.122 1
1 241 . 8 1 1 A 23 23 GLY H H 23 7.570 8.180 -0.610 1
1 242 . 8 1 1 A 23 23 GLY HA2 H 23 3.630 4.065 -0.435 1
1 243 . 8 1 1 A 23 23 GLY HA3 H 23 3.880 4.084 -0.204 1
1 244 . 8 1 1 A 23 23 GLY C C 23 173.980 171.660 2.320 1
1 245 . 8 1 1 A 23 23 GLY CA C 23 45.250 45.672 -0.422 1
1 246 . 8 1 1 A 23 23 GLY N N 23 112.180 108.176 4.004 1
1 247 . 8 1 1 A 24 24 ASP H H 24 8.680 8.451 0.229 1
1 248 . 8 1 1 A 24 24 ASP HA H 24 4.380 4.745 -0.365 1
1 251 . 8 1 1 A 24 24 ASP C C 24 178.590 177.846 0.744 1
1 252 . 8 1 1 A 24 24 ASP CA C 24 60.000 53.463 6.537 1
1 253 . 8 1 1 A 24 24 ASP CB C 24 27.480 41.691 -14.211 1
1 254 . 8 1 1 A 24 24 ASP N N 24 127.470 122.548 4.922 1
1 255 . 8 1 1 A 25 25 LYS H H 25 9.270 8.835 0.435 1
1 256 . 8 1 1 A 25 25 LYS HA H 25 4.250 3.981 0.269 1
1 265 . 8 1 1 A 25 25 LYS C C 25 177.030 177.400 -0.370 1
1 266 . 8 1 1 A 25 25 LYS CA C 25 60.000 59.083 0.917 1
1 267 . 8 1 1 A 25 25 LYS CB C 25 31.170 32.264 -1.094 1
1 271 . 8 1 1 A 25 25 LYS N N 25 132.960 123.039 9.921 1
1 272 . 8 1 1 A 26 26 TYR H H 26 9.430 7.847 1.583 1
1 273 . 8 1 1 A 26 26 TYR HA H 26 4.640 4.825 -0.185 1
1 276 . 8 1 1 A 26 26 TYR C C 26 174.290 174.372 -0.082 1
1 277 . 8 1 1 A 26 26 TYR CA C 26 56.010 56.821 -0.811 1
1 278 . 8 1 1 A 26 26 TYR CB C 26 37.730 39.404 -1.674 1
1 279 . 8 1 1 A 26 26 TYR N N 26 120.650 118.344 2.306 1
1 280 . 8 1 1 A 27 27 LYS H H 27 7.110 7.295 -0.185 1
1 281 . 8 1 1 A 27 27 LYS HA H 27 5.110 5.081 0.029 1
1 290 . 8 1 1 A 27 27 LYS C C 27 175.150 174.095 1.055 1
1 291 . 8 1 1 A 27 27 LYS CA C 27 55.070 54.999 0.071 1
1 292 . 8 1 1 A 27 27 LYS CB C 27 38.900 36.298 2.602 1
1 296 . 8 1 1 A 27 27 LYS N N 27 115.830 123.422 -7.592 1
1 297 . 8 1 1 A 28 28 LEU H H 28 9.820 8.407 1.413 1
1 298 . 8 1 1 A 28 28 LEU HA H 28 5.080 4.764 0.316 1
1 308 . 8 1 1 A 28 28 LEU C C 28 176.640 175.731 0.909 1
1 309 . 8 1 1 A 28 28 LEU CA C 28 52.660 53.874 -1.214 1
1 310 . 8 1 1 A 28 28 LEU CB C 28 42.710 43.788 -1.078 1
1 314 . 8 1 1 A 28 28 LEU N N 28 126.930 128.708 -1.778 1
1 315 . 8 1 1 A 29 29 SER H H 29 9.890 8.799 1.091 1
1 316 . 8 1 1 A 29 29 SER HA H 29 4.530 4.514 0.016 1
1 319 . 8 1 1 A 29 29 SER C C 29 174.990 175.441 -0.451 1
1 320 . 8 1 1 A 29 29 SER CA C 29 56.180 58.478 -2.298 1
1 321 . 8 1 1 A 29 29 SER CB C 29 65.550 63.593 1.957 1
1 322 . 8 1 1 A 29 29 SER N N 29 121.600 121.925 -0.325 1
1 323 . 8 1 1 A 30 30 LYS H H 30 8.850 8.960 -0.110 1
1 324 . 8 1 1 A 30 30 LYS HA H 30 3.850 3.978 -0.128 1
1 333 . 8 1 1 A 30 30 LYS C C 30 175.620 178.389 -2.769 1
1 334 . 8 1 1 A 30 30 LYS CA C 30 60.860 60.199 0.661 1
1 335 . 8 1 1 A 30 30 LYS CB C 30 31.290 32.149 -0.859 1
1 339 . 8 1 1 A 30 30 LYS N N 30 121.260 126.885 -5.625 1
1 340 . 8 1 1 A 31 31 LYS H H 31 7.970 8.057 -0.087 1
1 341 . 8 1 1 A 31 31 LYS HA H 31 3.880 4.103 -0.223 1
1 350 . 8 1 1 A 31 31 LYS C C 31 179.290 178.659 0.631 1
1 351 . 8 1 1 A 31 31 LYS CA C 31 59.110 58.802 0.308 1
1 352 . 8 1 1 A 31 31 LYS CB C 31 32.640 31.727 0.913 1
1 356 . 8 1 1 A 31 31 LYS N N 31 121.260 118.118 3.142 1
1 357 . 8 1 1 A 32 32 GLU H H 32 7.510 8.882 -1.372 1
1 358 . 8 1 1 A 32 32 GLU HA H 32 3.830 4.085 -0.255 1
1 363 . 8 1 1 A 32 32 GLU C C 32 179.290 179.622 -0.332 1
1 364 . 8 1 1 A 32 32 GLU CA C 32 58.590 58.872 -0.282 1
1 365 . 8 1 1 A 32 32 GLU CB C 32 30.120 30.105 0.015 1
1 367 . 8 1 1 A 32 32 GLU N N 32 120.090 119.250 0.840 1
1 368 . 8 1 1 A 33 33 LEU H H 33 8.970 7.740 1.230 1
1 369 . 8 1 1 A 33 33 LEU HA H 33 3.830 4.013 -0.183 1
1 379 . 8 1 1 A 33 33 LEU C C 33 178.200 178.867 -0.667 1
1 380 . 8 1 1 A 33 33 LEU CA C 33 57.930 58.155 -0.225 1
1 381 . 8 1 1 A 33 33 LEU CB C 33 40.660 41.709 -1.049 1
1 385 . 8 1 1 A 33 33 LEU N N 33 120.200 119.276 0.924 1
1 386 . 8 1 1 A 34 34 LYS H H 34 8.230 7.648 0.582 1
1 387 . 8 1 1 A 34 34 LYS HA H 34 3.550 3.953 -0.403 1
1 396 . 8 1 1 A 34 34 LYS C C 34 178.040 178.674 -0.634 1
1 397 . 8 1 1 A 34 34 LYS CA C 34 60.720 59.185 1.535 1
1 398 . 8 1 1 A 34 34 LYS CB C 34 31.980 32.002 -0.022 1
1 402 . 8 1 1 A 34 34 LYS N N 34 120.780 119.261 1.519 1
1 403 . 8 1 1 A 35 35 ASP H H 35 7.990 7.941 0.049 1
1 404 . 8 1 1 A 35 35 ASP HA H 35 4.250 4.463 -0.213 1
1 407 . 8 1 1 A 35 35 ASP C C 35 179.060 178.495 0.565 1
1 408 . 8 1 1 A 35 35 ASP CA C 35 56.830 57.300 -0.470 1
1 409 . 8 1 1 A 35 35 ASP CB C 35 40.440 40.669 -0.229 1
1 410 . 8 1 1 A 35 35 ASP N N 35 119.550 119.535 0.015 1
1 411 . 8 1 1 A 36 36 LEU H H 36 8.130 7.714 0.416 1
1 412 . 8 1 1 A 36 36 LEU HA H 36 2.580 3.462 -0.882 1
1 422 . 8 1 1 A 36 36 LEU C C 36 179.450 178.783 0.667 1
1 423 . 8 1 1 A 36 36 LEU CA C 36 59.980 57.861 2.119 1
1 424 . 8 1 1 A 36 36 LEU CB C 36 42.180 41.419 0.761 1
1 428 . 8 1 1 A 36 36 LEU N N 36 125.560 121.335 4.225 1
1 429 . 8 1 1 A 37 37 LEU H H 37 8.740 7.851 0.889 1
1 430 . 8 1 1 A 37 37 LEU HA H 37 3.580 4.165 -0.585 1
1 440 . 8 1 1 A 37 37 LEU C C 37 179.290 179.415 -0.125 1
1 441 . 8 1 1 A 37 37 LEU CA C 37 58.230 58.027 0.203 1
1 442 . 8 1 1 A 37 37 LEU CB C 37 41.590 41.564 0.026 1
1 446 . 8 1 1 A 37 37 LEU N N 37 120.520 118.313 2.207 1
1 447 . 8 1 1 A 38 38 GLN H H 38 8.520 8.195 0.325 1
1 448 . 8 1 1 A 38 38 GLN HA H 38 4.000 4.083 -0.083 1
1 453 . 8 1 1 A 38 38 GLN C C 38 177.960 177.315 0.645 1
1 454 . 8 1 1 A 38 38 GLN CA C 38 58.210 58.301 -0.091 1
1 455 . 8 1 1 A 38 38 GLN CB C 38 28.650 27.828 0.822 1
1 457 . 8 1 1 A 38 38 GLN N N 38 116.740 117.985 -1.245 1
1 458 . 8 1 1 A 39 39 THR H H 39 7.910 7.655 0.255 1
1 459 . 8 1 1 A 39 39 THR HA H 39 4.210 4.276 -0.066 1
1 464 . 8 1 1 A 39 39 THR C C 39 177.180 175.131 2.049 1
1 465 . 8 1 1 A 39 39 THR CA C 39 64.730 64.123 0.607 1
1 466 . 8 1 1 A 39 39 THR CB C 39 69.650 68.085 1.565 1
1 468 . 8 1 1 A 39 39 THR N N 39 111.400 115.293 -3.893 1
1 469 . 8 1 1 A 40 40 GLU H H 40 8.590 8.131 0.459 1
1 470 . 8 1 1 A 40 40 GLU HA H 40 4.680 4.479 0.201 1
1 475 . 8 1 1 A 40 40 GLU C C 40 178.280 177.479 0.801 1
1 476 . 8 1 1 A 40 40 GLU CA C 40 55.880 57.484 -1.604 1
1 477 . 8 1 1 A 40 40 GLU CB C 40 30.990 32.600 -1.610 1
1 479 . 8 1 1 A 40 40 GLU N N 40 117.840 120.182 -2.342 1
1 480 . 8 1 1 A 41 41 LEU H H 41 7.680 8.156 -0.476 1
1 481 . 8 1 1 A 41 41 LEU HA H 41 5.080 4.757 0.323 1
1 491 . 8 1 1 A 41 41 LEU C C 41 179.450 177.209 2.241 1
1 492 . 8 1 1 A 41 41 LEU CA C 41 53.830 54.272 -0.442 1
1 493 . 8 1 1 A 41 41 LEU CB C 41 41.360 42.439 -1.079 1
1 497 . 8 1 1 A 41 41 LEU N N 41 121.410 118.713 2.697 1
1 498 . 8 1 1 A 42 42 SER H H 42 8.380 8.285 0.095 1
1 499 . 8 1 1 A 42 42 SER HA H 42 4.130 4.155 -0.025 1
1 502 . 8 1 1 A 42 42 SER C C 42 176.640 177.043 -0.403 1
1 503 . 8 1 1 A 42 42 SER CA C 42 61.280 61.645 -0.365 1
1 504 . 8 1 1 A 42 42 SER CB C 42 63.040 62.645 0.395 1
1 505 . 8 1 1 A 42 42 SER N N 42 117.420 115.894 1.526 1
1 506 . 8 1 1 A 43 43 SER H H 43 8.900 8.141 0.759 1
1 507 . 8 1 1 A 43 43 SER HA H 43 4.290 4.221 0.069 1
1 510 . 8 1 1 A 43 43 SER C C 43 175.620 176.745 -1.125 1
1 511 . 8 1 1 A 43 43 SER CA C 43 60.860 62.290 -1.430 1
1 512 . 8 1 1 A 43 43 SER CB C 43 62.910 63.535 -0.625 1
1 513 . 8 1 1 A 43 43 SER N N 43 117.580 116.812 0.768 1
1 514 . 8 1 1 A 44 44 PHE H H 44 7.880 8.001 -0.121 1
1 515 . 8 1 1 A 44 44 PHE HA H 44 4.240 4.207 0.033 1
1 518 . 8 1 1 A 44 44 PHE C C 44 176.950 175.831 1.119 1
1 519 . 8 1 1 A 44 44 PHE CA C 44 62.710 60.873 1.837 1
1 520 . 8 1 1 A 44 44 PHE CB C 44 39.020 39.198 -0.178 1
1 521 . 8 1 1 A 44 44 PHE N N 44 119.480 121.600 -2.120 1
1 522 . 8 1 1 A 45 45 LEU H H 45 8.060 7.983 0.077 1
1 523 . 8 1 1 A 45 45 LEU HA H 45 3.810 4.008 -0.198 1
1 533 . 8 1 1 A 45 45 LEU C C 45 177.500 176.555 0.945 1
1 534 . 8 1 1 A 45 45 LEU CA C 45 59.980 55.866 4.114 1
1 535 . 8 1 1 A 45 45 LEU CB C 45 39.640 42.318 -2.678 1
1 538 . 8 1 1 A 45 45 LEU N N 45 118.010 121.033 -3.023 1
1 539 . 8 1 1 A 46 46 ASP H H 46 8.150 8.601 -0.451 1
1 540 . 8 1 1 A 46 46 ASP HA H 46 4.470 4.637 -0.167 1
1 543 . 8 1 1 A 46 46 ASP C C 46 179.920 175.494 4.426 1
1 544 . 8 1 1 A 46 46 ASP CA C 46 52.950 53.310 -0.360 1
1 545 . 8 1 1 A 46 46 ASP CB C 46 40.000 40.711 -0.711 1
1 546 . 8 1 1 A 46 46 ASP N N 46 119.460 125.403 -5.943 1
1 547 . 8 1 1 A 47 47 VAL H H 47 8.010 8.444 -0.434 1
1 548 . 8 1 1 A 47 47 VAL HA H 47 3.800 4.313 -0.513 1
1 556 . 8 1 1 A 47 47 VAL C C 47 175.460 177.128 -1.668 1
1 557 . 8 1 1 A 47 47 VAL CA C 47 60.000 63.353 -3.353 1
1 558 . 8 1 1 A 47 47 VAL CB C 47 31.580 33.260 -1.680 1
1 561 . 8 1 1 A 47 47 VAL N N 47 117.720 126.143 -8.423 1
1 562 . 8 1 1 A 48 48 GLN H H 48 7.960 8.953 -0.993 1
1 563 . 8 1 1 A 48 48 GLN HA H 48 4.060 3.988 0.072 1
1 568 . 8 1 1 A 48 48 GLN C C 48 179.370 178.876 0.494 1
1 569 . 8 1 1 A 48 48 GLN CA C 48 57.350 58.951 -1.601 1
1 570 . 8 1 1 A 48 48 GLN CB C 48 28.990 28.356 0.634 1
1 572 . 8 1 1 A 48 48 GLN N N 48 119.900 121.453 -1.553 1
1 573 . 8 1 1 A 49 49 LYS H H 49 7.810 7.662 0.148 1
1 574 . 8 1 1 A 49 49 LYS HA H 49 3.860 4.078 -0.218 1
1 583 . 8 1 1 A 49 49 LYS C C 49 177.890 176.686 1.204 1
1 584 . 8 1 1 A 49 49 LYS CA C 49 58.230 58.737 -0.507 1
1 585 . 8 1 1 A 49 49 LYS CB C 49 30.990 32.477 -1.487 1
1 587 . 8 1 1 A 49 49 LYS N N 49 120.030 119.877 0.153 1
1 588 . 8 1 1 A 50 50 ASP H H 50 7.570 7.654 -0.084 1
1 589 . 8 1 1 A 50 50 ASP HA H 50 4.700 4.812 -0.112 1
1 590 . 8 1 1 A 50 50 ASP CA C 50 52.950 53.047 -0.097 1
1 591 . 8 1 1 A 50 50 ASP CB C 50 38.900 41.313 -2.413 1
1 592 . 8 1 1 A 50 50 ASP N N 50 116.730 118.723 -1.993 1
1 593 . 8 1 1 A 51 51 ALA H H 51 7.570 8.809 -1.239 1
1 594 . 8 1 1 A 51 51 ALA HA H 51 4.200 3.944 0.256 1
1 598 . 8 1 1 A 51 51 ALA C C 51 179.760 179.317 0.443 1
1 599 . 8 1 1 A 51 51 ALA CA C 51 54.200 55.234 -1.034 1
1 600 . 8 1 1 A 51 51 ALA CB C 51 18.110 18.408 -0.298 1
1 601 . 8 1 1 A 51 51 ALA N N 51 118.390 127.346 -8.956 1
1 602 . 8 1 1 A 52 52 ASP H H 52 8.430 8.433 -0.003 1
1 603 . 8 1 1 A 52 52 ASP HA H 52 4.600 4.352 0.248 1
1 606 . 8 1 1 A 52 52 ASP C C 52 177.570 178.446 -0.876 1
1 607 . 8 1 1 A 52 52 ASP CA C 52 54.420 56.748 -2.328 1
1 608 . 8 1 1 A 52 52 ASP CB C 52 40.360 40.085 0.275 1
1 609 . 8 1 1 A 52 52 ASP N N 52 117.530 119.360 -1.830 1
1 610 . 8 1 1 A 53 53 ALA H H 53 7.660 7.710 -0.050 1
1 611 . 8 1 1 A 53 53 ALA HA H 53 3.860 3.988 -0.128 1
1 615 . 8 1 1 A 53 53 ALA C C 53 180.070 180.610 -0.540 1
1 616 . 8 1 1 A 53 53 ALA CA C 53 55.590 55.419 0.171 1
1 617 . 8 1 1 A 53 53 ALA CB C 53 18.800 17.973 0.827 1
1 618 . 8 1 1 A 53 53 ALA N N 53 123.450 122.698 0.752 1
1 619 . 8 1 1 A 54 54 VAL H H 54 8.030 7.788 0.242 1
1 620 . 8 1 1 A 54 54 VAL HA H 54 3.240 3.579 -0.339 1
1 628 . 8 1 1 A 54 54 VAL C C 54 177.340 178.052 -0.712 1
1 629 . 8 1 1 A 54 54 VAL CA C 54 66.620 65.959 0.661 1
1 630 . 8 1 1 A 54 54 VAL CB C 54 30.480 30.922 -0.442 1
1 633 . 8 1 1 A 54 54 VAL N N 54 116.150 117.598 -1.448 1
1 634 . 8 1 1 A 55 55 ASP H H 55 7.660 7.757 -0.097 1
1 635 . 8 1 1 A 55 55 ASP HA H 55 4.080 4.388 -0.308 1
1 638 . 8 1 1 A 55 55 ASP C C 55 177.260 179.421 -2.161 1
1 639 . 8 1 1 A 55 55 ASP CA C 55 57.640 57.344 0.296 1
1 640 . 8 1 1 A 55 55 ASP CB C 55 40.360 40.139 0.221 1
1 641 . 8 1 1 A 55 55 ASP N N 55 120.830 121.978 -1.148 1
1 642 . 8 1 1 A 56 56 LYS H H 56 7.780 7.477 0.303 1
1 643 . 8 1 1 A 56 56 LYS HA H 56 3.860 4.007 -0.147 1
1 652 . 8 1 1 A 56 56 LYS C C 56 179.530 179.541 -0.011 1
1 653 . 8 1 1 A 56 56 LYS CA C 56 59.690 59.644 0.046 1
1 654 . 8 1 1 A 56 56 LYS CB C 56 31.870 32.469 -0.599 1
1 658 . 8 1 1 A 56 56 LYS N N 56 120.010 119.872 0.138 1
1 659 . 8 1 1 A 57 57 ILE H H 57 8.090 7.835 0.255 1
1 660 . 8 1 1 A 57 57 ILE HA H 57 3.390 3.520 -0.130 1
1 670 . 8 1 1 A 57 57 ILE C C 57 176.710 177.563 -0.853 1
1 671 . 8 1 1 A 57 57 ILE CA C 57 64.960 65.255 -0.295 1
1 672 . 8 1 1 A 57 57 ILE CB C 57 38.080 38.370 -0.290 1
1 676 . 8 1 1 A 57 57 ILE N N 57 120.960 120.369 0.591 1
1 677 . 8 1 1 A 58 58 MET H H 58 8.480 8.222 0.258 1
1 678 . 8 1 1 A 58 58 MET HA H 58 3.800 4.105 -0.305 1
1 686 . 8 1 1 A 58 58 MET C C 58 177.570 178.141 -0.571 1
1 687 . 8 1 1 A 58 58 MET CA C 58 58.570 58.409 0.161 1
1 688 . 8 1 1 A 58 58 MET CB C 58 32.570 31.960 0.610 1
1 691 . 8 1 1 A 58 58 MET N N 58 119.160 120.594 -1.434 1
1 692 . 8 1 1 A 59 59 LYS H H 59 7.550 7.886 -0.336 1
1 693 . 8 1 1 A 59 59 LYS HA H 59 3.930 3.966 -0.036 1
1 702 . 8 1 1 A 59 59 LYS C C 59 179.530 179.151 0.379 1
1 703 . 8 1 1 A 59 59 LYS CA C 59 58.820 59.642 -0.822 1
1 704 . 8 1 1 A 59 59 LYS CB C 59 32.450 32.590 -0.140 1
1 708 . 8 1 1 A 59 59 LYS N N 59 116.730 119.697 -2.967 1
1 709 . 8 1 1 A 60 60 GLU H H 60 7.470 7.835 -0.365 1
1 710 . 8 1 1 A 60 60 GLU HA H 60 4.050 4.047 0.003 1
1 715 . 8 1 1 A 60 60 GLU C C 60 178.950 178.236 0.714 1
1 716 . 8 1 1 A 60 60 GLU CA C 60 58.600 59.078 -0.478 1
1 717 . 8 1 1 A 60 60 GLU CB C 60 31.700 29.403 2.297 1
1 719 . 8 1 1 A 60 60 GLU N N 60 116.820 119.490 -2.670 1
1 720 . 8 1 1 A 61 61 LEU H H 61 8.030 7.637 0.393 1
1 721 . 8 1 1 A 61 61 LEU HA H 61 4.310 4.252 0.058 1
1 731 . 8 1 1 A 61 61 LEU C C 61 179.450 177.259 2.191 1
1 732 . 8 1 1 A 61 61 LEU CA C 61 54.840 56.296 -1.456 1
1 733 . 8 1 1 A 61 61 LEU CB C 61 43.820 42.251 1.569 1
1 737 . 8 1 1 A 61 61 LEU N N 61 116.000 118.875 -2.875 1
1 738 . 8 1 1 A 62 62 ASP H H 62 7.890 8.960 -1.070 1
1 739 . 8 1 1 A 62 62 ASP HA H 62 4.660 4.853 -0.193 1
1 742 . 8 1 1 A 62 62 ASP C C 62 177.030 176.047 0.983 1
1 743 . 8 1 1 A 62 62 ASP CA C 62 53.660 53.762 -0.102 1
1 744 . 8 1 1 A 62 62 ASP CB C 62 38.700 39.180 -0.480 1
1 745 . 8 1 1 A 62 62 ASP N N 62 117.550 117.847 -0.297 1
1 746 . 8 1 1 A 63 63 GLU H H 63 8.430 9.779 -1.349 1
1 747 . 8 1 1 A 63 63 GLU HA H 63 4.020 4.035 -0.015 1
1 752 . 8 1 1 A 63 63 GLU C C 63 178.120 178.941 -0.821 1
1 753 . 8 1 1 A 63 63 GLU CA C 63 58.470 59.210 -0.740 1
1 754 . 8 1 1 A 63 63 GLU CB C 63 30.120 29.343 0.777 1
1 756 . 8 1 1 A 63 63 GLU N N 63 130.230 120.520 9.710 1
1 757 . 8 1 1 A 64 64 ASN H H 64 8.010 8.074 -0.064 1
1 758 . 8 1 1 A 64 64 ASN HA H 64 4.680 4.673 0.007 1
1 761 . 8 1 1 A 64 64 ASN C C 64 177.100 175.831 1.269 1
1 762 . 8 1 1 A 64 64 ASN CA C 64 51.780 53.257 -1.477 1
1 763 . 8 1 1 A 64 64 ASN CB C 64 37.260 38.928 -1.668 1
1 764 . 8 1 1 A 64 64 ASN N N 64 113.640 115.651 -2.011 1
1 765 . 8 1 1 A 65 65 GLY H H 65 7.550 8.000 -0.450 1
1 766 . 8 1 1 A 65 65 GLY HA2 H 65 3.770 3.954 -0.184 1
1 767 . 8 1 1 A 65 65 GLY HA3 H 65 3.770 3.954 -0.184 1
1 768 . 8 1 1 A 65 65 GLY C C 65 178.980 173.908 5.072 1
1 769 . 8 1 1 A 65 65 GLY CA C 65 47.200 46.118 1.082 1
1 770 . 8 1 1 A 65 65 GLY N N 65 113.640 108.670 4.970 1
1 771 . 8 1 1 A 66 66 ASP H H 66 8.110 8.118 -0.008 1
1 772 . 8 1 1 A 66 66 ASP HA H 66 4.490 4.997 -0.507 1
1 775 . 8 1 1 A 66 66 ASP C C 66 177.960 175.891 2.069 1
1 776 . 8 1 1 A 66 66 ASP CA C 66 52.960 52.294 0.666 1
1 777 . 8 1 1 A 66 66 ASP CB C 66 40.540 41.135 -0.595 1
1 778 . 8 1 1 A 66 66 ASP N N 66 120.030 120.070 -0.040 1
1 779 . 8 1 1 A 67 67 GLY H H 67 10.260 8.140 2.120 1
1 780 . 8 1 1 A 67 67 GLY HA2 H 67 3.360 4.114 -0.754 1
1 781 . 8 1 1 A 67 67 GLY HA3 H 67 4.000 4.114 -0.114 1
1 782 . 8 1 1 A 67 67 GLY C C 67 173.120 173.371 -0.251 1
1 783 . 8 1 1 A 67 67 GLY CA C 67 45.460 45.644 -0.184 1
1 784 . 8 1 1 A 67 67 GLY N N 67 114.100 108.640 5.460 1
1 785 . 8 1 1 A 68 68 GLU H H 68 7.750 7.765 -0.015 1
1 786 . 8 1 1 A 68 68 GLU HA H 68 4.780 4.936 -0.156 1
1 791 . 8 1 1 A 68 68 GLU C C 68 175.930 175.159 0.771 1
1 792 . 8 1 1 A 68 68 GLU CA C 68 54.430 54.389 0.041 1
1 793 . 8 1 1 A 68 68 GLU CB C 68 35.850 34.051 1.799 1
1 795 . 8 1 1 A 68 68 GLU N N 68 118.000 119.227 -1.227 1
1 796 . 8 1 1 A 69 69 VAL H H 69 9.380 8.763 0.617 1
1 797 . 8 1 1 A 69 69 VAL HA H 69 5.260 5.161 0.099 1
1 805 . 8 1 1 A 69 69 VAL C C 69 176.710 173.744 2.966 1
1 806 . 8 1 1 A 69 69 VAL CA C 69 61.280 60.734 0.546 1
1 807 . 8 1 1 A 69 69 VAL CB C 69 33.980 34.807 -0.827 1
1 810 . 8 1 1 A 69 69 VAL N N 69 125.970 120.956 5.014 1
1 811 . 8 1 1 A 70 70 ASP H H 70 9.100 8.938 0.162 1
1 812 . 8 1 1 A 70 70 ASP HA H 70 5.190 5.139 0.051 1
1 815 . 8 1 1 A 70 70 ASP C C 70 175.700 176.851 -1.151 1
1 816 . 8 1 1 A 70 70 ASP CA C 70 52.370 52.881 -0.511 1
1 817 . 8 1 1 A 70 70 ASP CB C 70 40.950 43.011 -2.061 1
1 818 . 8 1 1 A 70 70 ASP N N 70 130.320 127.498 2.822 1
1 819 . 8 1 1 A 71 71 PHE H H 71 9.090 9.053 0.037 1
1 820 . 8 1 1 A 71 71 PHE HA H 71 4.100 3.750 0.350 1
1 823 . 8 1 1 A 71 71 PHE C C 71 177.000 177.493 -0.493 1
1 824 . 8 1 1 A 71 71 PHE CA C 71 58.230 62.215 -3.985 1
1 825 . 8 1 1 A 71 71 PHE CB C 71 36.910 39.019 -2.109 1
1 826 . 8 1 1 A 71 71 PHE N N 71 119.760 125.935 -6.175 1
1 827 . 8 1 1 A 72 72 GLN H H 72 8.440 8.446 -0.006 1
1 828 . 8 1 1 A 72 72 GLN HA H 72 3.600 3.964 -0.364 1
1 831 . 8 1 1 A 72 72 GLN C C 72 178.820 178.005 0.815 1
1 832 . 8 1 1 A 72 72 GLN CA C 72 59.500 58.271 1.229 1
1 833 . 8 1 1 A 72 72 GLN CB C 72 29.553 27.320 2.233 1
1 835 . 8 1 1 A 72 72 GLN N N 72 121.820 116.733 5.087 1
1 836 . 8 1 1 A 73 73 GLU H H 73 8.290 7.890 0.400 1
1 837 . 8 1 1 A 73 73 GLU HA H 73 4.070 4.129 -0.059 1
1 842 . 8 1 1 A 73 73 GLU C C 73 179.370 178.809 0.561 1
1 843 . 8 1 1 A 73 73 GLU CA C 73 58.030 58.839 -0.809 1
1 844 . 8 1 1 A 73 73 GLU CB C 73 29.530 30.030 -0.500 1
1 846 . 8 1 1 A 73 73 GLU N N 73 120.550 119.432 1.118 1
1 847 . 8 1 1 A 74 74 PHE H H 74 8.630 8.539 0.091 1
1 848 . 8 1 1 A 74 74 PHE HA H 74 4.020 3.985 0.035 1
1 851 . 8 1 1 A 74 74 PHE C C 74 177.890 176.829 1.061 1
1 852 . 8 1 1 A 74 74 PHE CA C 74 60.090 61.281 -1.191 1
1 853 . 8 1 1 A 74 74 PHE CB C 74 38.020 39.303 -1.283 1
1 854 . 8 1 1 A 74 74 PHE N N 74 121.010 121.524 -0.514 1
1 855 . 8 1 1 A 75 75 VAL H H 75 8.080 8.305 -0.225 1
1 856 . 8 1 1 A 75 75 VAL HA H 75 2.860 3.389 -0.529 1
1 864 . 8 1 1 A 75 75 VAL C C 75 177.030 178.173 -1.143 1
1 865 . 8 1 1 A 75 75 VAL CA C 75 66.430 66.437 -0.007 1
1 866 . 8 1 1 A 75 75 VAL CB C 75 30.600 31.058 -0.458 1
1 869 . 8 1 1 A 75 75 VAL N N 75 119.460 118.969 0.491 1
1 870 . 8 1 1 A 76 76 VAL H H 76 7.100 8.047 -0.947 1
1 871 . 8 1 1 A 76 76 VAL HA H 76 3.330 3.462 -0.132 1
1 879 . 8 1 1 A 76 76 VAL C C 76 178.670 178.232 0.438 1
1 880 . 8 1 1 A 76 76 VAL CA C 76 67.000 66.682 0.318 1
1 881 . 8 1 1 A 76 76 VAL CB C 76 31.280 31.415 -0.135 1
1 884 . 8 1 1 A 76 76 VAL N N 76 121.030 120.067 0.963 1
1 885 . 8 1 1 A 77 77 LEU H H 77 6.900 7.735 -0.835 1
1 886 . 8 1 1 A 77 77 LEU HA H 77 3.800 3.907 -0.107 1
1 896 . 8 1 1 A 77 77 LEU C C 77 177.960 178.259 -0.299 1
1 897 . 8 1 1 A 77 77 LEU CA C 77 57.710 58.061 -0.351 1
1 898 . 8 1 1 A 77 77 LEU CB C 77 40.070 41.697 -1.627 1
1 902 . 8 1 1 A 77 77 LEU N N 77 120.310 120.702 -0.392 1
1 903 . 8 1 1 A 78 78 VAL H H 78 7.240 7.375 -0.135 1
1 904 . 8 1 1 A 78 78 VAL HA H 78 3.030 3.709 -0.679 1
1 912 . 8 1 1 A 78 78 VAL C C 78 179.600 178.002 1.598 1
1 913 . 8 1 1 A 78 78 VAL CA C 78 66.420 64.612 1.808 1
1 914 . 8 1 1 A 78 78 VAL CB C 78 30.700 31.246 -0.546 1
1 917 . 8 1 1 A 78 78 VAL N N 78 117.180 116.074 1.106 1
1 918 . 8 1 1 A 79 79 ALA H H 79 9.000 7.614 1.386 1
1 919 . 8 1 1 A 79 79 ALA HA H 79 3.610 4.056 -0.446 1
1 923 . 8 1 1 A 79 79 ALA C C 79 182.260 180.248 2.012 1
1 924 . 8 1 1 A 79 79 ALA CA C 79 55.580 55.234 0.346 1
1 925 . 8 1 1 A 79 79 ALA CB C 79 18.400 18.299 0.101 1
1 926 . 8 1 1 A 79 79 ALA N N 79 126.000 124.858 1.142 1
1 927 . 8 1 1 A 80 80 ALA H H 80 8.000 7.677 0.323 1
1 928 . 8 1 1 A 80 80 ALA HA H 80 4.100 4.047 0.053 1
1 932 . 8 1 1 A 80 80 ALA C C 80 175.460 179.979 -4.519 1
1 933 . 8 1 1 A 80 80 ALA CA C 80 56.020 54.521 1.499 1
1 934 . 8 1 1 A 80 80 ALA CB C 80 18.040 18.348 -0.308 1
1 935 . 8 1 1 A 80 80 ALA N N 80 120.730 120.788 -0.058 1
1 936 . 8 1 1 A 81 81 LEU H H 81 8.460 7.599 0.861 1
1 937 . 8 1 1 A 81 81 LEU HA H 81 4.000 3.969 0.031 1
1 941 . 8 1 1 A 81 81 LEU C C 81 177.030 178.709 -1.679 1
1 942 . 8 1 1 A 81 81 LEU CA C 81 57.640 57.772 -0.132 1
1 943 . 8 1 1 A 81 81 LEU CB C 81 40.620 41.500 -0.880 1
1 945 . 8 1 1 A 81 81 LEU N N 81 119.890 117.875 2.015 1
1 946 . 8 1 1 A 82 82 THR H H 82 8.320 7.623 0.697 1
1 947 . 8 1 1 A 82 82 THR HA H 82 3.800 3.925 -0.125 1
1 952 . 8 1 1 A 82 82 THR C C 82 181.010 176.826 4.184 1
1 953 . 8 1 1 A 82 82 THR CA C 82 68.500 66.051 2.449 1
1 954 . 8 1 1 A 82 82 THR CB C 82 67.400 68.742 -1.342 1
1 956 . 8 1 1 A 82 82 THR N N 82 117.120 115.007 2.113 1
1 957 . 8 1 1 A 83 83 VAL H H 83 8.530 7.518 1.012 1
1 958 . 8 1 1 A 83 83 VAL HA H 83 3.890 3.764 0.126 1
1 966 . 8 1 1 A 83 83 VAL C C 83 178.120 178.190 -0.070 1
1 967 . 8 1 1 A 83 83 VAL CA C 83 67.400 65.144 2.256 1
1 968 . 8 1 1 A 83 83 VAL CB C 83 31.590 31.476 0.114 1
1 971 . 8 1 1 A 83 83 VAL N N 83 119.760 118.099 1.661 1
1 972 . 8 1 1 A 84 84 ALA H H 84 7.910 8.060 -0.150 1
1 973 . 8 1 1 A 84 84 ALA HA H 84 4.060 4.071 -0.011 1
1 977 . 8 1 1 A 84 84 ALA C C 84 180.560 179.843 0.717 1
1 978 . 8 1 1 A 84 84 ALA CA C 84 55.000 55.199 -0.199 1
1 979 . 8 1 1 A 84 84 ALA CB C 84 17.230 18.127 -0.897 1
1 980 . 8 1 1 A 84 84 ALA N N 84 122.620 124.378 -1.758 1
1 981 . 8 1 1 A 85 85 CYS H H 85 8.580 7.735 0.845 1
1 982 . 8 1 1 A 85 85 CYS HA H 85 4.080 4.442 -0.362 1
1 985 . 8 1 1 A 85 85 CYS C C 85 179.060 176.926 2.134 1
1 986 . 8 1 1 A 85 85 CYS CA C 85 63.210 61.397 1.813 1
1 987 . 8 1 1 A 85 85 CYS CB C 85 26.310 27.152 -0.842 1
1 988 . 8 1 1 A 85 85 CYS N N 85 118.730 117.302 1.428 1
1 989 . 8 1 1 A 86 86 ASN H H 86 8.430 8.024 0.406 1
1 990 . 8 1 1 A 86 86 ASN CA C 86 55.860 56.669 -0.809 1
1 991 . 8 1 1 A 86 86 ASN CB C 86 37.440 39.891 -2.451 1
1 992 . 8 1 1 A 86 86 ASN N N 86 119.360 119.195 0.165 1
1 993 . 8 1 1 A 87 87 ASN H H 87 7.880 7.903 -0.023 1
1 994 . 8 1 1 A 87 87 ASN HA H 87 4.600 4.515 0.085 1
1 997 . 8 1 1 A 87 87 ASN C C 87 178.510 177.696 0.814 1
1 998 . 8 1 1 A 87 87 ASN CA C 87 56.470 56.332 0.138 1
1 999 . 8 1 1 A 87 87 ASN CB C 87 37.500 39.226 -1.726 1
1 1000 . 8 1 1 A 87 87 ASN N N 87 119.480 117.465 2.015 1
1 1001 . 8 1 1 A 88 88 PHE H H 88 8.050 7.674 0.376 1
1 1002 . 8 1 1 A 88 88 PHE HA H 88 4.200 4.385 -0.185 1
1 1005 . 8 1 1 A 88 88 PHE C C 88 178.510 176.946 1.564 1
1 1006 . 8 1 1 A 88 88 PHE CA C 88 56.460 60.014 -3.554 1
1 1007 . 8 1 1 A 88 88 PHE CB C 88 38.500 39.888 -1.388 1
1 1008 . 8 1 1 A 88 88 PHE N N 88 120.280 120.065 0.215 1
1 1009 . 8 1 1 A 89 89 PHE H H 89 8.020 8.024 -0.004 1
1 1010 . 8 1 1 A 89 89 PHE HA H 89 4.000 4.404 -0.404 1
1 1013 . 8 1 1 A 89 89 PHE C C 89 177.340 176.729 0.611 1
1 1014 . 8 1 1 A 89 89 PHE CA C 89 59.000 59.408 -0.408 1
1 1015 . 8 1 1 A 89 89 PHE CB C 89 37.430 38.943 -1.513 1
1 1016 . 8 1 1 A 89 89 PHE N N 89 120.910 116.191 4.719 1
1 1017 . 8 1 1 A 90 90 TRP H H 90 7.800 7.681 0.119 1
1 1018 . 8 1 1 A 90 90 TRP HA H 90 4.460 4.305 0.155 1
1 1021 . 8 1 1 A 90 90 TRP C C 90 177.340 178.706 -1.366 1
1 1022 . 8 1 1 A 90 90 TRP CA C 90 57.930 60.570 -2.640 1
1 1023 . 8 1 1 A 90 90 TRP CB C 90 42.000 29.737 12.263 1
1 1024 . 8 1 1 A 90 90 TRP N N 90 120.050 122.266 -2.216 1
1 1025 . 8 1 1 A 91 91 GLU H H 91 7.800 8.632 -0.832 1
1 1026 . 8 1 1 A 91 91 GLU HA H 91 4.050 3.519 0.531 1
1 1031 . 8 1 1 A 91 91 GLU C C 91 177.570 178.187 -0.617 1
1 1032 . 8 1 1 A 91 91 GLU CA C 91 57.350 59.591 -2.241 1
1 1033 . 8 1 1 A 91 91 GLU CB C 91 29.530 29.088 0.442 1
1 1035 . 8 1 1 A 91 91 GLU N N 91 120.730 117.686 3.044 1
1 1036 . 8 1 1 A 92 92 ASN H H 92 7.800 7.788 0.012 1
1 1037 . 8 1 1 A 92 92 ASN HA H 92 4.630 4.511 0.119 1
1 1040 . 8 1 1 A 92 92 ASN C C 92 174.450 175.022 -0.572 1
1 1041 . 8 1 1 A 92 92 ASN CA C 92 52.960 51.933 1.027 1
1 1042 . 8 1 1 A 92 92 ASN CB C 92 29.530 37.327 -7.797 1
1 1043 . 8 1 1 A 92 92 ASN N N 92 119.410 114.060 5.350 1
1 5 . 9 1 1 A 2 2 SER H H 2 9.000 8.980 0.020 1
1 6 . 9 1 1 A 2 2 SER HA H 2 4.690 4.555 0.135 1
1 9 . 9 1 1 A 2 2 SER C C 2 176.170 175.937 0.233 1
1 10 . 9 1 1 A 2 2 SER CA C 2 57.340 57.982 -0.642 1
1 11 . 9 1 1 A 2 2 SER CB C 2 65.550 64.120 1.430 1
1 12 . 9 1 1 A 2 2 SER N N 2 119.330 115.780 3.550 1
1 13 . 9 1 1 A 3 3 GLU H H 3 9.350 8.987 0.363 1
1 14 . 9 1 1 A 3 3 GLU HA H 3 4.060 4.047 0.013 1
1 17 . 9 1 1 A 3 3 GLU C C 3 180.150 178.532 1.618 1
1 18 . 9 1 1 A 3 3 GLU CA C 3 60.280 59.311 0.969 1
1 19 . 9 1 1 A 3 3 GLU CB C 3 29.230 29.007 0.223 1
1 21 . 9 1 1 A 3 3 GLU N N 3 125.350 123.662 1.688 1
1 22 . 9 1 1 A 4 4 LEU H H 4 9.060 8.130 0.930 1
1 23 . 9 1 1 A 4 4 LEU HA H 4 4.080 4.042 0.038 1
1 33 . 9 1 1 A 4 4 LEU C C 4 177.890 179.119 -1.229 1
1 34 . 9 1 1 A 4 4 LEU CA C 4 58.090 57.946 0.144 1
1 35 . 9 1 1 A 4 4 LEU CB C 4 42.120 41.126 0.994 1
1 39 . 9 1 1 A 4 4 LEU N N 4 121.090 120.477 0.613 1
1 40 . 9 1 1 A 5 5 GLU H H 5 8.340 8.254 0.086 1
1 41 . 9 1 1 A 5 5 GLU HA H 5 4.050 3.951 0.099 1
1 46 . 9 1 1 A 5 5 GLU C C 5 177.030 179.428 -2.398 1
1 47 . 9 1 1 A 5 5 GLU CA C 5 59.840 59.353 0.487 1
1 48 . 9 1 1 A 5 5 GLU CB C 5 28.940 29.347 -0.407 1
1 50 . 9 1 1 A 5 5 GLU N N 5 119.780 119.216 0.564 1
1 51 . 9 1 1 A 6 6 THR H H 6 8.370 8.691 -0.321 1
1 52 . 9 1 1 A 6 6 THR HA H 6 4.310 3.917 0.393 1
1 57 . 9 1 1 A 6 6 THR C C 6 177.340 176.920 0.420 1
1 58 . 9 1 1 A 6 6 THR CA C 6 66.630 66.385 0.245 1
1 59 . 9 1 1 A 6 6 THR CB C 6 68.650 68.518 0.132 1
1 61 . 9 1 1 A 6 6 THR N N 6 116.940 118.014 -1.074 1
1 62 . 9 1 1 A 7 7 ALA H H 7 8.270 7.691 0.579 1
1 63 . 9 1 1 A 7 7 ALA HA H 7 4.190 4.037 0.153 1
1 67 . 9 1 1 A 7 7 ALA C C 7 179.760 179.429 0.331 1
1 68 . 9 1 1 A 7 7 ALA CA C 7 55.880 55.184 0.696 1
1 69 . 9 1 1 A 7 7 ALA CB C 7 17.720 18.101 -0.381 1
1 70 . 9 1 1 A 7 7 ALA N N 7 127.400 124.133 3.267 1
1 71 . 9 1 1 A 8 8 MET H H 8 8.110 7.611 0.499 1
1 72 . 9 1 1 A 8 8 MET HA H 8 4.020 4.187 -0.167 1
1 80 . 9 1 1 A 8 8 MET C C 8 178.510 178.012 0.498 1
1 81 . 9 1 1 A 8 8 MET CA C 8 60.580 58.013 2.567 1
1 82 . 9 1 1 A 8 8 MET CB C 8 33.630 32.261 1.369 1
1 85 . 9 1 1 A 8 8 MET N N 8 117.520 118.381 -0.861 1
1 86 . 9 1 1 A 9 9 GLU H H 9 8.210 8.047 0.163 1
1 87 . 9 1 1 A 9 9 GLU HA H 9 3.830 4.070 -0.240 1
1 92 . 9 1 1 A 9 9 GLU C C 9 179.140 178.525 0.615 1
1 93 . 9 1 1 A 9 9 GLU CA C 9 59.690 59.328 0.362 1
1 94 . 9 1 1 A 9 9 GLU CB C 9 29.530 28.979 0.551 1
1 96 . 9 1 1 A 9 9 GLU N N 9 118.560 118.034 0.526 1
1 97 . 9 1 1 A 10 10 THR H H 10 8.490 7.534 0.956 1
1 98 . 9 1 1 A 10 10 THR HA H 10 4.000 4.098 -0.098 1
1 103 . 9 1 1 A 10 10 THR C C 10 176.010 176.420 -0.410 1
1 104 . 9 1 1 A 10 10 THR CA C 10 67.110 65.848 1.262 1
1 105 . 9 1 1 A 10 10 THR CB C 10 67.770 69.061 -1.291 1
1 107 . 9 1 1 A 10 10 THR N N 10 118.310 115.549 2.761 1
1 108 . 9 1 1 A 11 11 LEU H H 11 7.920 7.815 0.105 1
1 109 . 9 1 1 A 11 11 LEU HA H 11 3.930 4.112 -0.182 1
1 119 . 9 1 1 A 11 11 LEU C C 11 178.820 179.211 -0.391 1
1 120 . 9 1 1 A 11 11 LEU CA C 11 59.690 58.319 1.371 1
1 121 . 9 1 1 A 11 11 LEU CB C 11 41.920 41.753 0.167 1
1 125 . 9 1 1 A 11 11 LEU N N 11 121.150 120.994 0.156 1
1 126 . 9 1 1 A 12 12 ILE H H 12 7.440 7.808 -0.368 1
1 127 . 9 1 1 A 12 12 ILE HA H 12 3.640 3.895 -0.255 1
1 137 . 9 1 1 A 12 12 ILE C C 12 179.530 179.143 0.387 1
1 138 . 9 1 1 A 12 12 ILE CA C 12 63.740 65.352 -1.612 1
1 139 . 9 1 1 A 12 12 ILE CB C 12 38.800 37.824 0.976 1
1 143 . 9 1 1 A 12 12 ILE N N 12 118.010 119.700 -1.690 1
1 144 . 9 1 1 A 13 13 ASN H H 13 8.930 7.918 1.012 1
1 145 . 9 1 1 A 13 13 ASN HA H 13 4.520 4.722 -0.202 1
1 148 . 9 1 1 A 13 13 ASN C C 13 179.450 177.925 1.525 1
1 149 . 9 1 1 A 13 13 ASN CA C 13 56.470 56.030 0.440 1
1 150 . 9 1 1 A 13 13 ASN CB C 13 37.930 38.821 -0.891 1
1 151 . 9 1 1 A 13 13 ASN N N 13 121.820 119.526 2.294 1
1 152 . 9 1 1 A 14 14 VAL H H 14 9.180 8.293 0.887 1
1 153 . 9 1 1 A 14 14 VAL HA H 14 3.830 3.857 -0.027 1
1 161 . 9 1 1 A 14 14 VAL CA C 14 65.840 65.478 0.362 1
1 162 . 9 1 1 A 14 14 VAL CB C 14 31.290 31.657 -0.367 1
1 165 . 9 1 1 A 14 14 VAL N N 14 122.040 119.402 2.638 1
1 166 . 9 1 1 A 15 15 PHE H H 15 7.590 8.279 -0.689 1
1 167 . 9 1 1 A 15 15 PHE HA H 15 3.360 4.019 -0.659 1
1 170 . 9 1 1 A 15 15 PHE C C 15 177.890 177.396 0.494 1
1 171 . 9 1 1 A 15 15 PHE CA C 15 62.030 62.005 0.025 1
1 172 . 9 1 1 A 15 15 PHE CB C 15 38.900 39.014 -0.114 1
1 173 . 9 1 1 A 15 15 PHE N N 15 118.290 122.223 -3.933 1
1 174 . 9 1 1 A 16 16 HIS H H 16 7.790 7.995 -0.205 1
1 175 . 9 1 1 A 16 16 HIS HA H 16 4.890 4.304 0.586 1
1 178 . 9 1 1 A 16 16 HIS C C 16 177.810 176.719 1.091 1
1 179 . 9 1 1 A 16 16 HIS CA C 16 59.100 60.077 -0.977 1
1 180 . 9 1 1 A 16 16 HIS CB C 16 28.060 29.441 -1.381 1
1 181 . 9 1 1 A 16 16 HIS N N 16 118.290 118.546 -0.256 1
1 182 . 9 1 1 A 17 17 ALA H H 17 8.040 7.922 0.118 1
1 183 . 9 1 1 A 17 17 ALA HA H 17 4.050 3.776 0.274 1
1 187 . 9 1 1 A 17 17 ALA C C 17 179.600 179.510 0.090 1
1 188 . 9 1 1 A 17 17 ALA CA C 17 54.000 55.058 -1.058 1
1 189 . 9 1 1 A 17 17 ALA CB C 17 17.520 18.506 -0.986 1
1 190 . 9 1 1 A 17 17 ALA N N 17 124.410 120.759 3.651 1
1 191 . 9 1 1 A 18 18 HIS H H 18 7.000 7.096 -0.096 1
1 192 . 9 1 1 A 18 18 HIS HA H 18 4.330 4.301 0.029 1
1 195 . 9 1 1 A 18 18 HIS C C 18 176.320 177.401 -1.081 1
1 196 . 9 1 1 A 18 18 HIS CA C 18 57.350 58.873 -1.523 1
1 197 . 9 1 1 A 18 18 HIS CB C 18 32.920 30.250 2.670 1
1 198 . 9 1 1 A 18 18 HIS N N 18 115.160 115.843 -0.683 1
1 199 . 9 1 1 A 19 19 SER H H 19 8.380 7.750 0.630 1
1 200 . 9 1 1 A 19 19 SER HA H 19 3.640 4.113 -0.473 1
1 203 . 9 1 1 A 19 19 SER C C 19 177.340 175.565 1.775 1
1 204 . 9 1 1 A 19 19 SER CA C 19 60.160 62.566 -2.406 1
1 205 . 9 1 1 A 19 19 SER CB C 19 61.000 61.864 -0.864 1
1 206 . 9 1 1 A 19 19 SER N N 19 114.380 115.073 -0.693 1
1 207 . 9 1 1 A 20 20 GLY H H 20 7.600 7.749 -0.149 1
1 208 . 9 1 1 A 20 20 GLY HA2 H 20 3.680 3.703 -0.023 1
1 209 . 9 1 1 A 20 20 GLY HA3 H 20 4.000 3.858 0.142 1
1 210 . 9 1 1 A 20 20 GLY C C 20 174.140 174.386 -0.246 1
1 211 . 9 1 1 A 20 20 GLY CA C 20 47.000 45.175 1.825 1
1 212 . 9 1 1 A 20 20 GLY N N 20 112.550 107.603 4.947 1
1 213 . 9 1 1 A 21 21 LYS H H 21 7.230 7.649 -0.419 1
1 214 . 9 1 1 A 21 21 LYS HA H 21 3.860 4.514 -0.654 1
1 223 . 9 1 1 A 21 21 LYS C C 21 177.730 177.679 0.051 1
1 224 . 9 1 1 A 21 21 LYS CA C 21 59.110 57.430 1.680 1
1 225 . 9 1 1 A 21 21 LYS CB C 21 32.460 35.008 -2.548 1
1 229 . 9 1 1 A 21 21 LYS N N 21 123.240 119.741 3.499 1
1 230 . 9 1 1 A 22 22 GLU H H 22 9.350 7.959 1.391 1
1 231 . 9 1 1 A 22 22 GLU HA H 22 4.610 4.375 0.235 1
1 236 . 9 1 1 A 22 22 GLU C C 22 177.420 175.892 1.528 1
1 237 . 9 1 1 A 22 22 GLU CA C 22 53.700 56.358 -2.658 1
1 238 . 9 1 1 A 22 22 GLU CB C 22 32.000 30.169 1.831 1
1 240 . 9 1 1 A 22 22 GLU N N 22 116.770 117.074 -0.304 1
1 241 . 9 1 1 A 23 23 GLY H H 23 7.570 7.540 0.030 1
1 242 . 9 1 1 A 23 23 GLY HA2 H 23 3.630 3.928 -0.298 1
1 243 . 9 1 1 A 23 23 GLY HA3 H 23 3.880 3.957 -0.077 1
1 244 . 9 1 1 A 23 23 GLY C C 23 173.980 171.719 2.261 1
1 245 . 9 1 1 A 23 23 GLY CA C 23 45.250 45.557 -0.307 1
1 246 . 9 1 1 A 23 23 GLY N N 23 112.180 107.218 4.962 1
1 247 . 9 1 1 A 24 24 ASP H H 24 8.680 8.403 0.277 1
1 248 . 9 1 1 A 24 24 ASP HA H 24 4.380 4.460 -0.080 1
1 251 . 9 1 1 A 24 24 ASP C C 24 178.590 177.426 1.164 1
1 252 . 9 1 1 A 24 24 ASP CA C 24 60.000 54.331 5.669 1
1 253 . 9 1 1 A 24 24 ASP CB C 24 27.480 40.969 -13.489 1
1 254 . 9 1 1 A 24 24 ASP N N 24 127.470 121.955 5.515 1
1 255 . 9 1 1 A 25 25 LYS H H 25 9.270 8.553 0.717 1
1 256 . 9 1 1 A 25 25 LYS HA H 25 4.250 3.894 0.356 1
1 265 . 9 1 1 A 25 25 LYS C C 25 177.030 177.849 -0.819 1
1 266 . 9 1 1 A 25 25 LYS CA C 25 60.000 60.274 -0.274 1
1 267 . 9 1 1 A 25 25 LYS CB C 25 31.170 32.370 -1.200 1
1 271 . 9 1 1 A 25 25 LYS N N 25 132.960 123.538 9.422 1
1 272 . 9 1 1 A 26 26 TYR H H 26 9.430 7.480 1.950 1
1 273 . 9 1 1 A 26 26 TYR HA H 26 4.640 4.946 -0.306 1
1 276 . 9 1 1 A 26 26 TYR C C 26 174.290 174.658 -0.368 1
1 277 . 9 1 1 A 26 26 TYR CA C 26 56.010 57.755 -1.745 1
1 278 . 9 1 1 A 26 26 TYR CB C 26 37.730 39.526 -1.796 1
1 279 . 9 1 1 A 26 26 TYR N N 26 120.650 115.113 5.537 1
1 280 . 9 1 1 A 27 27 LYS H H 27 7.110 7.121 -0.011 1
1 281 . 9 1 1 A 27 27 LYS HA H 27 5.110 5.072 0.038 1
1 290 . 9 1 1 A 27 27 LYS C C 27 175.150 174.171 0.979 1
1 291 . 9 1 1 A 27 27 LYS CA C 27 55.070 55.079 -0.009 1
1 292 . 9 1 1 A 27 27 LYS CB C 27 38.900 35.956 2.944 1
1 296 . 9 1 1 A 27 27 LYS N N 27 115.830 121.985 -6.155 1
1 297 . 9 1 1 A 28 28 LEU H H 28 9.820 8.464 1.356 1
1 298 . 9 1 1 A 28 28 LEU HA H 28 5.080 4.591 0.489 1
1 308 . 9 1 1 A 28 28 LEU C C 28 176.640 175.476 1.164 1
1 309 . 9 1 1 A 28 28 LEU CA C 28 52.660 54.340 -1.680 1
1 310 . 9 1 1 A 28 28 LEU CB C 28 42.710 43.746 -1.036 1
1 314 . 9 1 1 A 28 28 LEU N N 28 126.930 127.376 -0.446 1
1 315 . 9 1 1 A 29 29 SER H H 29 9.890 8.488 1.402 1
1 316 . 9 1 1 A 29 29 SER HA H 29 4.530 4.878 -0.348 1
1 319 . 9 1 1 A 29 29 SER C C 29 174.990 174.743 0.247 1
1 320 . 9 1 1 A 29 29 SER CA C 29 56.180 56.978 -0.798 1
1 321 . 9 1 1 A 29 29 SER CB C 29 65.550 66.882 -1.332 1
1 322 . 9 1 1 A 29 29 SER N N 29 121.600 115.647 5.953 1
1 323 . 9 1 1 A 30 30 LYS H H 30 8.850 8.787 0.063 1
1 324 . 9 1 1 A 30 30 LYS HA H 30 3.850 3.899 -0.049 1
1 333 . 9 1 1 A 30 30 LYS C C 30 175.620 177.490 -1.870 1
1 334 . 9 1 1 A 30 30 LYS CA C 30 60.860 60.118 0.742 1
1 335 . 9 1 1 A 30 30 LYS CB C 30 31.290 32.173 -0.883 1
1 339 . 9 1 1 A 30 30 LYS N N 30 121.260 124.653 -3.393 1
1 340 . 9 1 1 A 31 31 LYS H H 31 7.970 7.878 0.092 1
1 341 . 9 1 1 A 31 31 LYS HA H 31 3.880 3.973 -0.093 1
1 350 . 9 1 1 A 31 31 LYS C C 31 179.290 179.323 -0.033 1
1 351 . 9 1 1 A 31 31 LYS CA C 31 59.110 59.153 -0.043 1
1 352 . 9 1 1 A 31 31 LYS CB C 31 32.640 31.600 1.040 1
1 356 . 9 1 1 A 31 31 LYS N N 31 121.260 118.819 2.441 1
1 357 . 9 1 1 A 32 32 GLU H H 32 7.510 7.731 -0.221 1
1 358 . 9 1 1 A 32 32 GLU HA H 32 3.830 3.942 -0.112 1
1 363 . 9 1 1 A 32 32 GLU C C 32 179.290 179.413 -0.123 1
1 364 . 9 1 1 A 32 32 GLU CA C 32 58.590 58.811 -0.221 1
1 365 . 9 1 1 A 32 32 GLU CB C 32 30.120 29.698 0.422 1
1 367 . 9 1 1 A 32 32 GLU N N 32 120.090 119.879 0.211 1
1 368 . 9 1 1 A 33 33 LEU H H 33 8.970 7.762 1.208 1
1 369 . 9 1 1 A 33 33 LEU HA H 33 3.830 3.660 0.170 1
1 379 . 9 1 1 A 33 33 LEU C C 33 178.200 178.600 -0.400 1
1 380 . 9 1 1 A 33 33 LEU CA C 33 57.930 57.949 -0.019 1
1 381 . 9 1 1 A 33 33 LEU CB C 33 40.660 41.434 -0.774 1
1 385 . 9 1 1 A 33 33 LEU N N 33 120.200 119.373 0.827 1
1 386 . 9 1 1 A 34 34 LYS H H 34 8.230 7.645 0.585 1
1 387 . 9 1 1 A 34 34 LYS HA H 34 3.550 3.788 -0.238 1
1 396 . 9 1 1 A 34 34 LYS C C 34 178.040 178.352 -0.312 1
1 397 . 9 1 1 A 34 34 LYS CA C 34 60.720 59.988 0.732 1
1 398 . 9 1 1 A 34 34 LYS CB C 34 31.980 31.950 0.030 1
1 402 . 9 1 1 A 34 34 LYS N N 34 120.780 119.054 1.726 1
1 403 . 9 1 1 A 35 35 ASP H H 35 7.990 7.673 0.317 1
1 404 . 9 1 1 A 35 35 ASP HA H 35 4.250 4.380 -0.130 1
1 407 . 9 1 1 A 35 35 ASP C C 35 179.060 178.856 0.204 1
1 408 . 9 1 1 A 35 35 ASP CA C 35 56.830 56.740 0.090 1
1 409 . 9 1 1 A 35 35 ASP CB C 35 40.440 40.465 -0.025 1
1 410 . 9 1 1 A 35 35 ASP N N 35 119.550 119.449 0.101 1
1 411 . 9 1 1 A 36 36 LEU H H 36 8.130 7.647 0.483 1
1 412 . 9 1 1 A 36 36 LEU HA H 36 2.580 3.878 -1.298 1
1 422 . 9 1 1 A 36 36 LEU C C 36 179.450 179.706 -0.256 1
1 423 . 9 1 1 A 36 36 LEU CA C 36 59.980 57.951 2.029 1
1 424 . 9 1 1 A 36 36 LEU CB C 36 42.180 41.268 0.912 1
1 428 . 9 1 1 A 36 36 LEU N N 36 125.560 120.591 4.969 1
1 429 . 9 1 1 A 37 37 LEU H H 37 8.740 7.564 1.176 1
1 430 . 9 1 1 A 37 37 LEU HA H 37 3.580 4.010 -0.430 1
1 440 . 9 1 1 A 37 37 LEU C C 37 179.290 179.647 -0.357 1
1 441 . 9 1 1 A 37 37 LEU CA C 37 58.230 58.019 0.211 1
1 442 . 9 1 1 A 37 37 LEU CB C 37 41.590 41.564 0.026 1
1 446 . 9 1 1 A 37 37 LEU N N 37 120.520 119.731 0.789 1
1 447 . 9 1 1 A 38 38 GLN H H 38 8.520 8.040 0.480 1
1 448 . 9 1 1 A 38 38 GLN HA H 38 4.000 4.134 -0.134 1
1 453 . 9 1 1 A 38 38 GLN C C 38 177.960 178.578 -0.618 1
1 454 . 9 1 1 A 38 38 GLN CA C 38 58.210 57.900 0.310 1
1 455 . 9 1 1 A 38 38 GLN CB C 38 28.650 27.687 0.963 1
1 457 . 9 1 1 A 38 38 GLN N N 38 116.740 117.883 -1.143 1
1 458 . 9 1 1 A 39 39 THR H H 39 7.910 8.133 -0.223 1
1 459 . 9 1 1 A 39 39 THR HA H 39 4.210 3.885 0.325 1
1 464 . 9 1 1 A 39 39 THR C C 39 177.180 176.155 1.025 1
1 465 . 9 1 1 A 39 39 THR CA C 39 64.730 65.552 -0.822 1
1 466 . 9 1 1 A 39 39 THR CB C 39 69.650 68.956 0.694 1
1 468 . 9 1 1 A 39 39 THR N N 39 111.400 115.239 -3.839 1
1 469 . 9 1 1 A 40 40 GLU H H 40 8.590 8.136 0.454 1
1 470 . 9 1 1 A 40 40 GLU HA H 40 4.680 4.549 0.131 1
1 475 . 9 1 1 A 40 40 GLU C C 40 178.280 177.877 0.403 1
1 476 . 9 1 1 A 40 40 GLU CA C 40 55.880 57.268 -1.388 1
1 477 . 9 1 1 A 40 40 GLU CB C 40 30.990 31.523 -0.533 1
1 479 . 9 1 1 A 40 40 GLU N N 40 117.840 120.112 -2.272 1
1 480 . 9 1 1 A 41 41 LEU H H 41 7.680 7.386 0.294 1
1 481 . 9 1 1 A 41 41 LEU HA H 41 5.080 4.794 0.286 1
1 491 . 9 1 1 A 41 41 LEU C C 41 179.450 177.023 2.427 1
1 492 . 9 1 1 A 41 41 LEU CA C 41 53.830 54.421 -0.591 1
1 493 . 9 1 1 A 41 41 LEU CB C 41 41.360 42.151 -0.791 1
1 497 . 9 1 1 A 41 41 LEU N N 41 121.410 119.490 1.920 1
1 498 . 9 1 1 A 42 42 SER H H 42 8.380 8.025 0.355 1
1 499 . 9 1 1 A 42 42 SER HA H 42 4.130 4.099 0.031 1
1 502 . 9 1 1 A 42 42 SER C C 42 176.640 177.005 -0.365 1
1 503 . 9 1 1 A 42 42 SER CA C 42 61.280 61.642 -0.362 1
1 504 . 9 1 1 A 42 42 SER CB C 42 63.040 63.050 -0.010 1
1 505 . 9 1 1 A 42 42 SER N N 42 117.420 117.383 0.037 1
1 506 . 9 1 1 A 43 43 SER H H 43 8.900 8.090 0.810 1
1 507 . 9 1 1 A 43 43 SER HA H 43 4.290 4.315 -0.025 1
1 510 . 9 1 1 A 43 43 SER C C 43 175.620 177.047 -1.427 1
1 511 . 9 1 1 A 43 43 SER CA C 43 60.860 61.089 -0.229 1
1 512 . 9 1 1 A 43 43 SER CB C 43 62.910 63.066 -0.156 1
1 513 . 9 1 1 A 43 43 SER N N 43 117.580 115.530 2.050 1
1 514 . 9 1 1 A 44 44 PHE H H 44 7.880 8.114 -0.234 1
1 515 . 9 1 1 A 44 44 PHE HA H 44 4.240 4.219 0.021 1
1 518 . 9 1 1 A 44 44 PHE C C 44 176.950 175.928 1.022 1
1 519 . 9 1 1 A 44 44 PHE CA C 44 62.710 61.342 1.368 1
1 520 . 9 1 1 A 44 44 PHE CB C 44 39.020 39.028 -0.008 1
1 521 . 9 1 1 A 44 44 PHE N N 44 119.480 122.461 -2.981 1
1 522 . 9 1 1 A 45 45 LEU H H 45 8.060 7.614 0.446 1
1 523 . 9 1 1 A 45 45 LEU HA H 45 3.810 3.532 0.278 1
1 533 . 9 1 1 A 45 45 LEU C C 45 177.500 176.171 1.329 1
1 534 . 9 1 1 A 45 45 LEU CA C 45 59.980 55.030 4.950 1
1 535 . 9 1 1 A 45 45 LEU CB C 45 39.640 42.145 -2.505 1
1 538 . 9 1 1 A 45 45 LEU N N 45 118.010 120.815 -2.805 1
1 539 . 9 1 1 A 46 46 ASP H H 46 8.150 8.517 -0.367 1
1 540 . 9 1 1 A 46 46 ASP HA H 46 4.470 4.681 -0.211 1
1 543 . 9 1 1 A 46 46 ASP C C 46 179.920 175.992 3.928 1
1 544 . 9 1 1 A 46 46 ASP CA C 46 52.950 52.868 0.082 1
1 545 . 9 1 1 A 46 46 ASP CB C 46 40.000 40.638 -0.638 1
1 546 . 9 1 1 A 46 46 ASP N N 46 119.460 124.428 -4.968 1
1 547 . 9 1 1 A 47 47 VAL H H 47 8.010 8.396 -0.386 1
1 548 . 9 1 1 A 47 47 VAL HA H 47 3.800 4.402 -0.602 1
1 556 . 9 1 1 A 47 47 VAL C C 47 175.460 177.012 -1.552 1
1 557 . 9 1 1 A 47 47 VAL CA C 47 60.000 62.639 -2.639 1
1 558 . 9 1 1 A 47 47 VAL CB C 47 31.580 33.264 -1.684 1
1 561 . 9 1 1 A 47 47 VAL N N 47 117.720 121.297 -3.577 1
1 562 . 9 1 1 A 48 48 GLN H H 48 7.960 8.586 -0.626 1
1 563 . 9 1 1 A 48 48 GLN HA H 48 4.060 3.944 0.116 1
1 568 . 9 1 1 A 48 48 GLN C C 48 179.370 178.793 0.577 1
1 569 . 9 1 1 A 48 48 GLN CA C 48 57.350 58.933 -1.583 1
1 570 . 9 1 1 A 48 48 GLN CB C 48 28.990 28.227 0.763 1
1 572 . 9 1 1 A 48 48 GLN N N 48 119.900 122.428 -2.528 1
1 573 . 9 1 1 A 49 49 LYS H H 49 7.810 7.786 0.024 1
1 574 . 9 1 1 A 49 49 LYS HA H 49 3.860 4.174 -0.314 1
1 583 . 9 1 1 A 49 49 LYS C C 49 177.890 176.052 1.838 1
1 584 . 9 1 1 A 49 49 LYS CA C 49 58.230 58.681 -0.451 1
1 585 . 9 1 1 A 49 49 LYS CB C 49 30.990 32.359 -1.369 1
1 587 . 9 1 1 A 49 49 LYS N N 49 120.030 119.541 0.489 1
1 588 . 9 1 1 A 50 50 ASP H H 50 7.570 7.804 -0.234 1
1 589 . 9 1 1 A 50 50 ASP HA H 50 4.700 4.902 -0.202 1
1 590 . 9 1 1 A 50 50 ASP CA C 50 52.950 52.865 0.085 1
1 591 . 9 1 1 A 50 50 ASP CB C 50 38.900 41.441 -2.541 1
1 592 . 9 1 1 A 50 50 ASP N N 50 116.730 118.851 -2.121 1
1 593 . 9 1 1 A 51 51 ALA H H 51 7.570 8.757 -1.187 1
1 594 . 9 1 1 A 51 51 ALA HA H 51 4.200 4.071 0.129 1
1 598 . 9 1 1 A 51 51 ALA C C 51 179.760 179.311 0.449 1
1 599 . 9 1 1 A 51 51 ALA CA C 51 54.200 55.293 -1.093 1
1 600 . 9 1 1 A 51 51 ALA CB C 51 18.110 18.490 -0.380 1
1 601 . 9 1 1 A 51 51 ALA N N 51 118.390 127.865 -9.475 1
1 602 . 9 1 1 A 52 52 ASP H H 52 8.430 8.365 0.065 1
1 603 . 9 1 1 A 52 52 ASP HA H 52 4.600 4.356 0.244 1
1 606 . 9 1 1 A 52 52 ASP C C 52 177.570 178.449 -0.879 1
1 607 . 9 1 1 A 52 52 ASP CA C 52 54.420 56.806 -2.386 1
1 608 . 9 1 1 A 52 52 ASP CB C 52 40.360 40.122 0.238 1
1 609 . 9 1 1 A 52 52 ASP N N 52 117.530 119.347 -1.817 1
1 610 . 9 1 1 A 53 53 ALA H H 53 7.660 7.926 -0.266 1
1 611 . 9 1 1 A 53 53 ALA HA H 53 3.860 4.013 -0.153 1
1 615 . 9 1 1 A 53 53 ALA C C 53 180.070 180.544 -0.474 1
1 616 . 9 1 1 A 53 53 ALA CA C 53 55.590 55.380 0.210 1
1 617 . 9 1 1 A 53 53 ALA CB C 53 18.800 18.184 0.616 1
1 618 . 9 1 1 A 53 53 ALA N N 53 123.450 122.536 0.914 1
1 619 . 9 1 1 A 54 54 VAL H H 54 8.030 8.067 -0.037 1
1 620 . 9 1 1 A 54 54 VAL HA H 54 3.240 3.577 -0.337 1
1 628 . 9 1 1 A 54 54 VAL C C 54 177.340 177.798 -0.458 1
1 629 . 9 1 1 A 54 54 VAL CA C 54 66.620 66.460 0.160 1
1 630 . 9 1 1 A 54 54 VAL CB C 54 30.480 31.209 -0.729 1
1 633 . 9 1 1 A 54 54 VAL N N 54 116.150 117.926 -1.776 1
1 634 . 9 1 1 A 55 55 ASP H H 55 7.660 8.029 -0.369 1
1 635 . 9 1 1 A 55 55 ASP HA H 55 4.080 4.388 -0.308 1
1 638 . 9 1 1 A 55 55 ASP C C 55 177.260 179.378 -2.118 1
1 639 . 9 1 1 A 55 55 ASP CA C 55 57.640 57.360 0.280 1
1 640 . 9 1 1 A 55 55 ASP CB C 55 40.360 40.011 0.349 1
1 641 . 9 1 1 A 55 55 ASP N N 55 120.830 121.127 -0.297 1
1 642 . 9 1 1 A 56 56 LYS H H 56 7.780 7.573 0.207 1
1 643 . 9 1 1 A 56 56 LYS HA H 56 3.860 4.024 -0.164 1
1 652 . 9 1 1 A 56 56 LYS C C 56 179.530 179.421 0.109 1
1 653 . 9 1 1 A 56 56 LYS CA C 56 59.690 59.735 -0.045 1
1 654 . 9 1 1 A 56 56 LYS CB C 56 31.870 32.517 -0.647 1
1 658 . 9 1 1 A 56 56 LYS N N 56 120.010 119.288 0.722 1
1 659 . 9 1 1 A 57 57 ILE H H 57 8.090 7.824 0.266 1
1 660 . 9 1 1 A 57 57 ILE HA H 57 3.390 3.636 -0.246 1
1 670 . 9 1 1 A 57 57 ILE C C 57 176.710 177.732 -1.022 1
1 671 . 9 1 1 A 57 57 ILE CA C 57 64.960 65.115 -0.155 1
1 672 . 9 1 1 A 57 57 ILE CB C 57 38.080 38.488 -0.408 1
1 676 . 9 1 1 A 57 57 ILE N N 57 120.960 120.515 0.445 1
1 677 . 9 1 1 A 58 58 MET H H 58 8.480 8.412 0.068 1
1 678 . 9 1 1 A 58 58 MET HA H 58 3.800 4.084 -0.284 1
1 686 . 9 1 1 A 58 58 MET C C 58 177.570 178.136 -0.566 1
1 687 . 9 1 1 A 58 58 MET CA C 58 58.570 58.531 0.039 1
1 688 . 9 1 1 A 58 58 MET CB C 58 32.570 31.640 0.930 1
1 691 . 9 1 1 A 58 58 MET N N 58 119.160 120.582 -1.422 1
1 692 . 9 1 1 A 59 59 LYS H H 59 7.550 7.883 -0.333 1
1 693 . 9 1 1 A 59 59 LYS HA H 59 3.930 3.964 -0.034 1
1 702 . 9 1 1 A 59 59 LYS C C 59 179.530 179.461 0.069 1
1 703 . 9 1 1 A 59 59 LYS CA C 59 58.820 60.007 -1.187 1
1 704 . 9 1 1 A 59 59 LYS CB C 59 32.450 32.177 0.273 1
1 708 . 9 1 1 A 59 59 LYS N N 59 116.730 118.875 -2.145 1
1 709 . 9 1 1 A 60 60 GLU H H 60 7.470 7.521 -0.051 1
1 710 . 9 1 1 A 60 60 GLU HA H 60 4.050 4.111 -0.061 1
1 715 . 9 1 1 A 60 60 GLU C C 60 178.950 178.111 0.839 1
1 716 . 9 1 1 A 60 60 GLU CA C 60 58.600 58.764 -0.164 1
1 717 . 9 1 1 A 60 60 GLU CB C 60 31.700 29.653 2.047 1
1 719 . 9 1 1 A 60 60 GLU N N 60 116.820 119.748 -2.928 1
1 720 . 9 1 1 A 61 61 LEU H H 61 8.030 7.979 0.051 1
1 721 . 9 1 1 A 61 61 LEU HA H 61 4.310 4.315 -0.005 1
1 731 . 9 1 1 A 61 61 LEU C C 61 179.450 177.289 2.161 1
1 732 . 9 1 1 A 61 61 LEU CA C 61 54.840 55.667 -0.827 1
1 733 . 9 1 1 A 61 61 LEU CB C 61 43.820 42.372 1.448 1
1 737 . 9 1 1 A 61 61 LEU N N 61 116.000 118.561 -2.561 1
1 738 . 9 1 1 A 62 62 ASP H H 62 7.890 8.697 -0.807 1
1 739 . 9 1 1 A 62 62 ASP HA H 62 4.660 4.853 -0.193 1
1 742 . 9 1 1 A 62 62 ASP C C 62 177.030 176.149 0.881 1
1 743 . 9 1 1 A 62 62 ASP CA C 62 53.660 53.828 -0.168 1
1 744 . 9 1 1 A 62 62 ASP CB C 62 38.700 39.646 -0.946 1
1 745 . 9 1 1 A 62 62 ASP N N 62 117.550 118.588 -1.038 1
1 746 . 9 1 1 A 63 63 GLU H H 63 8.430 9.273 -0.843 1
1 747 . 9 1 1 A 63 63 GLU HA H 63 4.020 4.040 -0.020 1
1 752 . 9 1 1 A 63 63 GLU C C 63 178.120 178.762 -0.642 1
1 753 . 9 1 1 A 63 63 GLU CA C 63 58.470 59.286 -0.816 1
1 754 . 9 1 1 A 63 63 GLU CB C 63 30.120 29.417 0.703 1
1 756 . 9 1 1 A 63 63 GLU N N 63 130.230 120.517 9.713 1
1 757 . 9 1 1 A 64 64 ASN H H 64 8.010 7.947 0.063 1
1 758 . 9 1 1 A 64 64 ASN HA H 64 4.680 4.647 0.033 1
1 761 . 9 1 1 A 64 64 ASN C C 64 177.100 176.371 0.729 1
1 762 . 9 1 1 A 64 64 ASN CA C 64 51.780 52.583 -0.803 1
1 763 . 9 1 1 A 64 64 ASN CB C 64 37.260 37.885 -0.625 1
1 764 . 9 1 1 A 64 64 ASN N N 64 113.640 114.323 -0.683 1
1 765 . 9 1 1 A 65 65 GLY H H 65 7.550 8.065 -0.515 1
1 766 . 9 1 1 A 65 65 GLY HA2 H 65 3.770 3.952 -0.182 1
1 767 . 9 1 1 A 65 65 GLY HA3 H 65 3.770 3.953 -0.183 1
1 768 . 9 1 1 A 65 65 GLY C C 65 178.980 175.016 3.964 1
1 769 . 9 1 1 A 65 65 GLY CA C 65 47.200 46.670 0.530 1
1 770 . 9 1 1 A 65 65 GLY N N 65 113.640 108.875 4.765 1
1 771 . 9 1 1 A 66 66 ASP H H 66 8.110 9.030 -0.920 1
1 772 . 9 1 1 A 66 66 ASP HA H 66 4.490 4.593 -0.103 1
1 775 . 9 1 1 A 66 66 ASP C C 66 177.960 177.625 0.335 1
1 776 . 9 1 1 A 66 66 ASP CA C 66 52.960 53.463 -0.503 1
1 777 . 9 1 1 A 66 66 ASP CB C 66 40.540 40.462 0.078 1
1 778 . 9 1 1 A 66 66 ASP N N 66 120.030 120.116 -0.086 1
1 779 . 9 1 1 A 67 67 GLY H H 67 10.260 9.018 1.242 1
1 780 . 9 1 1 A 67 67 GLY HA2 H 67 3.360 3.892 -0.532 1
1 781 . 9 1 1 A 67 67 GLY HA3 H 67 4.000 3.894 0.106 1
1 782 . 9 1 1 A 67 67 GLY C C 67 173.120 173.450 -0.330 1
1 783 . 9 1 1 A 67 67 GLY CA C 67 45.460 45.908 -0.448 1
1 784 . 9 1 1 A 67 67 GLY N N 67 114.100 110.476 3.624 1
1 785 . 9 1 1 A 68 68 GLU H H 68 7.750 8.205 -0.455 1
1 786 . 9 1 1 A 68 68 GLU HA H 68 4.780 4.929 -0.149 1
1 791 . 9 1 1 A 68 68 GLU C C 68 175.930 174.788 1.142 1
1 792 . 9 1 1 A 68 68 GLU CA C 68 54.430 54.410 0.020 1
1 793 . 9 1 1 A 68 68 GLU CB C 68 35.850 33.659 2.191 1
1 795 . 9 1 1 A 68 68 GLU N N 68 118.000 119.450 -1.450 1
1 796 . 9 1 1 A 69 69 VAL H H 69 9.380 8.519 0.861 1
1 797 . 9 1 1 A 69 69 VAL HA H 69 5.260 5.063 0.197 1
1 805 . 9 1 1 A 69 69 VAL C C 69 176.710 173.500 3.210 1
1 806 . 9 1 1 A 69 69 VAL CA C 69 61.280 60.879 0.401 1
1 807 . 9 1 1 A 69 69 VAL CB C 69 33.980 34.773 -0.793 1
1 810 . 9 1 1 A 69 69 VAL N N 69 125.970 121.225 4.745 1
1 811 . 9 1 1 A 70 70 ASP H H 70 9.100 9.607 -0.507 1
1 812 . 9 1 1 A 70 70 ASP HA H 70 5.190 5.125 0.065 1
1 815 . 9 1 1 A 70 70 ASP C C 70 175.700 177.020 -1.320 1
1 816 . 9 1 1 A 70 70 ASP CA C 70 52.370 53.697 -1.327 1
1 817 . 9 1 1 A 70 70 ASP CB C 70 40.950 42.874 -1.924 1
1 818 . 9 1 1 A 70 70 ASP N N 70 130.320 127.471 2.849 1
1 819 . 9 1 1 A 71 71 PHE H H 71 9.090 9.247 -0.157 1
1 820 . 9 1 1 A 71 71 PHE HA H 71 4.100 4.099 0.001 1
1 823 . 9 1 1 A 71 71 PHE C C 71 177.000 177.536 -0.536 1
1 824 . 9 1 1 A 71 71 PHE CA C 71 58.230 62.193 -3.963 1
1 825 . 9 1 1 A 71 71 PHE CB C 71 36.910 39.559 -2.649 1
1 826 . 9 1 1 A 71 71 PHE N N 71 119.760 127.634 -7.874 1
1 827 . 9 1 1 A 72 72 GLN H H 72 8.440 8.323 0.117 1
1 828 . 9 1 1 A 72 72 GLN HA H 72 3.600 3.945 -0.345 1
1 831 . 9 1 1 A 72 72 GLN C C 72 178.820 178.279 0.541 1
1 832 . 9 1 1 A 72 72 GLN CA C 72 59.500 58.779 0.721 1
1 833 . 9 1 1 A 72 72 GLN CB C 72 29.553 28.337 1.216 1
1 835 . 9 1 1 A 72 72 GLN N N 72 121.820 117.989 3.831 1
1 836 . 9 1 1 A 73 73 GLU H H 73 8.290 8.429 -0.139 1
1 837 . 9 1 1 A 73 73 GLU HA H 73 4.070 4.065 0.005 1
1 842 . 9 1 1 A 73 73 GLU C C 73 179.370 178.943 0.427 1
1 843 . 9 1 1 A 73 73 GLU CA C 73 58.030 58.907 -0.877 1
1 844 . 9 1 1 A 73 73 GLU CB C 73 29.530 29.684 -0.154 1
1 846 . 9 1 1 A 73 73 GLU N N 73 120.550 119.788 0.762 1
1 847 . 9 1 1 A 74 74 PHE H H 74 8.630 8.383 0.247 1
1 848 . 9 1 1 A 74 74 PHE HA H 74 4.020 4.147 -0.127 1
1 851 . 9 1 1 A 74 74 PHE C C 74 177.890 177.808 0.082 1
1 852 . 9 1 1 A 74 74 PHE CA C 74 60.090 61.356 -1.266 1
1 853 . 9 1 1 A 74 74 PHE CB C 74 38.020 39.135 -1.115 1
1 854 . 9 1 1 A 74 74 PHE N N 74 121.010 121.732 -0.722 1
1 855 . 9 1 1 A 75 75 VAL H H 75 8.080 8.158 -0.078 1
1 856 . 9 1 1 A 75 75 VAL HA H 75 2.860 3.376 -0.516 1
1 864 . 9 1 1 A 75 75 VAL C C 75 177.030 177.343 -0.313 1
1 865 . 9 1 1 A 75 75 VAL CA C 75 66.430 64.413 2.017 1
1 866 . 9 1 1 A 75 75 VAL CB C 75 30.600 31.196 -0.596 1
1 869 . 9 1 1 A 75 75 VAL N N 75 119.460 118.733 0.727 1
1 870 . 9 1 1 A 76 76 VAL H H 76 7.100 8.007 -0.907 1
1 871 . 9 1 1 A 76 76 VAL HA H 76 3.330 3.686 -0.356 1
1 879 . 9 1 1 A 76 76 VAL C C 76 178.670 177.688 0.982 1
1 880 . 9 1 1 A 76 76 VAL CA C 76 67.000 65.829 1.171 1
1 881 . 9 1 1 A 76 76 VAL CB C 76 31.280 31.161 0.119 1
1 884 . 9 1 1 A 76 76 VAL N N 76 121.030 119.548 1.482 1
1 885 . 9 1 1 A 77 77 LEU H H 77 6.900 7.821 -0.921 1
1 886 . 9 1 1 A 77 77 LEU HA H 77 3.800 4.057 -0.257 1
1 896 . 9 1 1 A 77 77 LEU C C 77 177.960 178.533 -0.573 1
1 897 . 9 1 1 A 77 77 LEU CA C 77 57.710 58.145 -0.435 1
1 898 . 9 1 1 A 77 77 LEU CB C 77 40.070 41.918 -1.848 1
1 902 . 9 1 1 A 77 77 LEU N N 77 120.310 122.437 -2.127 1
1 903 . 9 1 1 A 78 78 VAL H H 78 7.240 7.559 -0.319 1
1 904 . 9 1 1 A 78 78 VAL HA H 78 3.030 3.768 -0.738 1
1 912 . 9 1 1 A 78 78 VAL C C 78 179.600 178.097 1.503 1
1 913 . 9 1 1 A 78 78 VAL CA C 78 66.420 66.188 0.232 1
1 914 . 9 1 1 A 78 78 VAL CB C 78 30.700 31.437 -0.737 1
1 917 . 9 1 1 A 78 78 VAL N N 78 117.180 119.466 -2.286 1
1 918 . 9 1 1 A 79 79 ALA H H 79 9.000 8.278 0.722 1
1 919 . 9 1 1 A 79 79 ALA HA H 79 3.610 3.883 -0.273 1
1 923 . 9 1 1 A 79 79 ALA C C 79 182.260 180.175 2.085 1
1 924 . 9 1 1 A 79 79 ALA CA C 79 55.580 55.609 -0.029 1
1 925 . 9 1 1 A 79 79 ALA CB C 79 18.400 17.759 0.641 1
1 926 . 9 1 1 A 79 79 ALA N N 79 126.000 122.038 3.962 1
1 927 . 9 1 1 A 80 80 ALA H H 80 8.000 7.653 0.347 1
1 928 . 9 1 1 A 80 80 ALA HA H 80 4.100 4.068 0.032 1
1 932 . 9 1 1 A 80 80 ALA C C 80 175.460 179.911 -4.451 1
1 933 . 9 1 1 A 80 80 ALA CA C 80 56.020 54.641 1.379 1
1 934 . 9 1 1 A 80 80 ALA CB C 80 18.040 18.413 -0.373 1
1 935 . 9 1 1 A 80 80 ALA N N 80 120.730 121.014 -0.284 1
1 936 . 9 1 1 A 81 81 LEU H H 81 8.460 7.760 0.700 1
1 937 . 9 1 1 A 81 81 LEU HA H 81 4.000 4.079 -0.079 1
1 941 . 9 1 1 A 81 81 LEU C C 81 177.030 179.040 -2.010 1
1 942 . 9 1 1 A 81 81 LEU CA C 81 57.640 57.618 0.022 1
1 943 . 9 1 1 A 81 81 LEU CB C 81 40.620 42.105 -1.485 1
1 945 . 9 1 1 A 81 81 LEU N N 81 119.890 119.831 0.059 1
1 946 . 9 1 1 A 82 82 THR H H 82 8.320 7.835 0.485 1
1 947 . 9 1 1 A 82 82 THR HA H 82 3.800 3.994 -0.194 1
1 952 . 9 1 1 A 82 82 THR C C 82 181.010 176.874 4.136 1
1 953 . 9 1 1 A 82 82 THR CA C 82 68.500 66.164 2.336 1
1 954 . 9 1 1 A 82 82 THR CB C 82 67.400 69.240 -1.840 1
1 956 . 9 1 1 A 82 82 THR N N 82 117.120 113.145 3.975 1
1 957 . 9 1 1 A 83 83 VAL H H 83 8.530 7.491 1.039 1
1 958 . 9 1 1 A 83 83 VAL HA H 83 3.890 3.820 0.070 1
1 966 . 9 1 1 A 83 83 VAL C C 83 178.120 178.172 -0.052 1
1 967 . 9 1 1 A 83 83 VAL CA C 83 67.400 65.138 2.262 1
1 968 . 9 1 1 A 83 83 VAL CB C 83 31.590 31.516 0.074 1
1 971 . 9 1 1 A 83 83 VAL N N 83 119.760 118.071 1.689 1
1 972 . 9 1 1 A 84 84 ALA H H 84 7.910 8.011 -0.101 1
1 973 . 9 1 1 A 84 84 ALA HA H 84 4.060 4.077 -0.017 1
1 977 . 9 1 1 A 84 84 ALA C C 84 180.560 179.872 0.688 1
1 978 . 9 1 1 A 84 84 ALA CA C 84 55.000 55.214 -0.214 1
1 979 . 9 1 1 A 84 84 ALA CB C 84 17.230 18.267 -1.037 1
1 980 . 9 1 1 A 84 84 ALA N N 84 122.620 124.449 -1.829 1
1 981 . 9 1 1 A 85 85 CYS H H 85 8.580 7.841 0.739 1
1 982 . 9 1 1 A 85 85 CYS HA H 85 4.080 4.400 -0.320 1
1 985 . 9 1 1 A 85 85 CYS C C 85 179.060 177.130 1.930 1
1 986 . 9 1 1 A 85 85 CYS CA C 85 63.210 61.480 1.730 1
1 987 . 9 1 1 A 85 85 CYS CB C 85 26.310 27.122 -0.812 1
1 988 . 9 1 1 A 85 85 CYS N N 85 118.730 117.354 1.376 1
1 989 . 9 1 1 A 86 86 ASN H H 86 8.430 8.023 0.407 1
1 990 . 9 1 1 A 86 86 ASN CA C 86 55.860 56.862 -1.002 1
1 991 . 9 1 1 A 86 86 ASN CB C 86 37.440 40.076 -2.636 1
1 992 . 9 1 1 A 86 86 ASN N N 86 119.360 119.283 0.077 1
1 993 . 9 1 1 A 87 87 ASN H H 87 7.880 7.997 -0.117 1
1 994 . 9 1 1 A 87 87 ASN HA H 87 4.600 4.544 0.056 1
1 997 . 9 1 1 A 87 87 ASN C C 87 178.510 177.799 0.711 1
1 998 . 9 1 1 A 87 87 ASN CA C 87 56.470 56.821 -0.351 1
1 999 . 9 1 1 A 87 87 ASN CB C 87 37.500 38.203 -0.703 1
1 1000 . 9 1 1 A 87 87 ASN N N 87 119.480 117.066 2.414 1
1 1001 . 9 1 1 A 88 88 PHE H H 88 8.050 7.648 0.402 1
1 1002 . 9 1 1 A 88 88 PHE HA H 88 4.200 4.576 -0.376 1
1 1005 . 9 1 1 A 88 88 PHE C C 88 178.510 177.552 0.958 1
1 1006 . 9 1 1 A 88 88 PHE CA C 88 56.460 59.357 -2.897 1
1 1007 . 9 1 1 A 88 88 PHE CB C 88 38.500 38.455 0.045 1
1 1008 . 9 1 1 A 88 88 PHE N N 88 120.280 118.034 2.246 1
1 1009 . 9 1 1 A 89 89 PHE H H 89 8.020 8.266 -0.246 1
1 1010 . 9 1 1 A 89 89 PHE HA H 89 4.000 4.273 -0.273 1
1 1013 . 9 1 1 A 89 89 PHE C C 89 177.340 177.827 -0.487 1
1 1014 . 9 1 1 A 89 89 PHE CA C 89 59.000 60.066 -1.066 1
1 1015 . 9 1 1 A 89 89 PHE CB C 89 37.430 39.762 -2.332 1
1 1016 . 9 1 1 A 89 89 PHE N N 89 120.910 119.557 1.353 1
1 1017 . 9 1 1 A 90 90 TRP H H 90 7.800 8.304 -0.504 1
1 1018 . 9 1 1 A 90 90 TRP HA H 90 4.460 4.467 -0.007 1
1 1021 . 9 1 1 A 90 90 TRP C C 90 177.340 175.345 1.995 1
1 1022 . 9 1 1 A 90 90 TRP CA C 90 57.930 59.149 -1.219 1
1 1023 . 9 1 1 A 90 90 TRP CB C 90 42.000 30.218 11.782 1
1 1024 . 9 1 1 A 90 90 TRP N N 90 120.050 120.971 -0.921 1
1 1025 . 9 1 1 A 91 91 GLU H H 91 7.800 7.493 0.307 1
1 1026 . 9 1 1 A 91 91 GLU HA H 91 4.050 4.039 0.011 1
1 1031 . 9 1 1 A 91 91 GLU C C 91 177.570 175.947 1.623 1
1 1032 . 9 1 1 A 91 91 GLU CA C 91 57.350 56.644 0.706 1
1 1033 . 9 1 1 A 91 91 GLU CB C 91 29.530 30.144 -0.614 1
1 1035 . 9 1 1 A 91 91 GLU N N 91 120.730 117.495 3.235 1
1 1036 . 9 1 1 A 92 92 ASN H H 92 7.800 8.999 -1.199 1
1 1037 . 9 1 1 A 92 92 ASN HA H 92 4.630 4.220 0.410 1
1 1040 . 9 1 1 A 92 92 ASN C C 92 174.450 174.275 0.175 1
1 1041 . 9 1 1 A 92 92 ASN CA C 92 52.960 54.290 -1.330 1
1 1042 . 9 1 1 A 92 92 ASN CB C 92 29.530 36.762 -7.232 1
1 1043 . 9 1 1 A 92 92 ASN N N 92 119.410 116.282 3.128 1
1 5 . 10 1 1 A 2 2 SER H H 2 9.000 7.612 1.388 1
1 6 . 10 1 1 A 2 2 SER HA H 2 4.690 4.424 0.266 1
1 9 . 10 1 1 A 2 2 SER C C 2 176.170 175.511 0.659 1
1 10 . 10 1 1 A 2 2 SER CA C 2 57.340 58.211 -0.871 1
1 11 . 10 1 1 A 2 2 SER CB C 2 65.550 65.139 0.411 1
1 12 . 10 1 1 A 2 2 SER N N 2 119.330 115.738 3.592 1
1 13 . 10 1 1 A 3 3 GLU H H 3 9.350 9.030 0.320 1
1 14 . 10 1 1 A 3 3 GLU HA H 3 4.060 4.021 0.039 1
1 17 . 10 1 1 A 3 3 GLU C C 3 180.150 178.849 1.301 1
1 18 . 10 1 1 A 3 3 GLU CA C 3 60.280 59.546 0.734 1
1 19 . 10 1 1 A 3 3 GLU CB C 3 29.230 29.016 0.214 1
1 21 . 10 1 1 A 3 3 GLU N N 3 125.350 120.532 4.818 1
1 22 . 10 1 1 A 4 4 LEU H H 4 9.060 8.097 0.963 1
1 23 . 10 1 1 A 4 4 LEU HA H 4 4.080 4.109 -0.029 1
1 33 . 10 1 1 A 4 4 LEU C C 4 177.890 178.309 -0.419 1
1 34 . 10 1 1 A 4 4 LEU CA C 4 58.090 57.995 0.095 1
1 35 . 10 1 1 A 4 4 LEU CB C 4 42.120 42.453 -0.333 1
1 39 . 10 1 1 A 4 4 LEU N N 4 121.090 122.282 -1.192 1
1 40 . 10 1 1 A 5 5 GLU H H 5 8.340 8.230 0.110 1
1 41 . 10 1 1 A 5 5 GLU HA H 5 4.050 3.926 0.124 1
1 46 . 10 1 1 A 5 5 GLU C C 5 177.030 179.022 -1.992 1
1 47 . 10 1 1 A 5 5 GLU CA C 5 59.840 59.686 0.154 1
1 48 . 10 1 1 A 5 5 GLU CB C 5 28.940 29.416 -0.476 1
1 50 . 10 1 1 A 5 5 GLU N N 5 119.780 119.024 0.756 1
1 51 . 10 1 1 A 6 6 THR H H 6 8.370 8.108 0.262 1
1 52 . 10 1 1 A 6 6 THR HA H 6 4.310 3.941 0.369 1
1 57 . 10 1 1 A 6 6 THR C C 6 177.340 176.974 0.366 1
1 58 . 10 1 1 A 6 6 THR CA C 6 66.630 65.940 0.690 1
1 59 . 10 1 1 A 6 6 THR CB C 6 68.650 68.864 -0.214 1
1 61 . 10 1 1 A 6 6 THR N N 6 116.940 116.419 0.521 1
1 62 . 10 1 1 A 7 7 ALA H H 7 8.270 7.982 0.288 1
1 63 . 10 1 1 A 7 7 ALA HA H 7 4.190 4.052 0.138 1
1 67 . 10 1 1 A 7 7 ALA C C 7 179.760 179.789 -0.029 1
1 68 . 10 1 1 A 7 7 ALA CA C 7 55.880 55.307 0.573 1
1 69 . 10 1 1 A 7 7 ALA CB C 7 17.720 17.998 -0.278 1
1 70 . 10 1 1 A 7 7 ALA N N 7 127.400 123.582 3.818 1
1 71 . 10 1 1 A 8 8 MET H H 8 8.110 8.020 0.090 1
1 72 . 10 1 1 A 8 8 MET HA H 8 4.020 4.222 -0.202 1
1 80 . 10 1 1 A 8 8 MET C C 8 178.510 178.792 -0.282 1
1 81 . 10 1 1 A 8 8 MET CA C 8 60.580 58.465 2.115 1
1 82 . 10 1 1 A 8 8 MET CB C 8 33.630 32.501 1.129 1
1 85 . 10 1 1 A 8 8 MET N N 8 117.520 116.067 1.453 1
1 86 . 10 1 1 A 9 9 GLU H H 9 8.210 7.580 0.630 1
1 87 . 10 1 1 A 9 9 GLU HA H 9 3.830 4.110 -0.280 1
1 92 . 10 1 1 A 9 9 GLU C C 9 179.140 178.640 0.500 1
1 93 . 10 1 1 A 9 9 GLU CA C 9 59.690 59.363 0.327 1
1 94 . 10 1 1 A 9 9 GLU CB C 9 29.530 29.424 0.106 1
1 96 . 10 1 1 A 9 9 GLU N N 9 118.560 121.032 -2.472 1
1 97 . 10 1 1 A 10 10 THR H H 10 8.490 7.758 0.732 1
1 98 . 10 1 1 A 10 10 THR HA H 10 4.000 4.075 -0.075 1
1 103 . 10 1 1 A 10 10 THR C C 10 176.010 176.434 -0.424 1
1 104 . 10 1 1 A 10 10 THR CA C 10 67.110 65.766 1.344 1
1 105 . 10 1 1 A 10 10 THR CB C 10 67.770 69.205 -1.435 1
1 107 . 10 1 1 A 10 10 THR N N 10 118.310 116.086 2.224 1
1 108 . 10 1 1 A 11 11 LEU H H 11 7.920 7.801 0.119 1
1 109 . 10 1 1 A 11 11 LEU HA H 11 3.930 4.083 -0.153 1
1 119 . 10 1 1 A 11 11 LEU C C 11 178.820 179.460 -0.640 1
1 120 . 10 1 1 A 11 11 LEU CA C 11 59.690 58.188 1.502 1
1 121 . 10 1 1 A 11 11 LEU CB C 11 41.920 41.866 0.054 1
1 125 . 10 1 1 A 11 11 LEU N N 11 121.150 120.866 0.284 1
1 126 . 10 1 1 A 12 12 ILE H H 12 7.440 7.812 -0.372 1
1 127 . 10 1 1 A 12 12 ILE HA H 12 3.640 3.274 0.366 1
1 137 . 10 1 1 A 12 12 ILE C C 12 179.530 178.609 0.921 1
1 138 . 10 1 1 A 12 12 ILE CA C 12 63.740 65.104 -1.364 1
1 139 . 10 1 1 A 12 12 ILE CB C 12 38.800 37.529 1.271 1
1 143 . 10 1 1 A 12 12 ILE N N 12 118.010 120.728 -2.718 1
1 144 . 10 1 1 A 13 13 ASN H H 13 8.930 8.118 0.812 1
1 145 . 10 1 1 A 13 13 ASN HA H 13 4.520 4.537 -0.017 1
1 148 . 10 1 1 A 13 13 ASN C C 13 179.450 177.388 2.062 1
1 149 . 10 1 1 A 13 13 ASN CA C 13 56.470 56.384 0.086 1
1 150 . 10 1 1 A 13 13 ASN CB C 13 37.930 38.790 -0.860 1
1 151 . 10 1 1 A 13 13 ASN N N 13 121.820 119.865 1.955 1
1 152 . 10 1 1 A 14 14 VAL H H 14 9.180 7.969 1.211 1
1 153 . 10 1 1 A 14 14 VAL HA H 14 3.830 3.876 -0.046 1
1 161 . 10 1 1 A 14 14 VAL CA C 14 65.840 65.451 0.389 1
1 162 . 10 1 1 A 14 14 VAL CB C 14 31.290 31.567 -0.277 1
1 165 . 10 1 1 A 14 14 VAL N N 14 122.040 117.620 4.420 1
1 166 . 10 1 1 A 15 15 PHE H H 15 7.590 8.059 -0.469 1
1 167 . 10 1 1 A 15 15 PHE HA H 15 3.360 4.011 -0.651 1
1 170 . 10 1 1 A 15 15 PHE C C 15 177.890 177.347 0.543 1
1 171 . 10 1 1 A 15 15 PHE CA C 15 62.030 61.760 0.270 1
1 172 . 10 1 1 A 15 15 PHE CB C 15 38.900 39.099 -0.199 1
1 173 . 10 1 1 A 15 15 PHE N N 15 118.290 123.803 -5.513 1
1 174 . 10 1 1 A 16 16 HIS H H 16 7.790 8.226 -0.436 1
1 175 . 10 1 1 A 16 16 HIS HA H 16 4.890 4.167 0.723 1
1 178 . 10 1 1 A 16 16 HIS C C 16 177.810 176.815 0.995 1
1 179 . 10 1 1 A 16 16 HIS CA C 16 59.100 59.910 -0.810 1
1 180 . 10 1 1 A 16 16 HIS CB C 16 28.060 29.198 -1.138 1
1 181 . 10 1 1 A 16 16 HIS N N 16 118.290 118.390 -0.100 1
1 182 . 10 1 1 A 17 17 ALA H H 17 8.040 7.719 0.321 1
1 183 . 10 1 1 A 17 17 ALA HA H 17 4.050 3.714 0.336 1
1 187 . 10 1 1 A 17 17 ALA C C 17 179.600 179.838 -0.238 1
1 188 . 10 1 1 A 17 17 ALA CA C 17 54.000 55.097 -1.097 1
1 189 . 10 1 1 A 17 17 ALA CB C 17 17.520 18.463 -0.943 1
1 190 . 10 1 1 A 17 17 ALA N N 17 124.410 120.740 3.670 1
1 191 . 10 1 1 A 18 18 HIS H H 18 7.000 7.546 -0.546 1
1 192 . 10 1 1 A 18 18 HIS HA H 18 4.330 4.201 0.129 1
1 195 . 10 1 1 A 18 18 HIS C C 18 176.320 178.190 -1.870 1
1 196 . 10 1 1 A 18 18 HIS CA C 18 57.350 59.621 -2.271 1
1 197 . 10 1 1 A 18 18 HIS CB C 18 32.920 29.875 3.045 1
1 198 . 10 1 1 A 18 18 HIS N N 18 115.160 115.917 -0.757 1
1 199 . 10 1 1 A 19 19 SER H H 19 8.380 8.076 0.304 1
1 200 . 10 1 1 A 19 19 SER HA H 19 3.640 4.157 -0.517 1
1 203 . 10 1 1 A 19 19 SER C C 19 177.340 175.800 1.540 1
1 204 . 10 1 1 A 19 19 SER CA C 19 60.160 60.915 -0.755 1
1 205 . 10 1 1 A 19 19 SER CB C 19 61.000 62.105 -1.105 1
1 206 . 10 1 1 A 19 19 SER N N 19 114.380 115.760 -1.380 1
1 207 . 10 1 1 A 20 20 GLY H H 20 7.600 7.605 -0.005 1
1 208 . 10 1 1 A 20 20 GLY HA2 H 20 3.680 3.595 0.085 1
1 209 . 10 1 1 A 20 20 GLY HA3 H 20 4.000 3.742 0.258 1
1 210 . 10 1 1 A 20 20 GLY C C 20 174.140 174.287 -0.147 1
1 211 . 10 1 1 A 20 20 GLY CA C 20 47.000 45.113 1.887 1
1 212 . 10 1 1 A 20 20 GLY N N 20 112.550 109.423 3.127 1
1 213 . 10 1 1 A 21 21 LYS H H 21 7.230 7.471 -0.241 1
1 214 . 10 1 1 A 21 21 LYS HA H 21 3.860 4.285 -0.425 1
1 223 . 10 1 1 A 21 21 LYS C C 21 177.730 176.281 1.449 1
1 224 . 10 1 1 A 21 21 LYS CA C 21 59.110 56.911 2.199 1
1 225 . 10 1 1 A 21 21 LYS CB C 21 32.460 34.723 -2.263 1
1 229 . 10 1 1 A 21 21 LYS N N 21 123.240 118.113 5.127 1
1 230 . 10 1 1 A 22 22 GLU H H 22 9.350 7.800 1.550 1
1 231 . 10 1 1 A 22 22 GLU HA H 22 4.610 4.383 0.227 1
1 236 . 10 1 1 A 22 22 GLU C C 22 177.420 176.075 1.345 1
1 237 . 10 1 1 A 22 22 GLU CA C 22 53.700 56.287 -2.587 1
1 238 . 10 1 1 A 22 22 GLU CB C 22 32.000 27.766 4.234 1
1 240 . 10 1 1 A 22 22 GLU N N 22 116.770 117.930 -1.160 1
1 241 . 10 1 1 A 23 23 GLY H H 23 7.570 7.767 -0.197 1
1 242 . 10 1 1 A 23 23 GLY HA2 H 23 3.630 4.127 -0.497 1
1 243 . 10 1 1 A 23 23 GLY HA3 H 23 3.880 4.145 -0.265 1
1 244 . 10 1 1 A 23 23 GLY C C 23 173.980 171.361 2.619 1
1 245 . 10 1 1 A 23 23 GLY CA C 23 45.250 45.653 -0.403 1
1 246 . 10 1 1 A 23 23 GLY N N 23 112.180 109.566 2.614 1
1 247 . 10 1 1 A 24 24 ASP H H 24 8.680 8.357 0.323 1
1 248 . 10 1 1 A 24 24 ASP HA H 24 4.380 4.807 -0.427 1
1 251 . 10 1 1 A 24 24 ASP C C 24 178.590 177.992 0.598 1
1 252 . 10 1 1 A 24 24 ASP CA C 24 60.000 53.303 6.697 1
1 253 . 10 1 1 A 24 24 ASP CB C 24 27.480 41.746 -14.266 1
1 254 . 10 1 1 A 24 24 ASP N N 24 127.470 122.316 5.154 1
1 255 . 10 1 1 A 25 25 LYS H H 25 9.270 8.711 0.559 1
1 256 . 10 1 1 A 25 25 LYS HA H 25 4.250 3.678 0.572 1
1 265 . 10 1 1 A 25 25 LYS C C 25 177.030 176.699 0.331 1
1 266 . 10 1 1 A 25 25 LYS CA C 25 60.000 59.649 0.351 1
1 267 . 10 1 1 A 25 25 LYS CB C 25 31.170 32.220 -1.050 1
1 271 . 10 1 1 A 25 25 LYS N N 25 132.960 121.493 11.467 1
1 272 . 10 1 1 A 26 26 TYR H H 26 9.430 7.914 1.516 1
1 273 . 10 1 1 A 26 26 TYR HA H 26 4.640 4.881 -0.241 1
1 276 . 10 1 1 A 26 26 TYR C C 26 174.290 174.746 -0.456 1
1 277 . 10 1 1 A 26 26 TYR CA C 26 56.010 57.412 -1.402 1
1 278 . 10 1 1 A 26 26 TYR CB C 26 37.730 38.825 -1.095 1
1 279 . 10 1 1 A 26 26 TYR N N 26 120.650 113.745 6.905 1
1 280 . 10 1 1 A 27 27 LYS H H 27 7.110 7.301 -0.191 1
1 281 . 10 1 1 A 27 27 LYS HA H 27 5.110 5.266 -0.156 1
1 290 . 10 1 1 A 27 27 LYS C C 27 175.150 173.941 1.209 1
1 291 . 10 1 1 A 27 27 LYS CA C 27 55.070 54.973 0.097 1
1 292 . 10 1 1 A 27 27 LYS CB C 27 38.900 36.157 2.743 1
1 296 . 10 1 1 A 27 27 LYS N N 27 115.830 120.725 -4.895 1
1 297 . 10 1 1 A 28 28 LEU H H 28 9.820 8.389 1.431 1
1 298 . 10 1 1 A 28 28 LEU HA H 28 5.080 4.853 0.227 1
1 308 . 10 1 1 A 28 28 LEU C C 28 176.640 175.698 0.942 1
1 309 . 10 1 1 A 28 28 LEU CA C 28 52.660 53.752 -1.092 1
1 310 . 10 1 1 A 28 28 LEU CB C 28 42.710 44.572 -1.862 1
1 314 . 10 1 1 A 28 28 LEU N N 28 126.930 128.739 -1.809 1
1 315 . 10 1 1 A 29 29 SER H H 29 9.890 8.364 1.526 1
1 316 . 10 1 1 A 29 29 SER HA H 29 4.530 5.060 -0.530 1
1 319 . 10 1 1 A 29 29 SER C C 29 174.990 175.184 -0.194 1
1 320 . 10 1 1 A 29 29 SER CA C 29 56.180 55.541 0.639 1
1 321 . 10 1 1 A 29 29 SER CB C 29 65.550 66.810 -1.260 1
1 322 . 10 1 1 A 29 29 SER N N 29 121.600 118.118 3.482 1
1 323 . 10 1 1 A 30 30 LYS H H 30 8.850 8.853 -0.003 1
1 324 . 10 1 1 A 30 30 LYS HA H 30 3.850 4.005 -0.155 1
1 333 . 10 1 1 A 30 30 LYS C C 30 175.620 177.538 -1.918 1
1 334 . 10 1 1 A 30 30 LYS CA C 30 60.860 60.139 0.721 1
1 335 . 10 1 1 A 30 30 LYS CB C 30 31.290 32.063 -0.773 1
1 339 . 10 1 1 A 30 30 LYS N N 30 121.260 121.905 -0.645 1
1 340 . 10 1 1 A 31 31 LYS H H 31 7.970 7.979 -0.009 1
1 341 . 10 1 1 A 31 31 LYS HA H 31 3.880 4.025 -0.145 1
1 350 . 10 1 1 A 31 31 LYS C C 31 179.290 179.406 -0.116 1
1 351 . 10 1 1 A 31 31 LYS CA C 31 59.110 59.268 -0.158 1
1 352 . 10 1 1 A 31 31 LYS CB C 31 32.640 31.615 1.025 1
1 356 . 10 1 1 A 31 31 LYS N N 31 121.260 118.577 2.683 1
1 357 . 10 1 1 A 32 32 GLU H H 32 7.510 7.936 -0.426 1
1 358 . 10 1 1 A 32 32 GLU HA H 32 3.830 4.091 -0.261 1
1 363 . 10 1 1 A 32 32 GLU C C 32 179.290 179.537 -0.247 1
1 364 . 10 1 1 A 32 32 GLU CA C 32 58.590 58.976 -0.386 1
1 365 . 10 1 1 A 32 32 GLU CB C 32 30.120 30.110 0.010 1
1 367 . 10 1 1 A 32 32 GLU N N 32 120.090 119.320 0.770 1
1 368 . 10 1 1 A 33 33 LEU H H 33 8.970 7.893 1.077 1
1 369 . 10 1 1 A 33 33 LEU HA H 33 3.830 4.027 -0.197 1
1 379 . 10 1 1 A 33 33 LEU C C 33 178.200 178.890 -0.690 1
1 380 . 10 1 1 A 33 33 LEU CA C 33 57.930 58.200 -0.270 1
1 381 . 10 1 1 A 33 33 LEU CB C 33 40.660 41.599 -0.939 1
1 385 . 10 1 1 A 33 33 LEU N N 33 120.200 119.195 1.005 1
1 386 . 10 1 1 A 34 34 LYS H H 34 8.230 7.782 0.448 1
1 387 . 10 1 1 A 34 34 LYS HA H 34 3.550 3.948 -0.398 1
1 396 . 10 1 1 A 34 34 LYS C C 34 178.040 178.752 -0.712 1
1 397 . 10 1 1 A 34 34 LYS CA C 34 60.720 58.874 1.846 1
1 398 . 10 1 1 A 34 34 LYS CB C 34 31.980 31.916 0.064 1
1 402 . 10 1 1 A 34 34 LYS N N 34 120.780 119.204 1.576 1
1 403 . 10 1 1 A 35 35 ASP H H 35 7.990 7.840 0.150 1
1 404 . 10 1 1 A 35 35 ASP HA H 35 4.250 4.440 -0.190 1
1 407 . 10 1 1 A 35 35 ASP C C 35 179.060 178.554 0.506 1
1 408 . 10 1 1 A 35 35 ASP CA C 35 56.830 57.352 -0.522 1
1 409 . 10 1 1 A 35 35 ASP CB C 35 40.440 40.371 0.069 1
1 410 . 10 1 1 A 35 35 ASP N N 35 119.550 119.642 -0.092 1
1 411 . 10 1 1 A 36 36 LEU H H 36 8.130 7.559 0.571 1
1 412 . 10 1 1 A 36 36 LEU HA H 36 2.580 3.342 -0.762 1
1 422 . 10 1 1 A 36 36 LEU C C 36 179.450 178.159 1.291 1
1 423 . 10 1 1 A 36 36 LEU CA C 36 59.980 57.564 2.416 1
1 424 . 10 1 1 A 36 36 LEU CB C 36 42.180 41.336 0.844 1
1 428 . 10 1 1 A 36 36 LEU N N 36 125.560 120.748 4.812 1
1 429 . 10 1 1 A 37 37 LEU H H 37 8.740 7.636 1.104 1
1 430 . 10 1 1 A 37 37 LEU HA H 37 3.580 4.246 -0.666 1
1 440 . 10 1 1 A 37 37 LEU C C 37 179.290 178.309 0.981 1
1 441 . 10 1 1 A 37 37 LEU CA C 37 58.230 57.683 0.547 1
1 442 . 10 1 1 A 37 37 LEU CB C 37 41.590 41.870 -0.280 1
1 446 . 10 1 1 A 37 37 LEU N N 37 120.520 119.983 0.537 1
1 447 . 10 1 1 A 38 38 GLN H H 38 8.520 8.145 0.375 1
1 448 . 10 1 1 A 38 38 GLN HA H 38 4.000 4.083 -0.083 1
1 453 . 10 1 1 A 38 38 GLN C C 38 177.960 178.082 -0.122 1
1 454 . 10 1 1 A 38 38 GLN CA C 38 58.210 58.215 -0.005 1
1 455 . 10 1 1 A 38 38 GLN CB C 38 28.650 28.345 0.305 1
1 457 . 10 1 1 A 38 38 GLN N N 38 116.740 116.987 -0.247 1
1 458 . 10 1 1 A 39 39 THR H H 39 7.910 7.869 0.041 1
1 459 . 10 1 1 A 39 39 THR HA H 39 4.210 3.858 0.352 1
1 464 . 10 1 1 A 39 39 THR C C 39 177.180 176.316 0.864 1
1 465 . 10 1 1 A 39 39 THR CA C 39 64.730 65.975 -1.245 1
1 466 . 10 1 1 A 39 39 THR CB C 39 69.650 68.986 0.664 1
1 468 . 10 1 1 A 39 39 THR N N 39 111.400 115.510 -4.110 1
1 469 . 10 1 1 A 40 40 GLU H H 40 8.590 7.890 0.700 1
1 470 . 10 1 1 A 40 40 GLU HA H 40 4.680 4.449 0.231 1
1 475 . 10 1 1 A 40 40 GLU C C 40 178.280 177.402 0.878 1
1 476 . 10 1 1 A 40 40 GLU CA C 40 55.880 56.613 -0.733 1
1 477 . 10 1 1 A 40 40 GLU CB C 40 30.990 30.412 0.578 1
1 479 . 10 1 1 A 40 40 GLU N N 40 117.840 120.074 -2.234 1
1 480 . 10 1 1 A 41 41 LEU H H 41 7.680 7.615 0.065 1
1 481 . 10 1 1 A 41 41 LEU HA H 41 5.080 4.949 0.131 1
1 491 . 10 1 1 A 41 41 LEU C C 41 179.450 177.241 2.209 1
1 492 . 10 1 1 A 41 41 LEU CA C 41 53.830 54.070 -0.240 1
1 493 . 10 1 1 A 41 41 LEU CB C 41 41.360 42.744 -1.384 1
1 497 . 10 1 1 A 41 41 LEU N N 41 121.410 119.334 2.076 1
1 498 . 10 1 1 A 42 42 SER H H 42 8.380 8.046 0.334 1
1 499 . 10 1 1 A 42 42 SER HA H 42 4.130 4.030 0.100 1
1 502 . 10 1 1 A 42 42 SER C C 42 176.640 176.117 0.523 1
1 503 . 10 1 1 A 42 42 SER CA C 42 61.280 62.119 -0.839 1
1 504 . 10 1 1 A 42 42 SER CB C 42 63.040 62.836 0.204 1
1 505 . 10 1 1 A 42 42 SER N N 42 117.420 116.724 0.696 1
1 506 . 10 1 1 A 43 43 SER H H 43 8.900 8.117 0.783 1
1 507 . 10 1 1 A 43 43 SER HA H 43 4.290 4.339 -0.049 1
1 510 . 10 1 1 A 43 43 SER C C 43 175.620 177.134 -1.514 1
1 511 . 10 1 1 A 43 43 SER CA C 43 60.860 60.576 0.284 1
1 512 . 10 1 1 A 43 43 SER CB C 43 62.910 63.086 -0.176 1
1 513 . 10 1 1 A 43 43 SER N N 43 117.580 116.285 1.295 1
1 514 . 10 1 1 A 44 44 PHE H H 44 7.880 8.144 -0.264 1
1 515 . 10 1 1 A 44 44 PHE HA H 44 4.240 4.157 0.083 1
1 518 . 10 1 1 A 44 44 PHE C C 44 176.950 175.516 1.434 1
1 519 . 10 1 1 A 44 44 PHE CA C 44 62.710 61.334 1.376 1
1 520 . 10 1 1 A 44 44 PHE CB C 44 39.020 38.954 0.066 1
1 521 . 10 1 1 A 44 44 PHE N N 44 119.480 122.617 -3.137 1
1 522 . 10 1 1 A 45 45 LEU H H 45 8.060 7.732 0.328 1
1 523 . 10 1 1 A 45 45 LEU HA H 45 3.810 3.685 0.125 1
1 533 . 10 1 1 A 45 45 LEU C C 45 177.500 176.455 1.045 1
1 534 . 10 1 1 A 45 45 LEU CA C 45 59.980 55.352 4.628 1
1 535 . 10 1 1 A 45 45 LEU CB C 45 39.640 42.096 -2.456 1
1 538 . 10 1 1 A 45 45 LEU N N 45 118.010 122.357 -4.347 1
1 539 . 10 1 1 A 46 46 ASP H H 46 8.150 8.587 -0.437 1
1 540 . 10 1 1 A 46 46 ASP HA H 46 4.470 4.685 -0.215 1
1 543 . 10 1 1 A 46 46 ASP C C 46 179.920 176.122 3.798 1
1 544 . 10 1 1 A 46 46 ASP CA C 46 52.950 53.018 -0.068 1
1 545 . 10 1 1 A 46 46 ASP CB C 46 40.000 40.672 -0.672 1
1 546 . 10 1 1 A 46 46 ASP N N 46 119.460 124.602 -5.142 1
1 547 . 10 1 1 A 47 47 VAL H H 47 8.010 8.450 -0.440 1
1 548 . 10 1 1 A 47 47 VAL HA H 47 3.800 4.388 -0.588 1
1 556 . 10 1 1 A 47 47 VAL C C 47 175.460 176.843 -1.383 1
1 557 . 10 1 1 A 47 47 VAL CA C 47 60.000 62.735 -2.735 1
1 558 . 10 1 1 A 47 47 VAL CB C 47 31.580 33.446 -1.866 1
1 561 . 10 1 1 A 47 47 VAL N N 47 117.720 120.679 -2.959 1
1 562 . 10 1 1 A 48 48 GLN H H 48 7.960 8.397 -0.437 1
1 563 . 10 1 1 A 48 48 GLN HA H 48 4.060 4.232 -0.172 1
1 568 . 10 1 1 A 48 48 GLN C C 48 179.370 176.944 2.426 1
1 569 . 10 1 1 A 48 48 GLN CA C 48 57.350 57.575 -0.225 1
1 570 . 10 1 1 A 48 48 GLN CB C 48 28.990 28.823 0.167 1
1 572 . 10 1 1 A 48 48 GLN N N 48 119.900 121.090 -1.190 1
1 573 . 10 1 1 A 49 49 LYS H H 49 7.810 7.867 -0.057 1
1 574 . 10 1 1 A 49 49 LYS HA H 49 3.860 4.202 -0.342 1
1 583 . 10 1 1 A 49 49 LYS C C 49 177.890 176.130 1.760 1
1 584 . 10 1 1 A 49 49 LYS CA C 49 58.230 57.134 1.096 1
1 585 . 10 1 1 A 49 49 LYS CB C 49 30.990 33.284 -2.294 1
1 587 . 10 1 1 A 49 49 LYS N N 49 120.030 117.590 2.440 1
1 588 . 10 1 1 A 50 50 ASP H H 50 7.570 7.943 -0.373 1
1 589 . 10 1 1 A 50 50 ASP HA H 50 4.700 4.856 -0.156 1
1 590 . 10 1 1 A 50 50 ASP CA C 50 52.950 53.071 -0.121 1
1 591 . 10 1 1 A 50 50 ASP CB C 50 38.900 41.736 -2.836 1
1 592 . 10 1 1 A 50 50 ASP N N 50 116.730 118.652 -1.922 1
1 593 . 10 1 1 A 51 51 ALA H H 51 7.570 8.823 -1.253 1
1 594 . 10 1 1 A 51 51 ALA HA H 51 4.200 3.961 0.239 1
1 598 . 10 1 1 A 51 51 ALA C C 51 179.760 179.330 0.430 1
1 599 . 10 1 1 A 51 51 ALA CA C 51 54.200 55.274 -1.074 1
1 600 . 10 1 1 A 51 51 ALA CB C 51 18.110 18.474 -0.364 1
1 601 . 10 1 1 A 51 51 ALA N N 51 118.390 127.887 -9.497 1
1 602 . 10 1 1 A 52 52 ASP H H 52 8.430 8.354 0.076 1
1 603 . 10 1 1 A 52 52 ASP HA H 52 4.600 4.366 0.234 1
1 606 . 10 1 1 A 52 52 ASP C C 52 177.570 178.398 -0.828 1
1 607 . 10 1 1 A 52 52 ASP CA C 52 54.420 56.785 -2.365 1
1 608 . 10 1 1 A 52 52 ASP CB C 52 40.360 40.118 0.242 1
1 609 . 10 1 1 A 52 52 ASP N N 52 117.530 119.353 -1.823 1
1 610 . 10 1 1 A 53 53 ALA H H 53 7.660 7.952 -0.292 1
1 611 . 10 1 1 A 53 53 ALA HA H 53 3.860 4.022 -0.162 1
1 615 . 10 1 1 A 53 53 ALA C C 53 180.070 180.703 -0.633 1
1 616 . 10 1 1 A 53 53 ALA CA C 53 55.590 55.471 0.119 1
1 617 . 10 1 1 A 53 53 ALA CB C 53 18.800 18.021 0.779 1
1 618 . 10 1 1 A 53 53 ALA N N 53 123.450 122.610 0.840 1
1 619 . 10 1 1 A 54 54 VAL H H 54 8.030 7.741 0.289 1
1 620 . 10 1 1 A 54 54 VAL HA H 54 3.240 3.641 -0.401 1
1 628 . 10 1 1 A 54 54 VAL C C 54 177.340 177.460 -0.120 1
1 629 . 10 1 1 A 54 54 VAL CA C 54 66.620 66.046 0.574 1
1 630 . 10 1 1 A 54 54 VAL CB C 54 30.480 31.051 -0.571 1
1 633 . 10 1 1 A 54 54 VAL N N 54 116.150 117.658 -1.508 1
1 634 . 10 1 1 A 55 55 ASP H H 55 7.660 7.877 -0.217 1
1 635 . 10 1 1 A 55 55 ASP HA H 55 4.080 4.307 -0.227 1
1 638 . 10 1 1 A 55 55 ASP C C 55 177.260 178.622 -1.362 1
1 639 . 10 1 1 A 55 55 ASP CA C 55 57.640 57.675 -0.035 1
1 640 . 10 1 1 A 55 55 ASP CB C 55 40.360 40.998 -0.638 1
1 641 . 10 1 1 A 55 55 ASP N N 55 120.830 121.256 -0.426 1
1 642 . 10 1 1 A 56 56 LYS H H 56 7.780 7.569 0.211 1
1 643 . 10 1 1 A 56 56 LYS HA H 56 3.860 4.025 -0.165 1
1 652 . 10 1 1 A 56 56 LYS C C 56 179.530 179.540 -0.010 1
1 653 . 10 1 1 A 56 56 LYS CA C 56 59.690 59.722 -0.032 1
1 654 . 10 1 1 A 56 56 LYS CB C 56 31.870 32.474 -0.604 1
1 658 . 10 1 1 A 56 56 LYS N N 56 120.010 118.556 1.454 1
1 659 . 10 1 1 A 57 57 ILE H H 57 8.090 7.854 0.236 1
1 660 . 10 1 1 A 57 57 ILE HA H 57 3.390 3.623 -0.233 1
1 670 . 10 1 1 A 57 57 ILE C C 57 176.710 177.740 -1.030 1
1 671 . 10 1 1 A 57 57 ILE CA C 57 64.960 65.091 -0.131 1
1 672 . 10 1 1 A 57 57 ILE CB C 57 38.080 38.416 -0.336 1
1 676 . 10 1 1 A 57 57 ILE N N 57 120.960 120.530 0.430 1
1 677 . 10 1 1 A 58 58 MET H H 58 8.480 8.335 0.145 1
1 678 . 10 1 1 A 58 58 MET HA H 58 3.800 4.128 -0.328 1
1 686 . 10 1 1 A 58 58 MET C C 58 177.570 178.262 -0.692 1
1 687 . 10 1 1 A 58 58 MET CA C 58 58.570 58.437 0.133 1
1 688 . 10 1 1 A 58 58 MET CB C 58 32.570 31.880 0.690 1
1 691 . 10 1 1 A 58 58 MET N N 58 119.160 120.641 -1.481 1
1 692 . 10 1 1 A 59 59 LYS H H 59 7.550 7.952 -0.402 1
1 693 . 10 1 1 A 59 59 LYS HA H 59 3.930 3.948 -0.018 1
1 702 . 10 1 1 A 59 59 LYS C C 59 179.530 179.167 0.363 1
1 703 . 10 1 1 A 59 59 LYS CA C 59 58.820 59.682 -0.862 1
1 704 . 10 1 1 A 59 59 LYS CB C 59 32.450 32.450 0.000 1
1 708 . 10 1 1 A 59 59 LYS N N 59 116.730 119.815 -3.085 1
1 709 . 10 1 1 A 60 60 GLU H H 60 7.470 7.939 -0.469 1
1 710 . 10 1 1 A 60 60 GLU HA H 60 4.050 4.060 -0.010 1
1 715 . 10 1 1 A 60 60 GLU C C 60 178.950 178.260 0.690 1
1 716 . 10 1 1 A 60 60 GLU CA C 60 58.600 58.968 -0.368 1
1 717 . 10 1 1 A 60 60 GLU CB C 60 31.700 29.478 2.222 1
1 719 . 10 1 1 A 60 60 GLU N N 60 116.820 119.110 -2.290 1
1 720 . 10 1 1 A 61 61 LEU H H 61 8.030 7.616 0.414 1
1 721 . 10 1 1 A 61 61 LEU HA H 61 4.310 4.237 0.073 1
1 731 . 10 1 1 A 61 61 LEU C C 61 179.450 177.925 1.525 1
1 732 . 10 1 1 A 61 61 LEU CA C 61 54.840 56.367 -1.527 1
1 733 . 10 1 1 A 61 61 LEU CB C 61 43.820 42.239 1.581 1
1 737 . 10 1 1 A 61 61 LEU N N 61 116.000 118.458 -2.458 1
1 738 . 10 1 1 A 62 62 ASP H H 62 7.890 8.261 -0.371 1
1 739 . 10 1 1 A 62 62 ASP HA H 62 4.660 4.650 0.010 1
1 742 . 10 1 1 A 62 62 ASP C C 62 177.030 176.957 0.073 1
1 743 . 10 1 1 A 62 62 ASP CA C 62 53.660 52.654 1.006 1
1 744 . 10 1 1 A 62 62 ASP CB C 62 38.700 39.035 -0.335 1
1 745 . 10 1 1 A 62 62 ASP N N 62 117.550 118.289 -0.739 1
1 746 . 10 1 1 A 63 63 GLU H H 63 8.430 9.580 -1.150 1
1 747 . 10 1 1 A 63 63 GLU HA H 63 4.020 4.036 -0.016 1
1 752 . 10 1 1 A 63 63 GLU C C 63 178.120 178.898 -0.778 1
1 753 . 10 1 1 A 63 63 GLU CA C 63 58.470 59.217 -0.747 1
1 754 . 10 1 1 A 63 63 GLU CB C 63 30.120 29.451 0.669 1
1 756 . 10 1 1 A 63 63 GLU N N 63 130.230 124.775 5.455 1
1 757 . 10 1 1 A 64 64 ASN H H 64 8.010 8.154 -0.144 1
1 758 . 10 1 1 A 64 64 ASN HA H 64 4.680 4.685 -0.005 1
1 761 . 10 1 1 A 64 64 ASN C C 64 177.100 175.972 1.128 1
1 762 . 10 1 1 A 64 64 ASN CA C 64 51.780 53.307 -1.527 1
1 763 . 10 1 1 A 64 64 ASN CB C 64 37.260 39.003 -1.743 1
1 764 . 10 1 1 A 64 64 ASN N N 64 113.640 115.701 -2.061 1
1 765 . 10 1 1 A 65 65 GLY H H 65 7.550 7.900 -0.350 1
1 766 . 10 1 1 A 65 65 GLY HA2 H 65 3.770 3.973 -0.203 1
1 767 . 10 1 1 A 65 65 GLY HA3 H 65 3.770 3.975 -0.205 1
1 768 . 10 1 1 A 65 65 GLY C C 65 178.980 175.008 3.972 1
1 769 . 10 1 1 A 65 65 GLY CA C 65 47.200 46.504 0.696 1
1 770 . 10 1 1 A 65 65 GLY N N 65 113.640 107.596 6.044 1
1 771 . 10 1 1 A 66 66 ASP H H 66 8.110 8.160 -0.050 1
1 772 . 10 1 1 A 66 66 ASP HA H 66 4.490 4.601 -0.111 1
1 775 . 10 1 1 A 66 66 ASP C C 66 177.960 177.561 0.399 1
1 776 . 10 1 1 A 66 66 ASP CA C 66 52.960 53.425 -0.465 1
1 777 . 10 1 1 A 66 66 ASP CB C 66 40.540 40.475 0.065 1
1 778 . 10 1 1 A 66 66 ASP N N 66 120.030 120.317 -0.287 1
1 779 . 10 1 1 A 67 67 GLY H H 67 10.260 9.939 0.321 1
1 780 . 10 1 1 A 67 67 GLY HA2 H 67 3.360 3.885 -0.525 1
1 781 . 10 1 1 A 67 67 GLY HA3 H 67 4.000 3.886 0.114 1
1 782 . 10 1 1 A 67 67 GLY C C 67 173.120 173.420 -0.300 1
1 783 . 10 1 1 A 67 67 GLY CA C 67 45.460 45.816 -0.356 1
1 784 . 10 1 1 A 67 67 GLY N N 67 114.100 111.042 3.058 1
1 785 . 10 1 1 A 68 68 GLU H H 68 7.750 7.928 -0.178 1
1 786 . 10 1 1 A 68 68 GLU HA H 68 4.780 4.968 -0.188 1
1 791 . 10 1 1 A 68 68 GLU C C 68 175.930 174.862 1.068 1
1 792 . 10 1 1 A 68 68 GLU CA C 68 54.430 54.406 0.024 1
1 793 . 10 1 1 A 68 68 GLU CB C 68 35.850 33.578 2.272 1
1 795 . 10 1 1 A 68 68 GLU N N 68 118.000 119.478 -1.478 1
1 796 . 10 1 1 A 69 69 VAL H H 69 9.380 8.434 0.946 1
1 797 . 10 1 1 A 69 69 VAL HA H 69 5.260 5.120 0.140 1
1 805 . 10 1 1 A 69 69 VAL C C 69 176.710 173.516 3.194 1
1 806 . 10 1 1 A 69 69 VAL CA C 69 61.280 60.786 0.494 1
1 807 . 10 1 1 A 69 69 VAL CB C 69 33.980 35.111 -1.131 1
1 810 . 10 1 1 A 69 69 VAL N N 69 125.970 121.092 4.878 1
1 811 . 10 1 1 A 70 70 ASP H H 70 9.100 8.884 0.216 1
1 812 . 10 1 1 A 70 70 ASP HA H 70 5.190 5.226 -0.036 1
1 815 . 10 1 1 A 70 70 ASP C C 70 175.700 176.740 -1.040 1
1 816 . 10 1 1 A 70 70 ASP CA C 70 52.370 53.337 -0.967 1
1 817 . 10 1 1 A 70 70 ASP CB C 70 40.950 42.879 -1.929 1
1 818 . 10 1 1 A 70 70 ASP N N 70 130.320 127.255 3.065 1
1 819 . 10 1 1 A 71 71 PHE H H 71 9.090 9.187 -0.097 1
1 820 . 10 1 1 A 71 71 PHE HA H 71 4.100 3.785 0.315 1
1 823 . 10 1 1 A 71 71 PHE C C 71 177.000 177.690 -0.690 1
1 824 . 10 1 1 A 71 71 PHE CA C 71 58.230 61.646 -3.416 1
1 825 . 10 1 1 A 71 71 PHE CB C 71 36.910 38.999 -2.089 1
1 826 . 10 1 1 A 71 71 PHE N N 71 119.760 126.697 -6.937 1
1 827 . 10 1 1 A 72 72 GLN H H 72 8.440 8.435 0.005 1
1 828 . 10 1 1 A 72 72 GLN HA H 72 3.600 3.997 -0.397 1
1 831 . 10 1 1 A 72 72 GLN C C 72 178.820 178.068 0.752 1
1 832 . 10 1 1 A 72 72 GLN CA C 72 59.500 58.568 0.932 1
1 833 . 10 1 1 A 72 72 GLN CB C 72 29.553 28.212 1.341 1
1 835 . 10 1 1 A 72 72 GLN N N 72 121.820 118.051 3.769 1
1 836 . 10 1 1 A 73 73 GLU H H 73 8.290 8.374 -0.084 1
1 837 . 10 1 1 A 73 73 GLU HA H 73 4.070 4.140 -0.070 1
1 842 . 10 1 1 A 73 73 GLU C C 73 179.370 178.779 0.591 1
1 843 . 10 1 1 A 73 73 GLU CA C 73 58.030 58.839 -0.809 1
1 844 . 10 1 1 A 73 73 GLU CB C 73 29.530 29.982 -0.452 1
1 846 . 10 1 1 A 73 73 GLU N N 73 120.550 118.729 1.821 1
1 847 . 10 1 1 A 74 74 PHE H H 74 8.630 8.577 0.053 1
1 848 . 10 1 1 A 74 74 PHE HA H 74 4.020 4.010 0.010 1
1 851 . 10 1 1 A 74 74 PHE C C 74 177.890 176.879 1.011 1
1 852 . 10 1 1 A 74 74 PHE CA C 74 60.090 61.324 -1.234 1
1 853 . 10 1 1 A 74 74 PHE CB C 74 38.020 39.300 -1.280 1
1 854 . 10 1 1 A 74 74 PHE N N 74 121.010 121.650 -0.640 1
1 855 . 10 1 1 A 75 75 VAL H H 75 8.080 8.260 -0.180 1
1 856 . 10 1 1 A 75 75 VAL HA H 75 2.860 3.384 -0.524 1
1 864 . 10 1 1 A 75 75 VAL C C 75 177.030 178.178 -1.148 1
1 865 . 10 1 1 A 75 75 VAL CA C 75 66.430 66.449 -0.019 1
1 866 . 10 1 1 A 75 75 VAL CB C 75 30.600 31.012 -0.412 1
1 869 . 10 1 1 A 75 75 VAL N N 75 119.460 118.991 0.469 1
1 870 . 10 1 1 A 76 76 VAL H H 76 7.100 8.080 -0.980 1
1 871 . 10 1 1 A 76 76 VAL HA H 76 3.330 3.455 -0.125 1
1 879 . 10 1 1 A 76 76 VAL C C 76 178.670 177.810 0.860 1
1 880 . 10 1 1 A 76 76 VAL CA C 76 67.000 66.676 0.324 1
1 881 . 10 1 1 A 76 76 VAL CB C 76 31.280 31.373 -0.093 1
1 884 . 10 1 1 A 76 76 VAL N N 76 121.030 120.110 0.920 1
1 885 . 10 1 1 A 77 77 LEU H H 77 6.900 7.784 -0.884 1
1 886 . 10 1 1 A 77 77 LEU HA H 77 3.800 3.865 -0.065 1
1 896 . 10 1 1 A 77 77 LEU C C 77 177.960 178.209 -0.249 1
1 897 . 10 1 1 A 77 77 LEU CA C 77 57.710 58.135 -0.425 1
1 898 . 10 1 1 A 77 77 LEU CB C 77 40.070 41.668 -1.598 1
1 902 . 10 1 1 A 77 77 LEU N N 77 120.310 120.603 -0.293 1
1 903 . 10 1 1 A 78 78 VAL H H 78 7.240 7.300 -0.060 1
1 904 . 10 1 1 A 78 78 VAL HA H 78 3.030 3.649 -0.619 1
1 912 . 10 1 1 A 78 78 VAL C C 78 179.600 177.983 1.617 1
1 913 . 10 1 1 A 78 78 VAL CA C 78 66.420 64.781 1.639 1
1 914 . 10 1 1 A 78 78 VAL CB C 78 30.700 31.445 -0.745 1
1 917 . 10 1 1 A 78 78 VAL N N 78 117.180 116.039 1.141 1
1 918 . 10 1 1 A 79 79 ALA H H 79 9.000 8.073 0.927 1
1 919 . 10 1 1 A 79 79 ALA HA H 79 3.610 3.923 -0.313 1
1 923 . 10 1 1 A 79 79 ALA C C 79 182.260 180.189 2.071 1
1 924 . 10 1 1 A 79 79 ALA CA C 79 55.580 55.419 0.161 1
1 925 . 10 1 1 A 79 79 ALA CB C 79 18.400 17.980 0.420 1
1 926 . 10 1 1 A 79 79 ALA N N 79 126.000 125.143 0.857 1
1 927 . 10 1 1 A 80 80 ALA H H 80 8.000 7.686 0.314 1
1 928 . 10 1 1 A 80 80 ALA HA H 80 4.100 4.038 0.062 1
1 932 . 10 1 1 A 80 80 ALA C C 80 175.460 179.608 -4.148 1
1 933 . 10 1 1 A 80 80 ALA CA C 80 56.020 54.490 1.530 1
1 934 . 10 1 1 A 80 80 ALA CB C 80 18.040 18.267 -0.227 1
1 935 . 10 1 1 A 80 80 ALA N N 80 120.730 120.844 -0.114 1
1 936 . 10 1 1 A 81 81 LEU H H 81 8.460 7.438 1.022 1
1 937 . 10 1 1 A 81 81 LEU HA H 81 4.000 4.126 -0.126 1
1 941 . 10 1 1 A 81 81 LEU C C 81 177.030 178.815 -1.785 1
1 942 . 10 1 1 A 81 81 LEU CA C 81 57.640 57.294 0.346 1
1 943 . 10 1 1 A 81 81 LEU CB C 81 40.620 41.866 -1.246 1
1 945 . 10 1 1 A 81 81 LEU N N 81 119.890 118.692 1.198 1
1 946 . 10 1 1 A 82 82 THR H H 82 8.320 7.787 0.533 1
1 947 . 10 1 1 A 82 82 THR HA H 82 3.800 3.988 -0.188 1
1 952 . 10 1 1 A 82 82 THR C C 82 181.010 176.922 4.088 1
1 953 . 10 1 1 A 82 82 THR CA C 82 68.500 66.227 2.273 1
1 954 . 10 1 1 A 82 82 THR CB C 82 67.400 69.254 -1.854 1
1 956 . 10 1 1 A 82 82 THR N N 82 117.120 113.100 4.020 1
1 957 . 10 1 1 A 83 83 VAL H H 83 8.530 7.514 1.016 1
1 958 . 10 1 1 A 83 83 VAL HA H 83 3.890 3.882 0.008 1
1 966 . 10 1 1 A 83 83 VAL C C 83 178.120 178.259 -0.139 1
1 967 . 10 1 1 A 83 83 VAL CA C 83 67.400 65.191 2.209 1
1 968 . 10 1 1 A 83 83 VAL CB C 83 31.590 31.485 0.105 1
1 971 . 10 1 1 A 83 83 VAL N N 83 119.760 118.046 1.714 1
1 972 . 10 1 1 A 84 84 ALA H H 84 7.910 8.486 -0.576 1
1 973 . 10 1 1 A 84 84 ALA HA H 84 4.060 4.082 -0.022 1
1 977 . 10 1 1 A 84 84 ALA C C 84 180.560 180.032 0.528 1
1 978 . 10 1 1 A 84 84 ALA CA C 84 55.000 55.013 -0.013 1
1 979 . 10 1 1 A 84 84 ALA CB C 84 17.230 18.261 -1.031 1
1 980 . 10 1 1 A 84 84 ALA N N 84 122.620 124.507 -1.887 1
1 981 . 10 1 1 A 85 85 CYS H H 85 8.580 7.851 0.729 1
1 982 . 10 1 1 A 85 85 CYS HA H 85 4.080 4.527 -0.447 1
1 985 . 10 1 1 A 85 85 CYS C C 85 179.060 177.034 2.026 1
1 986 . 10 1 1 A 85 85 CYS CA C 85 63.210 61.818 1.392 1
1 987 . 10 1 1 A 85 85 CYS CB C 85 26.310 27.535 -1.225 1
1 988 . 10 1 1 A 85 85 CYS N N 85 118.730 117.408 1.322 1
1 989 . 10 1 1 A 86 86 ASN H H 86 8.430 8.101 0.329 1
1 990 . 10 1 1 A 86 86 ASN CA C 86 55.860 56.458 -0.598 1
1 991 . 10 1 1 A 86 86 ASN CB C 86 37.440 37.785 -0.345 1
1 992 . 10 1 1 A 86 86 ASN N N 86 119.360 119.310 0.050 1
1 993 . 10 1 1 A 87 87 ASN H H 87 7.880 7.793 0.087 1
1 994 . 10 1 1 A 87 87 ASN HA H 87 4.600 4.401 0.199 1
1 997 . 10 1 1 A 87 87 ASN C C 87 178.510 177.315 1.195 1
1 998 . 10 1 1 A 87 87 ASN CA C 87 56.470 56.632 -0.162 1
1 999 . 10 1 1 A 87 87 ASN CB C 87 37.500 37.943 -0.443 1
1 1000 . 10 1 1 A 87 87 ASN N N 87 119.480 117.516 1.964 1
1 1001 . 10 1 1 A 88 88 PHE H H 88 8.050 7.359 0.691 1
1 1002 . 10 1 1 A 88 88 PHE HA H 88 4.200 4.600 -0.400 1
1 1005 . 10 1 1 A 88 88 PHE C C 88 178.510 177.203 1.307 1
1 1006 . 10 1 1 A 88 88 PHE CA C 88 56.460 58.960 -2.500 1
1 1007 . 10 1 1 A 88 88 PHE CB C 88 38.500 38.236 0.264 1
1 1008 . 10 1 1 A 88 88 PHE N N 88 120.280 117.568 2.712 1
1 1009 . 10 1 1 A 89 89 PHE H H 89 8.020 8.576 -0.556 1
1 1010 . 10 1 1 A 89 89 PHE HA H 89 4.000 4.337 -0.337 1
1 1013 . 10 1 1 A 89 89 PHE C C 89 177.340 177.544 -0.204 1
1 1014 . 10 1 1 A 89 89 PHE CA C 89 59.000 59.865 -0.865 1
1 1015 . 10 1 1 A 89 89 PHE CB C 89 37.430 39.846 -2.416 1
1 1016 . 10 1 1 A 89 89 PHE N N 89 120.910 120.127 0.783 1
1 1017 . 10 1 1 A 90 90 TRP H H 90 7.800 7.776 0.024 1
1 1018 . 10 1 1 A 90 90 TRP HA H 90 4.460 4.383 0.077 1
1 1021 . 10 1 1 A 90 90 TRP C C 90 177.340 175.892 1.448 1
1 1022 . 10 1 1 A 90 90 TRP CA C 90 57.930 60.676 -2.746 1
1 1023 . 10 1 1 A 90 90 TRP CB C 90 42.000 29.618 12.382 1
1 1024 . 10 1 1 A 90 90 TRP N N 90 120.050 121.836 -1.786 1
1 1025 . 10 1 1 A 91 91 GLU H H 91 7.800 7.795 0.005 1
1 1026 . 10 1 1 A 91 91 GLU HA H 91 4.050 4.209 -0.159 1
1 1031 . 10 1 1 A 91 91 GLU C C 91 177.570 176.403 1.167 1
1 1032 . 10 1 1 A 91 91 GLU CA C 91 57.350 56.895 0.455 1
1 1033 . 10 1 1 A 91 91 GLU CB C 91 29.530 29.908 -0.378 1
1 1035 . 10 1 1 A 91 91 GLU N N 91 120.730 116.166 4.564 1
1 1036 . 10 1 1 A 92 92 ASN H H 92 7.800 9.160 -1.360 1
1 1037 . 10 1 1 A 92 92 ASN HA H 92 4.630 4.263 0.367 1
1 1040 . 10 1 1 A 92 92 ASN C C 92 174.450 173.959 0.491 1
1 1041 . 10 1 1 A 92 92 ASN CA C 92 52.960 53.888 -0.928 1
1 1042 . 10 1 1 A 92 92 ASN CB C 92 29.530 37.260 -7.730 1
1 1043 . 10 1 1 A 92 92 ASN N N 92 119.410 119.584 -0.174 1
1 5 . 11 1 1 A 2 2 SER H H 2 9.000 7.820 1.180 1
1 6 . 11 1 1 A 2 2 SER HA H 2 4.690 4.587 0.103 1
1 9 . 11 1 1 A 2 2 SER C C 2 176.170 175.001 1.169 1
1 10 . 11 1 1 A 2 2 SER CA C 2 57.340 57.882 -0.542 1
1 11 . 11 1 1 A 2 2 SER CB C 2 65.550 64.537 1.013 1
1 12 . 11 1 1 A 2 2 SER N N 2 119.330 116.476 2.854 1
1 13 . 11 1 1 A 3 3 GLU H H 3 9.350 9.085 0.265 1
1 14 . 11 1 1 A 3 3 GLU HA H 3 4.060 3.989 0.071 1
1 17 . 11 1 1 A 3 3 GLU C C 3 180.150 178.423 1.727 1
1 18 . 11 1 1 A 3 3 GLU CA C 3 60.280 59.373 0.907 1
1 19 . 11 1 1 A 3 3 GLU CB C 3 29.230 29.553 -0.323 1
1 21 . 11 1 1 A 3 3 GLU N N 3 125.350 124.032 1.318 1
1 22 . 11 1 1 A 4 4 LEU H H 4 9.060 8.375 0.685 1
1 23 . 11 1 1 A 4 4 LEU HA H 4 4.080 3.948 0.132 1
1 33 . 11 1 1 A 4 4 LEU C C 4 177.890 179.066 -1.176 1
1 34 . 11 1 1 A 4 4 LEU CA C 4 58.090 57.991 0.099 1
1 35 . 11 1 1 A 4 4 LEU CB C 4 42.120 41.422 0.698 1
1 39 . 11 1 1 A 4 4 LEU N N 4 121.090 120.302 0.788 1
1 40 . 11 1 1 A 5 5 GLU H H 5 8.340 8.312 0.028 1
1 41 . 11 1 1 A 5 5 GLU HA H 5 4.050 3.912 0.138 1
1 46 . 11 1 1 A 5 5 GLU C C 5 177.030 179.333 -2.303 1
1 47 . 11 1 1 A 5 5 GLU CA C 5 59.840 59.346 0.494 1
1 48 . 11 1 1 A 5 5 GLU CB C 5 28.940 29.092 -0.152 1
1 50 . 11 1 1 A 5 5 GLU N N 5 119.780 119.791 -0.011 1
1 51 . 11 1 1 A 6 6 THR H H 6 8.370 8.012 0.358 1
1 52 . 11 1 1 A 6 6 THR HA H 6 4.310 3.870 0.440 1
1 57 . 11 1 1 A 6 6 THR C C 6 177.340 176.864 0.476 1
1 58 . 11 1 1 A 6 6 THR CA C 6 66.630 66.313 0.317 1
1 59 . 11 1 1 A 6 6 THR CB C 6 68.650 68.496 0.154 1
1 61 . 11 1 1 A 6 6 THR N N 6 116.940 117.223 -0.283 1
1 62 . 11 1 1 A 7 7 ALA H H 7 8.270 7.714 0.556 1
1 63 . 11 1 1 A 7 7 ALA HA H 7 4.190 3.999 0.191 1
1 67 . 11 1 1 A 7 7 ALA C C 7 179.760 179.337 0.423 1
1 68 . 11 1 1 A 7 7 ALA CA C 7 55.880 55.085 0.795 1
1 69 . 11 1 1 A 7 7 ALA CB C 7 17.720 17.999 -0.279 1
1 70 . 11 1 1 A 7 7 ALA N N 7 127.400 123.978 3.422 1
1 71 . 11 1 1 A 8 8 MET H H 8 8.110 7.627 0.483 1
1 72 . 11 1 1 A 8 8 MET HA H 8 4.020 4.120 -0.100 1
1 80 . 11 1 1 A 8 8 MET C C 8 178.510 177.891 0.619 1
1 81 . 11 1 1 A 8 8 MET CA C 8 60.580 58.162 2.418 1
1 82 . 11 1 1 A 8 8 MET CB C 8 33.630 32.170 1.460 1
1 85 . 11 1 1 A 8 8 MET N N 8 117.520 118.332 -0.812 1
1 86 . 11 1 1 A 9 9 GLU H H 9 8.210 7.931 0.279 1
1 87 . 11 1 1 A 9 9 GLU HA H 9 3.830 4.013 -0.183 1
1 92 . 11 1 1 A 9 9 GLU C C 9 179.140 178.420 0.720 1
1 93 . 11 1 1 A 9 9 GLU CA C 9 59.690 59.305 0.385 1
1 94 . 11 1 1 A 9 9 GLU CB C 9 29.530 28.988 0.542 1
1 96 . 11 1 1 A 9 9 GLU N N 9 118.560 118.197 0.363 1
1 97 . 11 1 1 A 10 10 THR H H 10 8.490 7.660 0.830 1
1 98 . 11 1 1 A 10 10 THR HA H 10 4.000 3.950 0.050 1
1 103 . 11 1 1 A 10 10 THR C C 10 176.010 176.111 -0.101 1
1 104 . 11 1 1 A 10 10 THR CA C 10 67.110 65.805 1.305 1
1 105 . 11 1 1 A 10 10 THR CB C 10 67.770 69.361 -1.591 1
1 107 . 11 1 1 A 10 10 THR N N 10 118.310 115.445 2.865 1
1 108 . 11 1 1 A 11 11 LEU H H 11 7.920 7.652 0.268 1
1 109 . 11 1 1 A 11 11 LEU HA H 11 3.930 3.580 0.350 1
1 119 . 11 1 1 A 11 11 LEU C C 11 178.820 178.593 0.227 1
1 120 . 11 1 1 A 11 11 LEU CA C 11 59.690 57.646 2.044 1
1 121 . 11 1 1 A 11 11 LEU CB C 11 41.920 41.435 0.485 1
1 125 . 11 1 1 A 11 11 LEU N N 11 121.150 120.915 0.235 1
1 126 . 11 1 1 A 12 12 ILE H H 12 7.440 7.495 -0.055 1
1 127 . 11 1 1 A 12 12 ILE HA H 12 3.640 3.980 -0.340 1
1 137 . 11 1 1 A 12 12 ILE C C 12 179.530 178.328 1.202 1
1 138 . 11 1 1 A 12 12 ILE CA C 12 63.740 64.287 -0.547 1
1 139 . 11 1 1 A 12 12 ILE CB C 12 38.800 36.933 1.867 1
1 143 . 11 1 1 A 12 12 ILE N N 12 118.010 120.865 -2.855 1
1 144 . 11 1 1 A 13 13 ASN H H 13 8.930 9.044 -0.114 1
1 145 . 11 1 1 A 13 13 ASN HA H 13 4.520 4.503 0.017 1
1 148 . 11 1 1 A 13 13 ASN C C 13 179.450 177.518 1.932 1
1 149 . 11 1 1 A 13 13 ASN CA C 13 56.470 56.335 0.135 1
1 150 . 11 1 1 A 13 13 ASN CB C 13 37.930 38.764 -0.834 1
1 151 . 11 1 1 A 13 13 ASN N N 13 121.820 120.753 1.067 1
1 152 . 11 1 1 A 14 14 VAL H H 14 9.180 7.839 1.341 1
1 153 . 11 1 1 A 14 14 VAL HA H 14 3.830 3.973 -0.143 1
1 161 . 11 1 1 A 14 14 VAL CA C 14 65.840 65.506 0.334 1
1 162 . 11 1 1 A 14 14 VAL CB C 14 31.290 31.812 -0.522 1
1 165 . 11 1 1 A 14 14 VAL N N 14 122.040 117.044 4.996 1
1 166 . 11 1 1 A 15 15 PHE H H 15 7.590 8.300 -0.710 1
1 167 . 11 1 1 A 15 15 PHE HA H 15 3.360 4.269 -0.909 1
1 170 . 11 1 1 A 15 15 PHE C C 15 177.890 178.260 -0.370 1
1 171 . 11 1 1 A 15 15 PHE CA C 15 62.030 60.453 1.577 1
1 172 . 11 1 1 A 15 15 PHE CB C 15 38.900 38.493 0.407 1
1 173 . 11 1 1 A 15 15 PHE N N 15 118.290 120.285 -1.995 1
1 174 . 11 1 1 A 16 16 HIS H H 16 7.790 8.538 -0.748 1
1 175 . 11 1 1 A 16 16 HIS HA H 16 4.890 4.493 0.397 1
1 178 . 11 1 1 A 16 16 HIS C C 16 177.810 177.640 0.170 1
1 179 . 11 1 1 A 16 16 HIS CA C 16 59.100 60.104 -1.004 1
1 180 . 11 1 1 A 16 16 HIS CB C 16 28.060 29.372 -1.312 1
1 181 . 11 1 1 A 16 16 HIS N N 16 118.290 117.516 0.774 1
1 182 . 11 1 1 A 17 17 ALA H H 17 8.040 8.082 -0.042 1
1 183 . 11 1 1 A 17 17 ALA HA H 17 4.050 4.064 -0.014 1
1 187 . 11 1 1 A 17 17 ALA C C 17 179.600 180.024 -0.424 1
1 188 . 11 1 1 A 17 17 ALA CA C 17 54.000 55.420 -1.420 1
1 189 . 11 1 1 A 17 17 ALA CB C 17 17.520 18.825 -1.305 1
1 190 . 11 1 1 A 17 17 ALA N N 17 124.410 121.797 2.613 1
1 191 . 11 1 1 A 18 18 HIS H H 18 7.000 7.898 -0.898 1
1 192 . 11 1 1 A 18 18 HIS HA H 18 4.330 4.401 -0.071 1
1 195 . 11 1 1 A 18 18 HIS C C 18 176.320 177.937 -1.617 1
1 196 . 11 1 1 A 18 18 HIS CA C 18 57.350 59.630 -2.280 1
1 197 . 11 1 1 A 18 18 HIS CB C 18 32.920 30.264 2.656 1
1 198 . 11 1 1 A 18 18 HIS N N 18 115.160 116.137 -0.977 1
1 199 . 11 1 1 A 19 19 SER H H 19 8.380 8.277 0.103 1
1 200 . 11 1 1 A 19 19 SER HA H 19 3.640 4.429 -0.789 1
1 203 . 11 1 1 A 19 19 SER C C 19 177.340 176.055 1.285 1
1 204 . 11 1 1 A 19 19 SER CA C 19 60.160 62.964 -2.804 1
1 205 . 11 1 1 A 19 19 SER CB C 19 61.000 62.936 -1.936 1
1 206 . 11 1 1 A 19 19 SER N N 19 114.380 115.654 -1.274 1
1 207 . 11 1 1 A 20 20 GLY H H 20 7.600 7.976 -0.376 1
1 208 . 11 1 1 A 20 20 GLY HA2 H 20 3.680 4.010 -0.330 1
1 209 . 11 1 1 A 20 20 GLY HA3 H 20 4.000 4.038 -0.038 1
1 210 . 11 1 1 A 20 20 GLY C C 20 174.140 174.456 -0.316 1
1 211 . 11 1 1 A 20 20 GLY CA C 20 47.000 45.377 1.623 1
1 212 . 11 1 1 A 20 20 GLY N N 20 112.550 108.096 4.454 1
1 213 . 11 1 1 A 21 21 LYS H H 21 7.230 8.074 -0.844 1
1 214 . 11 1 1 A 21 21 LYS HA H 21 3.860 4.657 -0.797 1
1 223 . 11 1 1 A 21 21 LYS C C 21 177.730 177.131 0.599 1
1 224 . 11 1 1 A 21 21 LYS CA C 21 59.110 57.559 1.551 1
1 225 . 11 1 1 A 21 21 LYS CB C 21 32.460 34.771 -2.311 1
1 229 . 11 1 1 A 21 21 LYS N N 21 123.240 119.374 3.866 1
1 230 . 11 1 1 A 22 22 GLU H H 22 9.350 7.988 1.362 1
1 231 . 11 1 1 A 22 22 GLU HA H 22 4.610 4.287 0.323 1
1 236 . 11 1 1 A 22 22 GLU C C 22 177.420 176.051 1.369 1
1 237 . 11 1 1 A 22 22 GLU CA C 22 53.700 56.407 -2.707 1
1 238 . 11 1 1 A 22 22 GLU CB C 22 32.000 28.296 3.704 1
1 240 . 11 1 1 A 22 22 GLU N N 22 116.770 119.019 -2.249 1
1 241 . 11 1 1 A 23 23 GLY H H 23 7.570 8.201 -0.631 1
1 242 . 11 1 1 A 23 23 GLY HA2 H 23 3.630 4.079 -0.449 1
1 243 . 11 1 1 A 23 23 GLY HA3 H 23 3.880 4.084 -0.204 1
1 244 . 11 1 1 A 23 23 GLY C C 23 173.980 171.495 2.485 1
1 245 . 11 1 1 A 23 23 GLY CA C 23 45.250 45.821 -0.571 1
1 246 . 11 1 1 A 23 23 GLY N N 23 112.180 108.248 3.932 1
1 247 . 11 1 1 A 24 24 ASP H H 24 8.680 8.293 0.387 1
1 248 . 11 1 1 A 24 24 ASP HA H 24 4.380 4.815 -0.435 1
1 251 . 11 1 1 A 24 24 ASP C C 24 178.590 177.742 0.848 1
1 252 . 11 1 1 A 24 24 ASP CA C 24 60.000 53.252 6.748 1
1 253 . 11 1 1 A 24 24 ASP CB C 24 27.480 41.705 -14.225 1
1 254 . 11 1 1 A 24 24 ASP N N 24 127.470 122.765 4.705 1
1 255 . 11 1 1 A 25 25 LYS H H 25 9.270 8.576 0.694 1
1 256 . 11 1 1 A 25 25 LYS HA H 25 4.250 3.928 0.322 1
1 265 . 11 1 1 A 25 25 LYS C C 25 177.030 177.003 0.027 1
1 266 . 11 1 1 A 25 25 LYS CA C 25 60.000 59.719 0.281 1
1 267 . 11 1 1 A 25 25 LYS CB C 25 31.170 32.526 -1.356 1
1 271 . 11 1 1 A 25 25 LYS N N 25 132.960 121.577 11.383 1
1 272 . 11 1 1 A 26 26 TYR H H 26 9.430 7.140 2.290 1
1 273 . 11 1 1 A 26 26 TYR HA H 26 4.640 4.814 -0.174 1
1 276 . 11 1 1 A 26 26 TYR C C 26 174.290 174.465 -0.175 1
1 277 . 11 1 1 A 26 26 TYR CA C 26 56.010 57.224 -1.214 1
1 278 . 11 1 1 A 26 26 TYR CB C 26 37.730 39.270 -1.540 1
1 279 . 11 1 1 A 26 26 TYR N N 26 120.650 112.579 8.071 1
1 280 . 11 1 1 A 27 27 LYS H H 27 7.110 7.091 0.019 1
1 281 . 11 1 1 A 27 27 LYS HA H 27 5.110 5.059 0.051 1
1 290 . 11 1 1 A 27 27 LYS C C 27 175.150 173.784 1.366 1
1 291 . 11 1 1 A 27 27 LYS CA C 27 55.070 54.772 0.298 1
1 292 . 11 1 1 A 27 27 LYS CB C 27 38.900 36.066 2.834 1
1 296 . 11 1 1 A 27 27 LYS N N 27 115.830 121.664 -5.834 1
1 297 . 11 1 1 A 28 28 LEU H H 28 9.820 8.218 1.602 1
1 298 . 11 1 1 A 28 28 LEU HA H 28 5.080 4.760 0.320 1
1 308 . 11 1 1 A 28 28 LEU C C 28 176.640 174.973 1.667 1
1 309 . 11 1 1 A 28 28 LEU CA C 28 52.660 54.019 -1.359 1
1 310 . 11 1 1 A 28 28 LEU CB C 28 42.710 43.978 -1.268 1
1 314 . 11 1 1 A 28 28 LEU N N 28 126.930 128.796 -1.866 1
1 315 . 11 1 1 A 29 29 SER H H 29 9.890 8.286 1.604 1
1 316 . 11 1 1 A 29 29 SER HA H 29 4.530 4.985 -0.455 1
1 319 . 11 1 1 A 29 29 SER C C 29 174.990 174.653 0.337 1
1 320 . 11 1 1 A 29 29 SER CA C 29 56.180 55.953 0.227 1
1 321 . 11 1 1 A 29 29 SER CB C 29 65.550 65.680 -0.130 1
1 322 . 11 1 1 A 29 29 SER N N 29 121.600 119.869 1.731 1
1 323 . 11 1 1 A 30 30 LYS H H 30 8.850 8.859 -0.009 1
1 324 . 11 1 1 A 30 30 LYS HA H 30 3.850 3.878 -0.028 1
1 333 . 11 1 1 A 30 30 LYS C C 30 175.620 177.573 -1.953 1
1 334 . 11 1 1 A 30 30 LYS CA C 30 60.860 60.048 0.812 1
1 335 . 11 1 1 A 30 30 LYS CB C 30 31.290 32.073 -0.783 1
1 339 . 11 1 1 A 30 30 LYS N N 30 121.260 126.339 -5.079 1
1 340 . 11 1 1 A 31 31 LYS H H 31 7.970 7.885 0.085 1
1 341 . 11 1 1 A 31 31 LYS HA H 31 3.880 4.026 -0.146 1
1 350 . 11 1 1 A 31 31 LYS C C 31 179.290 179.440 -0.150 1
1 351 . 11 1 1 A 31 31 LYS CA C 31 59.110 59.114 -0.004 1
1 352 . 11 1 1 A 31 31 LYS CB C 31 32.640 31.647 0.993 1
1 356 . 11 1 1 A 31 31 LYS N N 31 121.260 118.517 2.743 1
1 357 . 11 1 1 A 32 32 GLU H H 32 7.510 8.081 -0.571 1
1 358 . 11 1 1 A 32 32 GLU HA H 32 3.830 4.065 -0.235 1
1 363 . 11 1 1 A 32 32 GLU C C 32 179.290 179.407 -0.117 1
1 364 . 11 1 1 A 32 32 GLU CA C 32 58.590 58.775 -0.185 1
1 365 . 11 1 1 A 32 32 GLU CB C 32 30.120 30.129 -0.009 1
1 367 . 11 1 1 A 32 32 GLU N N 32 120.090 118.961 1.129 1
1 368 . 11 1 1 A 33 33 LEU H H 33 8.970 7.506 1.464 1
1 369 . 11 1 1 A 33 33 LEU HA H 33 3.830 3.244 0.586 1
1 379 . 11 1 1 A 33 33 LEU C C 33 178.200 178.570 -0.370 1
1 380 . 11 1 1 A 33 33 LEU CA C 33 57.930 57.684 0.246 1
1 381 . 11 1 1 A 33 33 LEU CB C 33 40.660 41.231 -0.571 1
1 385 . 11 1 1 A 33 33 LEU N N 33 120.200 119.049 1.151 1
1 386 . 11 1 1 A 34 34 LYS H H 34 8.230 7.546 0.684 1
1 387 . 11 1 1 A 34 34 LYS HA H 34 3.550 3.778 -0.228 1
1 396 . 11 1 1 A 34 34 LYS C C 34 178.040 178.192 -0.152 1
1 397 . 11 1 1 A 34 34 LYS CA C 34 60.720 60.056 0.664 1
1 398 . 11 1 1 A 34 34 LYS CB C 34 31.980 32.197 -0.217 1
1 402 . 11 1 1 A 34 34 LYS N N 34 120.780 119.095 1.685 1
1 403 . 11 1 1 A 35 35 ASP H H 35 7.990 7.805 0.185 1
1 404 . 11 1 1 A 35 35 ASP HA H 35 4.250 4.372 -0.122 1
1 407 . 11 1 1 A 35 35 ASP C C 35 179.060 178.556 0.504 1
1 408 . 11 1 1 A 35 35 ASP CA C 35 56.830 57.639 -0.809 1
1 409 . 11 1 1 A 35 35 ASP CB C 35 40.440 41.249 -0.809 1
1 410 . 11 1 1 A 35 35 ASP N N 35 119.550 119.617 -0.067 1
1 411 . 11 1 1 A 36 36 LEU H H 36 8.130 7.495 0.635 1
1 412 . 11 1 1 A 36 36 LEU HA H 36 2.580 3.865 -1.285 1
1 422 . 11 1 1 A 36 36 LEU C C 36 179.450 179.467 -0.017 1
1 423 . 11 1 1 A 36 36 LEU CA C 36 59.980 57.649 2.331 1
1 424 . 11 1 1 A 36 36 LEU CB C 36 42.180 41.485 0.695 1
1 428 . 11 1 1 A 36 36 LEU N N 36 125.560 119.811 5.749 1
1 429 . 11 1 1 A 37 37 LEU H H 37 8.740 7.805 0.935 1
1 430 . 11 1 1 A 37 37 LEU HA H 37 3.580 3.986 -0.406 1
1 440 . 11 1 1 A 37 37 LEU C C 37 179.290 179.474 -0.184 1
1 441 . 11 1 1 A 37 37 LEU CA C 37 58.230 58.182 0.048 1
1 442 . 11 1 1 A 37 37 LEU CB C 37 41.590 41.026 0.564 1
1 446 . 11 1 1 A 37 37 LEU N N 37 120.520 119.220 1.300 1
1 447 . 11 1 1 A 38 38 GLN H H 38 8.520 8.188 0.332 1
1 448 . 11 1 1 A 38 38 GLN HA H 38 4.000 4.082 -0.082 1
1 453 . 11 1 1 A 38 38 GLN C C 38 177.960 178.459 -0.499 1
1 454 . 11 1 1 A 38 38 GLN CA C 38 58.210 58.352 -0.142 1
1 455 . 11 1 1 A 38 38 GLN CB C 38 28.650 27.931 0.719 1
1 457 . 11 1 1 A 38 38 GLN N N 38 116.740 117.683 -0.943 1
1 458 . 11 1 1 A 39 39 THR H H 39 7.910 7.739 0.171 1
1 459 . 11 1 1 A 39 39 THR HA H 39 4.210 3.865 0.345 1
1 464 . 11 1 1 A 39 39 THR C C 39 177.180 175.707 1.473 1
1 465 . 11 1 1 A 39 39 THR CA C 39 64.730 67.379 -2.649 1
1 466 . 11 1 1 A 39 39 THR CB C 39 69.650 68.642 1.008 1
1 468 . 11 1 1 A 39 39 THR N N 39 111.400 116.937 -5.537 1
1 469 . 11 1 1 A 40 40 GLU H H 40 8.590 7.407 1.183 1
1 470 . 11 1 1 A 40 40 GLU HA H 40 4.680 4.434 0.246 1
1 475 . 11 1 1 A 40 40 GLU C C 40 178.280 177.053 1.227 1
1 476 . 11 1 1 A 40 40 GLU CA C 40 55.880 56.709 -0.829 1
1 477 . 11 1 1 A 40 40 GLU CB C 40 30.990 30.573 0.417 1
1 479 . 11 1 1 A 40 40 GLU N N 40 117.840 116.489 1.351 1
1 480 . 11 1 1 A 41 41 LEU H H 41 7.680 7.563 0.117 1
1 481 . 11 1 1 A 41 41 LEU HA H 41 5.080 4.799 0.281 1
1 491 . 11 1 1 A 41 41 LEU C C 41 179.450 177.212 2.238 1
1 492 . 11 1 1 A 41 41 LEU CA C 41 53.830 53.519 0.311 1
1 493 . 11 1 1 A 41 41 LEU CB C 41 41.360 42.814 -1.454 1
1 497 . 11 1 1 A 41 41 LEU N N 41 121.410 119.793 1.617 1
1 498 . 11 1 1 A 42 42 SER H H 42 8.380 8.320 0.060 1
1 499 . 11 1 1 A 42 42 SER HA H 42 4.130 4.026 0.104 1
1 502 . 11 1 1 A 42 42 SER C C 42 176.640 176.904 -0.264 1
1 503 . 11 1 1 A 42 42 SER CA C 42 61.280 62.168 -0.888 1
1 504 . 11 1 1 A 42 42 SER CB C 42 63.040 62.852 0.188 1
1 505 . 11 1 1 A 42 42 SER N N 42 117.420 118.002 -0.582 1
1 506 . 11 1 1 A 43 43 SER H H 43 8.900 8.154 0.746 1
1 507 . 11 1 1 A 43 43 SER HA H 43 4.290 4.223 0.067 1
1 510 . 11 1 1 A 43 43 SER C C 43 175.620 176.727 -1.107 1
1 511 . 11 1 1 A 43 43 SER CA C 43 60.860 62.309 -1.449 1
1 512 . 11 1 1 A 43 43 SER CB C 43 62.910 63.531 -0.621 1
1 513 . 11 1 1 A 43 43 SER N N 43 117.580 117.328 0.252 1
1 514 . 11 1 1 A 44 44 PHE H H 44 7.880 7.999 -0.119 1
1 515 . 11 1 1 A 44 44 PHE HA H 44 4.240 4.257 -0.017 1
1 518 . 11 1 1 A 44 44 PHE C C 44 176.950 175.708 1.242 1
1 519 . 11 1 1 A 44 44 PHE CA C 44 62.710 60.896 1.814 1
1 520 . 11 1 1 A 44 44 PHE CB C 44 39.020 39.187 -0.167 1
1 521 . 11 1 1 A 44 44 PHE N N 44 119.480 121.879 -2.399 1
1 522 . 11 1 1 A 45 45 LEU H H 45 8.060 8.098 -0.038 1
1 523 . 11 1 1 A 45 45 LEU HA H 45 3.810 4.154 -0.344 1
1 533 . 11 1 1 A 45 45 LEU C C 45 177.500 176.350 1.150 1
1 534 . 11 1 1 A 45 45 LEU CA C 45 59.980 55.935 4.045 1
1 535 . 11 1 1 A 45 45 LEU CB C 45 39.640 42.420 -2.780 1
1 538 . 11 1 1 A 45 45 LEU N N 45 118.010 121.736 -3.726 1
1 539 . 11 1 1 A 46 46 ASP H H 46 8.150 8.505 -0.355 1
1 540 . 11 1 1 A 46 46 ASP HA H 46 4.470 5.057 -0.587 1
1 543 . 11 1 1 A 46 46 ASP C C 46 179.920 175.063 4.857 1
1 544 . 11 1 1 A 46 46 ASP CA C 46 52.950 53.349 -0.399 1
1 545 . 11 1 1 A 46 46 ASP CB C 46 40.000 41.691 -1.691 1
1 546 . 11 1 1 A 46 46 ASP N N 46 119.460 123.081 -3.621 1
1 547 . 11 1 1 A 47 47 VAL H H 47 8.010 8.445 -0.435 1
1 548 . 11 1 1 A 47 47 VAL HA H 47 3.800 4.366 -0.566 1
1 556 . 11 1 1 A 47 47 VAL C C 47 175.460 176.904 -1.444 1
1 557 . 11 1 1 A 47 47 VAL CA C 47 60.000 62.569 -2.569 1
1 558 . 11 1 1 A 47 47 VAL CB C 47 31.580 33.152 -1.572 1
1 561 . 11 1 1 A 47 47 VAL N N 47 117.720 120.784 -3.064 1
1 562 . 11 1 1 A 48 48 GLN H H 48 7.960 8.949 -0.989 1
1 563 . 11 1 1 A 48 48 GLN HA H 48 4.060 4.019 0.041 1
1 568 . 11 1 1 A 48 48 GLN C C 48 179.370 178.925 0.445 1
1 569 . 11 1 1 A 48 48 GLN CA C 48 57.350 58.869 -1.519 1
1 570 . 11 1 1 A 48 48 GLN CB C 48 28.990 28.393 0.597 1
1 572 . 11 1 1 A 48 48 GLN N N 48 119.900 121.661 -1.761 1
1 573 . 11 1 1 A 49 49 LYS H H 49 7.810 8.408 -0.598 1
1 574 . 11 1 1 A 49 49 LYS HA H 49 3.860 4.169 -0.309 1
1 583 . 11 1 1 A 49 49 LYS C C 49 177.890 176.219 1.671 1
1 584 . 11 1 1 A 49 49 LYS CA C 49 58.230 58.410 -0.180 1
1 585 . 11 1 1 A 49 49 LYS CB C 49 30.990 31.649 -0.659 1
1 587 . 11 1 1 A 49 49 LYS N N 49 120.030 118.481 1.549 1
1 588 . 11 1 1 A 50 50 ASP H H 50 7.570 7.824 -0.254 1
1 589 . 11 1 1 A 50 50 ASP HA H 50 4.700 4.799 -0.099 1
1 590 . 11 1 1 A 50 50 ASP CA C 50 52.950 53.182 -0.232 1
1 591 . 11 1 1 A 50 50 ASP CB C 50 38.900 41.239 -2.339 1
1 592 . 11 1 1 A 50 50 ASP N N 50 116.730 120.115 -3.385 1
1 593 . 11 1 1 A 51 51 ALA H H 51 7.570 8.802 -1.232 1
1 594 . 11 1 1 A 51 51 ALA HA H 51 4.200 3.943 0.257 1
1 598 . 11 1 1 A 51 51 ALA C C 51 179.760 179.131 0.629 1
1 599 . 11 1 1 A 51 51 ALA CA C 51 54.200 55.350 -1.150 1
1 600 . 11 1 1 A 51 51 ALA CB C 51 18.110 18.338 -0.228 1
1 601 . 11 1 1 A 51 51 ALA N N 51 118.390 127.417 -9.027 1
1 602 . 11 1 1 A 52 52 ASP H H 52 8.430 7.978 0.452 1
1 603 . 11 1 1 A 52 52 ASP HA H 52 4.600 4.337 0.263 1
1 606 . 11 1 1 A 52 52 ASP C C 52 177.570 178.176 -0.606 1
1 607 . 11 1 1 A 52 52 ASP CA C 52 54.420 57.338 -2.918 1
1 608 . 11 1 1 A 52 52 ASP CB C 52 40.360 42.145 -1.785 1
1 609 . 11 1 1 A 52 52 ASP N N 52 117.530 118.701 -1.171 1
1 610 . 11 1 1 A 53 53 ALA H H 53 7.660 7.557 0.103 1
1 611 . 11 1 1 A 53 53 ALA HA H 53 3.860 4.003 -0.143 1
1 615 . 11 1 1 A 53 53 ALA C C 53 180.070 180.461 -0.391 1
1 616 . 11 1 1 A 53 53 ALA CA C 53 55.590 55.327 0.263 1
1 617 . 11 1 1 A 53 53 ALA CB C 53 18.800 18.204 0.596 1
1 618 . 11 1 1 A 53 53 ALA N N 53 123.450 121.570 1.880 1
1 619 . 11 1 1 A 54 54 VAL H H 54 8.030 7.684 0.346 1
1 620 . 11 1 1 A 54 54 VAL HA H 54 3.240 3.720 -0.480 1
1 628 . 11 1 1 A 54 54 VAL C C 54 177.340 177.679 -0.339 1
1 629 . 11 1 1 A 54 54 VAL CA C 54 66.620 65.643 0.977 1
1 630 . 11 1 1 A 54 54 VAL CB C 54 30.480 30.937 -0.457 1
1 633 . 11 1 1 A 54 54 VAL N N 54 116.150 116.998 -0.848 1
1 634 . 11 1 1 A 55 55 ASP H H 55 7.660 7.600 0.060 1
1 635 . 11 1 1 A 55 55 ASP HA H 55 4.080 4.361 -0.281 1
1 638 . 11 1 1 A 55 55 ASP C C 55 177.260 179.320 -2.060 1
1 639 . 11 1 1 A 55 55 ASP CA C 55 57.640 57.335 0.305 1
1 640 . 11 1 1 A 55 55 ASP CB C 55 40.360 40.232 0.128 1
1 641 . 11 1 1 A 55 55 ASP N N 55 120.830 122.087 -1.257 1
1 642 . 11 1 1 A 56 56 LYS H H 56 7.780 7.555 0.225 1
1 643 . 11 1 1 A 56 56 LYS HA H 56 3.860 4.004 -0.144 1
1 652 . 11 1 1 A 56 56 LYS C C 56 179.530 179.494 0.036 1
1 653 . 11 1 1 A 56 56 LYS CA C 56 59.690 59.669 0.021 1
1 654 . 11 1 1 A 56 56 LYS CB C 56 31.870 32.515 -0.645 1
1 658 . 11 1 1 A 56 56 LYS N N 56 120.010 120.127 -0.117 1
1 659 . 11 1 1 A 57 57 ILE H H 57 8.090 7.954 0.136 1
1 660 . 11 1 1 A 57 57 ILE HA H 57 3.390 3.617 -0.227 1
1 670 . 11 1 1 A 57 57 ILE C C 57 176.710 177.693 -0.983 1
1 671 . 11 1 1 A 57 57 ILE CA C 57 64.960 65.162 -0.202 1
1 672 . 11 1 1 A 57 57 ILE CB C 57 38.080 38.322 -0.242 1
1 676 . 11 1 1 A 57 57 ILE N N 57 120.960 120.374 0.586 1
1 677 . 11 1 1 A 58 58 MET H H 58 8.480 8.216 0.264 1
1 678 . 11 1 1 A 58 58 MET HA H 58 3.800 4.049 -0.249 1
1 686 . 11 1 1 A 58 58 MET C C 58 177.570 178.065 -0.495 1
1 687 . 11 1 1 A 58 58 MET CA C 58 58.570 58.423 0.147 1
1 688 . 11 1 1 A 58 58 MET CB C 58 32.570 31.790 0.780 1
1 691 . 11 1 1 A 58 58 MET N N 58 119.160 120.676 -1.516 1
1 692 . 11 1 1 A 59 59 LYS H H 59 7.550 7.967 -0.417 1
1 693 . 11 1 1 A 59 59 LYS HA H 59 3.930 3.957 -0.027 1
1 702 . 11 1 1 A 59 59 LYS C C 59 179.530 179.175 0.355 1
1 703 . 11 1 1 A 59 59 LYS CA C 59 58.820 59.696 -0.876 1
1 704 . 11 1 1 A 59 59 LYS CB C 59 32.450 32.519 -0.069 1
1 708 . 11 1 1 A 59 59 LYS N N 59 116.730 119.808 -3.078 1
1 709 . 11 1 1 A 60 60 GLU H H 60 7.470 7.891 -0.421 1
1 710 . 11 1 1 A 60 60 GLU HA H 60 4.050 4.072 -0.022 1
1 715 . 11 1 1 A 60 60 GLU C C 60 178.950 178.208 0.742 1
1 716 . 11 1 1 A 60 60 GLU CA C 60 58.600 59.068 -0.468 1
1 717 . 11 1 1 A 60 60 GLU CB C 60 31.700 29.491 2.209 1
1 719 . 11 1 1 A 60 60 GLU N N 60 116.820 119.404 -2.584 1
1 720 . 11 1 1 A 61 61 LEU H H 61 8.030 7.721 0.309 1
1 721 . 11 1 1 A 61 61 LEU HA H 61 4.310 4.278 0.032 1
1 731 . 11 1 1 A 61 61 LEU C C 61 179.450 177.252 2.198 1
1 732 . 11 1 1 A 61 61 LEU CA C 61 54.840 56.066 -1.226 1
1 733 . 11 1 1 A 61 61 LEU CB C 61 43.820 42.192 1.628 1
1 737 . 11 1 1 A 61 61 LEU N N 61 116.000 118.032 -2.032 1
1 738 . 11 1 1 A 62 62 ASP H H 62 7.890 8.998 -1.108 1
1 739 . 11 1 1 A 62 62 ASP HA H 62 4.660 4.847 -0.187 1
1 742 . 11 1 1 A 62 62 ASP C C 62 177.030 176.255 0.775 1
1 743 . 11 1 1 A 62 62 ASP CA C 62 53.660 53.603 0.057 1
1 744 . 11 1 1 A 62 62 ASP CB C 62 38.700 39.210 -0.510 1
1 745 . 11 1 1 A 62 62 ASP N N 62 117.550 117.951 -0.401 1
1 746 . 11 1 1 A 63 63 GLU H H 63 8.430 9.551 -1.121 1
1 747 . 11 1 1 A 63 63 GLU HA H 63 4.020 4.054 -0.034 1
1 752 . 11 1 1 A 63 63 GLU C C 63 178.120 178.964 -0.844 1
1 753 . 11 1 1 A 63 63 GLU CA C 63 58.470 59.257 -0.787 1
1 754 . 11 1 1 A 63 63 GLU CB C 63 30.120 29.519 0.601 1
1 756 . 11 1 1 A 63 63 GLU N N 63 130.230 120.447 9.783 1
1 757 . 11 1 1 A 64 64 ASN H H 64 8.010 8.122 -0.112 1
1 758 . 11 1 1 A 64 64 ASN HA H 64 4.680 4.684 -0.004 1
1 761 . 11 1 1 A 64 64 ASN C C 64 177.100 176.082 1.018 1
1 762 . 11 1 1 A 64 64 ASN CA C 64 51.780 53.304 -1.524 1
1 763 . 11 1 1 A 64 64 ASN CB C 64 37.260 38.923 -1.663 1
1 764 . 11 1 1 A 64 64 ASN N N 64 113.640 115.685 -2.045 1
1 765 . 11 1 1 A 65 65 GLY H H 65 7.550 7.887 -0.337 1
1 766 . 11 1 1 A 65 65 GLY HA2 H 65 3.770 3.963 -0.193 1
1 767 . 11 1 1 A 65 65 GLY HA3 H 65 3.770 3.966 -0.196 1
1 768 . 11 1 1 A 65 65 GLY C C 65 178.980 174.982 3.998 1
1 769 . 11 1 1 A 65 65 GLY CA C 65 47.200 46.486 0.714 1
1 770 . 11 1 1 A 65 65 GLY N N 65 113.640 107.555 6.085 1
1 771 . 11 1 1 A 66 66 ASP H H 66 8.110 8.067 0.043 1
1 772 . 11 1 1 A 66 66 ASP HA H 66 4.490 4.572 -0.082 1
1 775 . 11 1 1 A 66 66 ASP C C 66 177.960 177.530 0.430 1
1 776 . 11 1 1 A 66 66 ASP CA C 66 52.960 53.443 -0.483 1
1 777 . 11 1 1 A 66 66 ASP CB C 66 40.540 40.471 0.069 1
1 778 . 11 1 1 A 66 66 ASP N N 66 120.030 120.319 -0.289 1
1 779 . 11 1 1 A 67 67 GLY H H 67 10.260 9.225 1.035 1
1 780 . 11 1 1 A 67 67 GLY HA2 H 67 3.360 3.829 -0.469 1
1 781 . 11 1 1 A 67 67 GLY HA3 H 67 4.000 3.832 0.168 1
1 782 . 11 1 1 A 67 67 GLY C C 67 173.120 173.288 -0.168 1
1 783 . 11 1 1 A 67 67 GLY CA C 67 45.460 45.753 -0.293 1
1 784 . 11 1 1 A 67 67 GLY N N 67 114.100 110.840 3.260 1
1 785 . 11 1 1 A 68 68 GLU H H 68 7.750 7.978 -0.228 1
1 786 . 11 1 1 A 68 68 GLU HA H 68 4.780 4.888 -0.108 1
1 791 . 11 1 1 A 68 68 GLU C C 68 175.930 174.761 1.169 1
1 792 . 11 1 1 A 68 68 GLU CA C 68 54.430 54.320 0.110 1
1 793 . 11 1 1 A 68 68 GLU CB C 68 35.850 33.499 2.351 1
1 795 . 11 1 1 A 68 68 GLU N N 68 118.000 119.147 -1.147 1
1 796 . 11 1 1 A 69 69 VAL H H 69 9.380 8.244 1.136 1
1 797 . 11 1 1 A 69 69 VAL HA H 69 5.260 5.043 0.217 1
1 805 . 11 1 1 A 69 69 VAL C C 69 176.710 173.743 2.967 1
1 806 . 11 1 1 A 69 69 VAL CA C 69 61.280 60.651 0.629 1
1 807 . 11 1 1 A 69 69 VAL CB C 69 33.980 34.790 -0.810 1
1 810 . 11 1 1 A 69 69 VAL N N 69 125.970 120.794 5.176 1
1 811 . 11 1 1 A 70 70 ASP H H 70 9.100 9.237 -0.137 1
1 812 . 11 1 1 A 70 70 ASP HA H 70 5.190 5.010 0.180 1
1 815 . 11 1 1 A 70 70 ASP C C 70 175.700 176.898 -1.198 1
1 816 . 11 1 1 A 70 70 ASP CA C 70 52.370 53.022 -0.652 1
1 817 . 11 1 1 A 70 70 ASP CB C 70 40.950 42.531 -1.581 1
1 818 . 11 1 1 A 70 70 ASP N N 70 130.320 127.177 3.143 1
1 819 . 11 1 1 A 71 71 PHE H H 71 9.090 9.192 -0.102 1
1 820 . 11 1 1 A 71 71 PHE HA H 71 4.100 4.364 -0.264 1
1 823 . 11 1 1 A 71 71 PHE C C 71 177.000 177.941 -0.941 1
1 824 . 11 1 1 A 71 71 PHE CA C 71 58.230 62.821 -4.591 1
1 825 . 11 1 1 A 71 71 PHE CB C 71 36.910 39.569 -2.659 1
1 826 . 11 1 1 A 71 71 PHE N N 71 119.760 125.604 -5.844 1
1 827 . 11 1 1 A 72 72 GLN H H 72 8.440 8.363 0.077 1
1 828 . 11 1 1 A 72 72 GLN HA H 72 3.600 4.168 -0.568 1
1 831 . 11 1 1 A 72 72 GLN C C 72 178.820 178.194 0.626 1
1 832 . 11 1 1 A 72 72 GLN CA C 72 59.500 58.864 0.636 1
1 833 . 11 1 1 A 72 72 GLN CB C 72 29.553 28.445 1.108 1
1 835 . 11 1 1 A 72 72 GLN N N 72 121.820 118.458 3.362 1
1 836 . 11 1 1 A 73 73 GLU H H 73 8.290 7.926 0.364 1
1 837 . 11 1 1 A 73 73 GLU HA H 73 4.070 4.221 -0.151 1
1 842 . 11 1 1 A 73 73 GLU C C 73 179.370 178.956 0.414 1
1 843 . 11 1 1 A 73 73 GLU CA C 73 58.030 58.953 -0.923 1
1 844 . 11 1 1 A 73 73 GLU CB C 73 29.530 30.075 -0.545 1
1 846 . 11 1 1 A 73 73 GLU N N 73 120.550 119.056 1.494 1
1 847 . 11 1 1 A 74 74 PHE H H 74 8.630 8.682 -0.052 1
1 848 . 11 1 1 A 74 74 PHE HA H 74 4.020 4.023 -0.003 1
1 851 . 11 1 1 A 74 74 PHE C C 74 177.890 177.061 0.829 1
1 852 . 11 1 1 A 74 74 PHE CA C 74 60.090 61.379 -1.289 1
1 853 . 11 1 1 A 74 74 PHE CB C 74 38.020 39.092 -1.072 1
1 854 . 11 1 1 A 74 74 PHE N N 74 121.010 121.672 -0.662 1
1 855 . 11 1 1 A 75 75 VAL H H 75 8.080 8.604 -0.524 1
1 856 . 11 1 1 A 75 75 VAL HA H 75 2.860 3.517 -0.657 1
1 864 . 11 1 1 A 75 75 VAL C C 75 177.030 178.312 -1.282 1
1 865 . 11 1 1 A 75 75 VAL CA C 75 66.430 66.657 -0.227 1
1 866 . 11 1 1 A 75 75 VAL CB C 75 30.600 31.479 -0.879 1
1 869 . 11 1 1 A 75 75 VAL N N 75 119.460 119.187 0.273 1
1 870 . 11 1 1 A 76 76 VAL H H 76 7.100 8.224 -1.124 1
1 871 . 11 1 1 A 76 76 VAL HA H 76 3.330 3.572 -0.242 1
1 879 . 11 1 1 A 76 76 VAL C C 76 178.670 178.018 0.652 1
1 880 . 11 1 1 A 76 76 VAL CA C 76 67.000 66.865 0.135 1
1 881 . 11 1 1 A 76 76 VAL CB C 76 31.280 31.343 -0.063 1
1 884 . 11 1 1 A 76 76 VAL N N 76 121.030 120.172 0.858 1
1 885 . 11 1 1 A 77 77 LEU H H 77 6.900 7.880 -0.980 1
1 886 . 11 1 1 A 77 77 LEU HA H 77 3.800 4.025 -0.225 1
1 896 . 11 1 1 A 77 77 LEU C C 77 177.960 178.369 -0.409 1
1 897 . 11 1 1 A 77 77 LEU CA C 77 57.710 58.472 -0.762 1
1 898 . 11 1 1 A 77 77 LEU CB C 77 40.070 41.875 -1.805 1
1 902 . 11 1 1 A 77 77 LEU N N 77 120.310 120.559 -0.249 1
1 903 . 11 1 1 A 78 78 VAL H H 78 7.240 7.566 -0.326 1
1 904 . 11 1 1 A 78 78 VAL HA H 78 3.030 3.976 -0.946 1
1 912 . 11 1 1 A 78 78 VAL C C 78 179.600 178.070 1.530 1
1 913 . 11 1 1 A 78 78 VAL CA C 78 66.420 64.688 1.732 1
1 914 . 11 1 1 A 78 78 VAL CB C 78 30.700 31.376 -0.676 1
1 917 . 11 1 1 A 78 78 VAL N N 78 117.180 115.674 1.506 1
1 918 . 11 1 1 A 79 79 ALA H H 79 9.000 7.838 1.162 1
1 919 . 11 1 1 A 79 79 ALA HA H 79 3.610 4.149 -0.539 1
1 923 . 11 1 1 A 79 79 ALA C C 79 182.260 179.835 2.425 1
1 924 . 11 1 1 A 79 79 ALA CA C 79 55.580 55.303 0.277 1
1 925 . 11 1 1 A 79 79 ALA CB C 79 18.400 18.188 0.212 1
1 926 . 11 1 1 A 79 79 ALA N N 79 126.000 124.674 1.326 1
1 927 . 11 1 1 A 80 80 ALA H H 80 8.000 7.753 0.247 1
1 928 . 11 1 1 A 80 80 ALA HA H 80 4.100 4.228 -0.128 1
1 932 . 11 1 1 A 80 80 ALA C C 80 175.460 179.768 -4.308 1
1 933 . 11 1 1 A 80 80 ALA CA C 80 56.020 53.771 2.249 1
1 934 . 11 1 1 A 80 80 ALA CB C 80 18.040 18.947 -0.907 1
1 935 . 11 1 1 A 80 80 ALA N N 80 120.730 119.776 0.954 1
1 936 . 11 1 1 A 81 81 LEU H H 81 8.460 7.671 0.789 1
1 937 . 11 1 1 A 81 81 LEU HA H 81 4.000 4.047 -0.047 1
1 941 . 11 1 1 A 81 81 LEU C C 81 177.030 178.895 -1.865 1
1 942 . 11 1 1 A 81 81 LEU CA C 81 57.640 58.021 -0.381 1
1 943 . 11 1 1 A 81 81 LEU CB C 81 40.620 41.259 -0.639 1
1 945 . 11 1 1 A 81 81 LEU N N 81 119.890 117.808 2.082 1
1 946 . 11 1 1 A 82 82 THR H H 82 8.320 7.976 0.344 1
1 947 . 11 1 1 A 82 82 THR HA H 82 3.800 4.147 -0.347 1
1 952 . 11 1 1 A 82 82 THR C C 82 181.010 176.905 4.105 1
1 953 . 11 1 1 A 82 82 THR CA C 82 68.500 66.159 2.341 1
1 954 . 11 1 1 A 82 82 THR CB C 82 67.400 68.376 -0.976 1
1 956 . 11 1 1 A 82 82 THR N N 82 117.120 114.543 2.577 1
1 957 . 11 1 1 A 83 83 VAL H H 83 8.530 7.580 0.950 1
1 958 . 11 1 1 A 83 83 VAL HA H 83 3.890 3.814 0.076 1
1 966 . 11 1 1 A 83 83 VAL C C 83 178.120 178.243 -0.123 1
1 967 . 11 1 1 A 83 83 VAL CA C 83 67.400 65.191 2.209 1
1 968 . 11 1 1 A 83 83 VAL CB C 83 31.590 31.521 0.069 1
1 971 . 11 1 1 A 83 83 VAL N N 83 119.760 118.239 1.521 1
1 972 . 11 1 1 A 84 84 ALA H H 84 7.910 8.043 -0.133 1
1 973 . 11 1 1 A 84 84 ALA HA H 84 4.060 4.017 0.043 1
1 977 . 11 1 1 A 84 84 ALA C C 84 180.560 179.817 0.743 1
1 978 . 11 1 1 A 84 84 ALA CA C 84 55.000 55.342 -0.342 1
1 979 . 11 1 1 A 84 84 ALA CB C 84 17.230 18.267 -1.037 1
1 980 . 11 1 1 A 84 84 ALA N N 84 122.620 124.538 -1.918 1
1 981 . 11 1 1 A 85 85 CYS H H 85 8.580 7.967 0.613 1
1 982 . 11 1 1 A 85 85 CYS HA H 85 4.080 4.527 -0.447 1
1 985 . 11 1 1 A 85 85 CYS C C 85 179.060 177.116 1.944 1
1 986 . 11 1 1 A 85 85 CYS CA C 85 63.210 61.993 1.217 1
1 987 . 11 1 1 A 85 85 CYS CB C 85 26.310 27.489 -1.179 1
1 988 . 11 1 1 A 85 85 CYS N N 85 118.730 117.801 0.929 1
1 989 . 11 1 1 A 86 86 ASN H H 86 8.430 8.290 0.140 1
1 990 . 11 1 1 A 86 86 ASN CA C 86 55.860 56.610 -0.750 1
1 991 . 11 1 1 A 86 86 ASN CB C 86 37.440 39.828 -2.388 1
1 992 . 11 1 1 A 86 86 ASN N N 86 119.360 119.282 0.078 1
1 993 . 11 1 1 A 87 87 ASN H H 87 7.880 7.826 0.054 1
1 994 . 11 1 1 A 87 87 ASN HA H 87 4.600 4.424 0.176 1
1 997 . 11 1 1 A 87 87 ASN C C 87 178.510 177.527 0.983 1
1 998 . 11 1 1 A 87 87 ASN CA C 87 56.470 56.177 0.293 1
1 999 . 11 1 1 A 87 87 ASN CB C 87 37.500 39.036 -1.536 1
1 1000 . 11 1 1 A 87 87 ASN N N 87 119.480 117.710 1.770 1
1 1001 . 11 1 1 A 88 88 PHE H H 88 8.050 7.453 0.597 1
1 1002 . 11 1 1 A 88 88 PHE HA H 88 4.200 4.555 -0.355 1
1 1005 . 11 1 1 A 88 88 PHE C C 88 178.510 177.812 0.698 1
1 1006 . 11 1 1 A 88 88 PHE CA C 88 56.460 59.070 -2.610 1
1 1007 . 11 1 1 A 88 88 PHE CB C 88 38.500 38.486 0.014 1
1 1008 . 11 1 1 A 88 88 PHE N N 88 120.280 116.586 3.694 1
1 1009 . 11 1 1 A 89 89 PHE H H 89 8.020 8.382 -0.362 1
1 1010 . 11 1 1 A 89 89 PHE HA H 89 4.000 4.253 -0.253 1
1 1013 . 11 1 1 A 89 89 PHE C C 89 177.340 178.325 -0.985 1
1 1014 . 11 1 1 A 89 89 PHE CA C 89 59.000 61.625 -2.625 1
1 1015 . 11 1 1 A 89 89 PHE CB C 89 37.430 39.010 -1.580 1
1 1016 . 11 1 1 A 89 89 PHE N N 89 120.910 120.088 0.822 1
1 1017 . 11 1 1 A 90 90 TRP H H 90 7.800 7.767 0.033 1
1 1018 . 11 1 1 A 90 90 TRP HA H 90 4.460 4.446 0.014 1
1 1021 . 11 1 1 A 90 90 TRP C C 90 177.340 177.944 -0.604 1
1 1022 . 11 1 1 A 90 90 TRP CA C 90 57.930 59.017 -1.087 1
1 1023 . 11 1 1 A 90 90 TRP CB C 90 42.000 30.048 11.952 1
1 1024 . 11 1 1 A 90 90 TRP N N 90 120.050 120.607 -0.557 1
1 1025 . 11 1 1 A 91 91 GLU H H 91 7.800 8.968 -1.168 1
1 1026 . 11 1 1 A 91 91 GLU HA H 91 4.050 4.054 -0.004 1
1 1031 . 11 1 1 A 91 91 GLU C C 91 177.570 177.441 0.129 1
1 1032 . 11 1 1 A 91 91 GLU CA C 91 57.350 59.085 -1.735 1
1 1033 . 11 1 1 A 91 91 GLU CB C 91 29.530 29.187 0.343 1
1 1035 . 11 1 1 A 91 91 GLU N N 91 120.730 118.127 2.603 1
1 1036 . 11 1 1 A 92 92 ASN H H 92 7.800 7.872 -0.072 1
1 1037 . 11 1 1 A 92 92 ASN HA H 92 4.630 4.741 -0.111 1
1 1040 . 11 1 1 A 92 92 ASN C C 92 174.450 174.238 0.212 1
1 1041 . 11 1 1 A 92 92 ASN CA C 92 52.960 52.690 0.270 1
1 1042 . 11 1 1 A 92 92 ASN CB C 92 29.530 38.572 -9.042 1
1 1043 . 11 1 1 A 92 92 ASN N N 92 119.410 117.372 2.038 1
1 5 . 12 1 1 A 2 2 SER H H 2 9.000 8.761 0.239 1
1 6 . 12 1 1 A 2 2 SER HA H 2 4.690 4.746 -0.056 1
1 9 . 12 1 1 A 2 2 SER C C 2 176.170 174.715 1.455 1
1 10 . 12 1 1 A 2 2 SER CA C 2 57.340 58.103 -0.763 1
1 11 . 12 1 1 A 2 2 SER CB C 2 65.550 63.151 2.399 1
1 12 . 12 1 1 A 2 2 SER N N 2 119.330 115.533 3.797 1
1 13 . 12 1 1 A 3 3 GLU H H 3 9.350 8.144 1.206 1
1 14 . 12 1 1 A 3 3 GLU HA H 3 4.060 4.108 -0.048 1
1 17 . 12 1 1 A 3 3 GLU C C 3 180.150 179.038 1.112 1
1 18 . 12 1 1 A 3 3 GLU CA C 3 60.280 58.993 1.287 1
1 19 . 12 1 1 A 3 3 GLU CB C 3 29.230 29.318 -0.088 1
1 21 . 12 1 1 A 3 3 GLU N N 3 125.350 122.160 3.190 1
1 22 . 12 1 1 A 4 4 LEU H H 4 9.060 8.173 0.887 1
1 23 . 12 1 1 A 4 4 LEU HA H 4 4.080 4.093 -0.013 1
1 33 . 12 1 1 A 4 4 LEU C C 4 177.890 178.350 -0.460 1
1 34 . 12 1 1 A 4 4 LEU CA C 4 58.090 57.863 0.227 1
1 35 . 12 1 1 A 4 4 LEU CB C 4 42.120 41.672 0.448 1
1 39 . 12 1 1 A 4 4 LEU N N 4 121.090 121.077 0.013 1
1 40 . 12 1 1 A 5 5 GLU H H 5 8.340 8.312 0.028 1
1 41 . 12 1 1 A 5 5 GLU HA H 5 4.050 3.925 0.125 1
1 46 . 12 1 1 A 5 5 GLU C C 5 177.030 178.911 -1.881 1
1 47 . 12 1 1 A 5 5 GLU CA C 5 59.840 59.650 0.190 1
1 48 . 12 1 1 A 5 5 GLU CB C 5 28.940 29.418 -0.478 1
1 50 . 12 1 1 A 5 5 GLU N N 5 119.780 118.812 0.968 1
1 51 . 12 1 1 A 6 6 THR H H 6 8.370 7.965 0.405 1
1 52 . 12 1 1 A 6 6 THR HA H 6 4.310 3.900 0.410 1
1 57 . 12 1 1 A 6 6 THR C C 6 177.340 177.072 0.268 1
1 58 . 12 1 1 A 6 6 THR CA C 6 66.630 66.041 0.589 1
1 59 . 12 1 1 A 6 6 THR CB C 6 68.650 68.612 0.038 1
1 61 . 12 1 1 A 6 6 THR N N 6 116.940 116.125 0.815 1
1 62 . 12 1 1 A 7 7 ALA H H 7 8.270 7.644 0.626 1
1 63 . 12 1 1 A 7 7 ALA HA H 7 4.190 4.380 -0.190 1
1 67 . 12 1 1 A 7 7 ALA C C 7 179.760 179.313 0.447 1
1 68 . 12 1 1 A 7 7 ALA CA C 7 55.880 55.078 0.802 1
1 69 . 12 1 1 A 7 7 ALA CB C 7 17.720 18.018 -0.298 1
1 70 . 12 1 1 A 7 7 ALA N N 7 127.400 123.914 3.486 1
1 71 . 12 1 1 A 8 8 MET H H 8 8.110 7.757 0.353 1
1 72 . 12 1 1 A 8 8 MET HA H 8 4.020 4.239 -0.219 1
1 80 . 12 1 1 A 8 8 MET C C 8 178.510 178.165 0.345 1
1 81 . 12 1 1 A 8 8 MET CA C 8 60.580 58.223 2.357 1
1 82 . 12 1 1 A 8 8 MET CB C 8 33.630 32.251 1.379 1
1 85 . 12 1 1 A 8 8 MET N N 8 117.520 118.403 -0.883 1
1 86 . 12 1 1 A 9 9 GLU H H 9 8.210 7.608 0.602 1
1 87 . 12 1 1 A 9 9 GLU HA H 9 3.830 4.143 -0.313 1
1 92 . 12 1 1 A 9 9 GLU C C 9 179.140 179.116 0.024 1
1 93 . 12 1 1 A 9 9 GLU CA C 9 59.690 59.279 0.411 1
1 94 . 12 1 1 A 9 9 GLU CB C 9 29.530 29.270 0.260 1
1 96 . 12 1 1 A 9 9 GLU N N 9 118.560 118.169 0.391 1
1 97 . 12 1 1 A 10 10 THR H H 10 8.490 7.592 0.898 1
1 98 . 12 1 1 A 10 10 THR HA H 10 4.000 3.995 0.005 1
1 103 . 12 1 1 A 10 10 THR C C 10 176.010 176.856 -0.846 1
1 104 . 12 1 1 A 10 10 THR CA C 10 67.110 66.105 1.005 1
1 105 . 12 1 1 A 10 10 THR CB C 10 67.770 68.491 -0.721 1
1 107 . 12 1 1 A 10 10 THR N N 10 118.310 115.136 3.174 1
1 108 . 12 1 1 A 11 11 LEU H H 11 7.920 7.855 0.065 1
1 109 . 12 1 1 A 11 11 LEU HA H 11 3.930 4.020 -0.090 1
1 119 . 12 1 1 A 11 11 LEU C C 11 178.820 179.136 -0.316 1
1 120 . 12 1 1 A 11 11 LEU CA C 11 59.690 58.270 1.420 1
1 121 . 12 1 1 A 11 11 LEU CB C 11 41.920 41.439 0.481 1
1 125 . 12 1 1 A 11 11 LEU N N 11 121.150 122.181 -1.031 1
1 126 . 12 1 1 A 12 12 ILE H H 12 7.440 7.771 -0.331 1
1 127 . 12 1 1 A 12 12 ILE HA H 12 3.640 3.155 0.485 1
1 137 . 12 1 1 A 12 12 ILE C C 12 179.530 178.633 0.897 1
1 138 . 12 1 1 A 12 12 ILE CA C 12 63.740 65.004 -1.264 1
1 139 . 12 1 1 A 12 12 ILE CB C 12 38.800 37.548 1.252 1
1 143 . 12 1 1 A 12 12 ILE N N 12 118.010 119.971 -1.961 1
1 144 . 12 1 1 A 13 13 ASN H H 13 8.930 8.117 0.813 1
1 145 . 12 1 1 A 13 13 ASN HA H 13 4.520 4.538 -0.018 1
1 148 . 12 1 1 A 13 13 ASN C C 13 179.450 177.349 2.101 1
1 149 . 12 1 1 A 13 13 ASN CA C 13 56.470 56.478 -0.008 1
1 150 . 12 1 1 A 13 13 ASN CB C 13 37.930 38.795 -0.865 1
1 151 . 12 1 1 A 13 13 ASN N N 13 121.820 119.842 1.978 1
1 152 . 12 1 1 A 14 14 VAL H H 14 9.180 8.151 1.029 1
1 153 . 12 1 1 A 14 14 VAL HA H 14 3.830 3.779 0.051 1
1 161 . 12 1 1 A 14 14 VAL CA C 14 65.840 65.324 0.516 1
1 162 . 12 1 1 A 14 14 VAL CB C 14 31.290 31.299 -0.009 1
1 165 . 12 1 1 A 14 14 VAL N N 14 122.040 118.968 3.072 1
1 166 . 12 1 1 A 15 15 PHE H H 15 7.590 8.078 -0.488 1
1 167 . 12 1 1 A 15 15 PHE HA H 15 3.360 4.239 -0.879 1
1 170 . 12 1 1 A 15 15 PHE C C 15 177.890 177.459 0.431 1
1 171 . 12 1 1 A 15 15 PHE CA C 15 62.030 61.984 0.046 1
1 172 . 12 1 1 A 15 15 PHE CB C 15 38.900 39.018 -0.118 1
1 173 . 12 1 1 A 15 15 PHE N N 15 118.290 122.095 -3.805 1
1 174 . 12 1 1 A 16 16 HIS H H 16 7.790 7.951 -0.161 1
1 175 . 12 1 1 A 16 16 HIS HA H 16 4.890 4.174 0.716 1
1 178 . 12 1 1 A 16 16 HIS C C 16 177.810 177.479 0.331 1
1 179 . 12 1 1 A 16 16 HIS CA C 16 59.100 59.672 -0.572 1
1 180 . 12 1 1 A 16 16 HIS CB C 16 28.060 29.714 -1.654 1
1 181 . 12 1 1 A 16 16 HIS N N 16 118.290 117.791 0.499 1
1 182 . 12 1 1 A 17 17 ALA H H 17 8.040 8.063 -0.023 1
1 183 . 12 1 1 A 17 17 ALA HA H 17 4.050 3.886 0.164 1
1 187 . 12 1 1 A 17 17 ALA C C 17 179.600 179.232 0.368 1
1 188 . 12 1 1 A 17 17 ALA CA C 17 54.000 55.232 -1.232 1
1 189 . 12 1 1 A 17 17 ALA CB C 17 17.520 18.637 -1.117 1
1 190 . 12 1 1 A 17 17 ALA N N 17 124.410 121.093 3.317 1
1 191 . 12 1 1 A 18 18 HIS H H 18 7.000 7.843 -0.843 1
1 192 . 12 1 1 A 18 18 HIS HA H 18 4.330 4.254 0.076 1
1 195 . 12 1 1 A 18 18 HIS C C 18 176.320 177.662 -1.342 1
1 196 . 12 1 1 A 18 18 HIS CA C 18 57.350 57.919 -0.569 1
1 197 . 12 1 1 A 18 18 HIS CB C 18 32.920 29.193 3.727 1
1 198 . 12 1 1 A 18 18 HIS N N 18 115.160 115.617 -0.457 1
1 199 . 12 1 1 A 19 19 SER H H 19 8.380 7.174 1.206 1
1 200 . 12 1 1 A 19 19 SER HA H 19 3.640 3.614 0.026 1
1 203 . 12 1 1 A 19 19 SER C C 19 177.340 175.707 1.633 1
1 204 . 12 1 1 A 19 19 SER CA C 19 60.160 62.276 -2.116 1
1 205 . 12 1 1 A 19 19 SER CB C 19 61.000 62.032 -1.032 1
1 206 . 12 1 1 A 19 19 SER N N 19 114.380 115.388 -1.008 1
1 207 . 12 1 1 A 20 20 GLY H H 20 7.600 7.303 0.297 1
1 208 . 12 1 1 A 20 20 GLY HA2 H 20 3.680 3.775 -0.095 1
1 209 . 12 1 1 A 20 20 GLY HA3 H 20 4.000 3.893 0.107 1
1 210 . 12 1 1 A 20 20 GLY C C 20 174.140 174.303 -0.163 1
1 211 . 12 1 1 A 20 20 GLY CA C 20 47.000 45.055 1.945 1
1 212 . 12 1 1 A 20 20 GLY N N 20 112.550 107.623 4.927 1
1 213 . 12 1 1 A 21 21 LYS H H 21 7.230 7.504 -0.274 1
1 214 . 12 1 1 A 21 21 LYS HA H 21 3.860 4.348 -0.488 1
1 223 . 12 1 1 A 21 21 LYS C C 21 177.730 176.066 1.664 1
1 224 . 12 1 1 A 21 21 LYS CA C 21 59.110 57.139 1.971 1
1 225 . 12 1 1 A 21 21 LYS CB C 21 32.460 33.887 -1.427 1
1 229 . 12 1 1 A 21 21 LYS N N 21 123.240 118.387 4.853 1
1 230 . 12 1 1 A 22 22 GLU H H 22 9.350 8.287 1.063 1
1 231 . 12 1 1 A 22 22 GLU HA H 22 4.610 4.328 0.282 1
1 236 . 12 1 1 A 22 22 GLU C C 22 177.420 176.349 1.071 1
1 237 . 12 1 1 A 22 22 GLU CA C 22 53.700 56.306 -2.606 1
1 238 . 12 1 1 A 22 22 GLU CB C 22 32.000 27.936 4.064 1
1 240 . 12 1 1 A 22 22 GLU N N 22 116.770 118.894 -2.124 1
1 241 . 12 1 1 A 23 23 GLY H H 23 7.570 7.895 -0.325 1
1 242 . 12 1 1 A 23 23 GLY HA2 H 23 3.630 4.092 -0.462 1
1 243 . 12 1 1 A 23 23 GLY HA3 H 23 3.880 4.128 -0.248 1
1 244 . 12 1 1 A 23 23 GLY C C 23 173.980 171.501 2.479 1
1 245 . 12 1 1 A 23 23 GLY CA C 23 45.250 45.057 0.193 1
1 246 . 12 1 1 A 23 23 GLY N N 23 112.180 110.915 1.265 1
1 247 . 12 1 1 A 24 24 ASP H H 24 8.680 8.334 0.346 1
1 248 . 12 1 1 A 24 24 ASP HA H 24 4.380 4.642 -0.262 1
1 251 . 12 1 1 A 24 24 ASP C C 24 178.590 177.929 0.661 1
1 252 . 12 1 1 A 24 24 ASP CA C 24 60.000 53.956 6.044 1
1 253 . 12 1 1 A 24 24 ASP CB C 24 27.480 41.658 -14.178 1
1 254 . 12 1 1 A 24 24 ASP N N 24 127.470 122.223 5.247 1
1 255 . 12 1 1 A 25 25 LYS H H 25 9.270 8.679 0.591 1
1 256 . 12 1 1 A 25 25 LYS HA H 25 4.250 3.963 0.287 1
1 265 . 12 1 1 A 25 25 LYS C C 25 177.030 177.159 -0.129 1
1 266 . 12 1 1 A 25 25 LYS CA C 25 60.000 59.961 0.039 1
1 267 . 12 1 1 A 25 25 LYS CB C 25 31.170 32.524 -1.354 1
1 271 . 12 1 1 A 25 25 LYS N N 25 132.960 122.866 10.094 1
1 272 . 12 1 1 A 26 26 TYR H H 26 9.430 7.838 1.592 1
1 273 . 12 1 1 A 26 26 TYR HA H 26 4.640 4.867 -0.227 1
1 276 . 12 1 1 A 26 26 TYR C C 26 174.290 174.352 -0.062 1
1 277 . 12 1 1 A 26 26 TYR CA C 26 56.010 56.819 -0.809 1
1 278 . 12 1 1 A 26 26 TYR CB C 26 37.730 39.373 -1.643 1
1 279 . 12 1 1 A 26 26 TYR N N 26 120.650 117.673 2.977 1
1 280 . 12 1 1 A 27 27 LYS H H 27 7.110 7.309 -0.199 1
1 281 . 12 1 1 A 27 27 LYS HA H 27 5.110 4.968 0.142 1
1 290 . 12 1 1 A 27 27 LYS C C 27 175.150 173.979 1.171 1
1 291 . 12 1 1 A 27 27 LYS CA C 27 55.070 55.132 -0.062 1
1 292 . 12 1 1 A 27 27 LYS CB C 27 38.900 36.106 2.794 1
1 296 . 12 1 1 A 27 27 LYS N N 27 115.830 123.820 -7.990 1
1 297 . 12 1 1 A 28 28 LEU H H 28 9.820 8.668 1.152 1
1 298 . 12 1 1 A 28 28 LEU HA H 28 5.080 4.781 0.299 1
1 308 . 12 1 1 A 28 28 LEU C C 28 176.640 175.736 0.904 1
1 309 . 12 1 1 A 28 28 LEU CA C 28 52.660 53.795 -1.135 1
1 310 . 12 1 1 A 28 28 LEU CB C 28 42.710 44.167 -1.457 1
1 314 . 12 1 1 A 28 28 LEU N N 28 126.930 127.883 -0.953 1
1 315 . 12 1 1 A 29 29 SER H H 29 9.890 8.709 1.181 1
1 316 . 12 1 1 A 29 29 SER HA H 29 4.530 4.964 -0.434 1
1 319 . 12 1 1 A 29 29 SER C C 29 174.990 174.825 0.165 1
1 320 . 12 1 1 A 29 29 SER CA C 29 56.180 57.205 -1.025 1
1 321 . 12 1 1 A 29 29 SER CB C 29 65.550 66.879 -1.329 1
1 322 . 12 1 1 A 29 29 SER N N 29 121.600 121.448 0.152 1
1 323 . 12 1 1 A 30 30 LYS H H 30 8.850 8.890 -0.040 1
1 324 . 12 1 1 A 30 30 LYS HA H 30 3.850 4.005 -0.155 1
1 333 . 12 1 1 A 30 30 LYS C C 30 175.620 177.469 -1.849 1
1 334 . 12 1 1 A 30 30 LYS CA C 30 60.860 59.985 0.875 1
1 335 . 12 1 1 A 30 30 LYS CB C 30 31.290 32.190 -0.900 1
1 339 . 12 1 1 A 30 30 LYS N N 30 121.260 124.700 -3.440 1
1 340 . 12 1 1 A 31 31 LYS H H 31 7.970 7.893 0.077 1
1 341 . 12 1 1 A 31 31 LYS HA H 31 3.880 4.084 -0.204 1
1 350 . 12 1 1 A 31 31 LYS C C 31 179.290 179.369 -0.079 1
1 351 . 12 1 1 A 31 31 LYS CA C 31 59.110 59.325 -0.215 1
1 352 . 12 1 1 A 31 31 LYS CB C 31 32.640 32.094 0.546 1
1 356 . 12 1 1 A 31 31 LYS N N 31 121.260 118.862 2.398 1
1 357 . 12 1 1 A 32 32 GLU H H 32 7.510 8.042 -0.532 1
1 358 . 12 1 1 A 32 32 GLU HA H 32 3.830 4.146 -0.316 1
1 363 . 12 1 1 A 32 32 GLU C C 32 179.290 179.703 -0.413 1
1 364 . 12 1 1 A 32 32 GLU CA C 32 58.590 59.081 -0.491 1
1 365 . 12 1 1 A 32 32 GLU CB C 32 30.120 29.744 0.376 1
1 367 . 12 1 1 A 32 32 GLU N N 32 120.090 120.139 -0.049 1
1 368 . 12 1 1 A 33 33 LEU H H 33 8.970 8.117 0.853 1
1 369 . 12 1 1 A 33 33 LEU HA H 33 3.830 4.031 -0.201 1
1 379 . 12 1 1 A 33 33 LEU C C 33 178.200 178.820 -0.620 1
1 380 . 12 1 1 A 33 33 LEU CA C 33 57.930 58.361 -0.431 1
1 381 . 12 1 1 A 33 33 LEU CB C 33 40.660 41.714 -1.054 1
1 385 . 12 1 1 A 33 33 LEU N N 33 120.200 119.367 0.833 1
1 386 . 12 1 1 A 34 34 LYS H H 34 8.230 7.831 0.399 1
1 387 . 12 1 1 A 34 34 LYS HA H 34 3.550 3.874 -0.324 1
1 396 . 12 1 1 A 34 34 LYS C C 34 178.040 178.212 -0.172 1
1 397 . 12 1 1 A 34 34 LYS CA C 34 60.720 60.134 0.586 1
1 398 . 12 1 1 A 34 34 LYS CB C 34 31.980 32.078 -0.098 1
1 402 . 12 1 1 A 34 34 LYS N N 34 120.780 119.345 1.435 1
1 403 . 12 1 1 A 35 35 ASP H H 35 7.990 7.913 0.077 1
1 404 . 12 1 1 A 35 35 ASP HA H 35 4.250 4.334 -0.084 1
1 407 . 12 1 1 A 35 35 ASP C C 35 179.060 178.136 0.924 1
1 408 . 12 1 1 A 35 35 ASP CA C 35 56.830 57.583 -0.753 1
1 409 . 12 1 1 A 35 35 ASP CB C 35 40.440 41.605 -1.165 1
1 410 . 12 1 1 A 35 35 ASP N N 35 119.550 119.430 0.120 1
1 411 . 12 1 1 A 36 36 LEU H H 36 8.130 7.535 0.595 1
1 412 . 12 1 1 A 36 36 LEU HA H 36 2.580 3.666 -1.086 1
1 422 . 12 1 1 A 36 36 LEU C C 36 179.450 178.141 1.309 1
1 423 . 12 1 1 A 36 36 LEU CA C 36 59.980 58.017 1.963 1
1 424 . 12 1 1 A 36 36 LEU CB C 36 42.180 41.014 1.166 1
1 428 . 12 1 1 A 36 36 LEU N N 36 125.560 120.434 5.126 1
1 429 . 12 1 1 A 37 37 LEU H H 37 8.740 7.723 1.017 1
1 430 . 12 1 1 A 37 37 LEU HA H 37 3.580 3.796 -0.216 1
1 440 . 12 1 1 A 37 37 LEU C C 37 179.290 180.261 -0.971 1
1 441 . 12 1 1 A 37 37 LEU CA C 37 58.230 57.999 0.231 1
1 442 . 12 1 1 A 37 37 LEU CB C 37 41.590 40.527 1.063 1
1 446 . 12 1 1 A 37 37 LEU N N 37 120.520 118.366 2.154 1
1 447 . 12 1 1 A 38 38 GLN H H 38 8.520 8.026 0.494 1
1 448 . 12 1 1 A 38 38 GLN HA H 38 4.000 4.076 -0.076 1
1 453 . 12 1 1 A 38 38 GLN C C 38 177.960 177.959 0.001 1
1 454 . 12 1 1 A 38 38 GLN CA C 38 58.210 58.024 0.186 1
1 455 . 12 1 1 A 38 38 GLN CB C 38 28.650 27.524 1.126 1
1 457 . 12 1 1 A 38 38 GLN N N 38 116.740 118.551 -1.811 1
1 458 . 12 1 1 A 39 39 THR H H 39 7.910 7.474 0.436 1
1 459 . 12 1 1 A 39 39 THR HA H 39 4.210 3.782 0.428 1
1 464 . 12 1 1 A 39 39 THR C C 39 177.180 175.702 1.478 1
1 465 . 12 1 1 A 39 39 THR CA C 39 64.730 67.236 -2.506 1
1 466 . 12 1 1 A 39 39 THR CB C 39 69.650 68.532 1.118 1
1 468 . 12 1 1 A 39 39 THR N N 39 111.400 117.185 -5.785 1
1 469 . 12 1 1 A 40 40 GLU H H 40 8.590 8.072 0.518 1
1 470 . 12 1 1 A 40 40 GLU HA H 40 4.680 4.511 0.169 1
1 475 . 12 1 1 A 40 40 GLU C C 40 178.280 177.715 0.565 1
1 476 . 12 1 1 A 40 40 GLU CA C 40 55.880 57.122 -1.242 1
1 477 . 12 1 1 A 40 40 GLU CB C 40 30.990 30.905 0.085 1
1 479 . 12 1 1 A 40 40 GLU N N 40 117.840 117.201 0.639 1
1 480 . 12 1 1 A 41 41 LEU H H 41 7.680 7.642 0.038 1
1 481 . 12 1 1 A 41 41 LEU HA H 41 5.080 4.779 0.301 1
1 491 . 12 1 1 A 41 41 LEU C C 41 179.450 176.875 2.575 1
1 492 . 12 1 1 A 41 41 LEU CA C 41 53.830 54.257 -0.427 1
1 493 . 12 1 1 A 41 41 LEU CB C 41 41.360 42.248 -0.888 1
1 497 . 12 1 1 A 41 41 LEU N N 41 121.410 118.596 2.814 1
1 498 . 12 1 1 A 42 42 SER H H 42 8.380 7.958 0.422 1
1 499 . 12 1 1 A 42 42 SER HA H 42 4.130 4.135 -0.005 1
1 502 . 12 1 1 A 42 42 SER C C 42 176.640 176.823 -0.183 1
1 503 . 12 1 1 A 42 42 SER CA C 42 61.280 61.665 -0.385 1
1 504 . 12 1 1 A 42 42 SER CB C 42 63.040 62.917 0.123 1
1 505 . 12 1 1 A 42 42 SER N N 42 117.420 117.509 -0.089 1
1 506 . 12 1 1 A 43 43 SER H H 43 8.900 8.019 0.881 1
1 507 . 12 1 1 A 43 43 SER HA H 43 4.290 4.341 -0.051 1
1 510 . 12 1 1 A 43 43 SER C C 43 175.620 177.070 -1.450 1
1 511 . 12 1 1 A 43 43 SER CA C 43 60.860 60.558 0.302 1
1 512 . 12 1 1 A 43 43 SER CB C 43 62.910 63.104 -0.194 1
1 513 . 12 1 1 A 43 43 SER N N 43 117.580 115.548 2.032 1
1 514 . 12 1 1 A 44 44 PHE H H 44 7.880 8.028 -0.148 1
1 515 . 12 1 1 A 44 44 PHE HA H 44 4.240 4.227 0.013 1
1 518 . 12 1 1 A 44 44 PHE C C 44 176.950 175.566 1.384 1
1 519 . 12 1 1 A 44 44 PHE CA C 44 62.710 61.086 1.624 1
1 520 . 12 1 1 A 44 44 PHE CB C 44 39.020 39.130 -0.110 1
1 521 . 12 1 1 A 44 44 PHE N N 44 119.480 122.525 -3.045 1
1 522 . 12 1 1 A 45 45 LEU H H 45 8.060 7.518 0.542 1
1 523 . 12 1 1 A 45 45 LEU HA H 45 3.810 3.431 0.379 1
1 533 . 12 1 1 A 45 45 LEU C C 45 177.500 175.817 1.683 1
1 534 . 12 1 1 A 45 45 LEU CA C 45 59.980 55.270 4.710 1
1 535 . 12 1 1 A 45 45 LEU CB C 45 39.640 42.506 -2.866 1
1 538 . 12 1 1 A 45 45 LEU N N 45 118.010 120.654 -2.644 1
1 539 . 12 1 1 A 46 46 ASP H H 46 8.150 8.510 -0.360 1
1 540 . 12 1 1 A 46 46 ASP HA H 46 4.470 4.670 -0.200 1
1 543 . 12 1 1 A 46 46 ASP C C 46 179.920 176.100 3.820 1
1 544 . 12 1 1 A 46 46 ASP CA C 46 52.950 52.877 0.073 1
1 545 . 12 1 1 A 46 46 ASP CB C 46 40.000 40.656 -0.656 1
1 546 . 12 1 1 A 46 46 ASP N N 46 119.460 125.152 -5.692 1
1 547 . 12 1 1 A 47 47 VAL H H 47 8.010 8.481 -0.471 1
1 548 . 12 1 1 A 47 47 VAL HA H 47 3.800 4.372 -0.572 1
1 556 . 12 1 1 A 47 47 VAL C C 47 175.460 176.744 -1.284 1
1 557 . 12 1 1 A 47 47 VAL CA C 47 60.000 62.581 -2.581 1
1 558 . 12 1 1 A 47 47 VAL CB C 47 31.580 33.191 -1.611 1
1 561 . 12 1 1 A 47 47 VAL N N 47 117.720 121.259 -3.539 1
1 562 . 12 1 1 A 48 48 GLN H H 48 7.960 8.312 -0.352 1
1 563 . 12 1 1 A 48 48 GLN HA H 48 4.060 4.060 0.000 1
1 568 . 12 1 1 A 48 48 GLN C C 48 179.370 178.061 1.309 1
1 569 . 12 1 1 A 48 48 GLN CA C 48 57.350 58.535 -1.185 1
1 570 . 12 1 1 A 48 48 GLN CB C 48 28.990 28.416 0.574 1
1 572 . 12 1 1 A 48 48 GLN N N 48 119.900 120.718 -0.818 1
1 573 . 12 1 1 A 49 49 LYS H H 49 7.810 8.483 -0.673 1
1 574 . 12 1 1 A 49 49 LYS HA H 49 3.860 4.154 -0.294 1
1 583 . 12 1 1 A 49 49 LYS C C 49 177.890 176.194 1.696 1
1 584 . 12 1 1 A 49 49 LYS CA C 49 58.230 58.555 -0.325 1
1 585 . 12 1 1 A 49 49 LYS CB C 49 30.990 31.678 -0.688 1
1 587 . 12 1 1 A 49 49 LYS N N 49 120.030 118.157 1.873 1
1 588 . 12 1 1 A 50 50 ASP H H 50 7.570 7.999 -0.429 1
1 589 . 12 1 1 A 50 50 ASP HA H 50 4.700 4.884 -0.184 1
1 590 . 12 1 1 A 50 50 ASP CA C 50 52.950 53.118 -0.168 1
1 591 . 12 1 1 A 50 50 ASP CB C 50 38.900 41.527 -2.627 1
1 592 . 12 1 1 A 50 50 ASP N N 50 116.730 120.265 -3.535 1
1 593 . 12 1 1 A 51 51 ALA H H 51 7.570 8.792 -1.222 1
1 594 . 12 1 1 A 51 51 ALA HA H 51 4.200 4.128 0.072 1
1 598 . 12 1 1 A 51 51 ALA C C 51 179.760 179.351 0.409 1
1 599 . 12 1 1 A 51 51 ALA CA C 51 54.200 55.371 -1.171 1
1 600 . 12 1 1 A 51 51 ALA CB C 51 18.110 18.436 -0.326 1
1 601 . 12 1 1 A 51 51 ALA N N 51 118.390 127.833 -9.443 1
1 602 . 12 1 1 A 52 52 ASP H H 52 8.430 8.380 0.050 1
1 603 . 12 1 1 A 52 52 ASP HA H 52 4.600 4.358 0.242 1
1 606 . 12 1 1 A 52 52 ASP C C 52 177.570 178.560 -0.990 1
1 607 . 12 1 1 A 52 52 ASP CA C 52 54.420 56.778 -2.358 1
1 608 . 12 1 1 A 52 52 ASP CB C 52 40.360 40.107 0.253 1
1 609 . 12 1 1 A 52 52 ASP N N 52 117.530 119.488 -1.958 1
1 610 . 12 1 1 A 53 53 ALA H H 53 7.660 7.762 -0.102 1
1 611 . 12 1 1 A 53 53 ALA HA H 53 3.860 4.002 -0.142 1
1 615 . 12 1 1 A 53 53 ALA C C 53 180.070 180.741 -0.671 1
1 616 . 12 1 1 A 53 53 ALA CA C 53 55.590 55.401 0.189 1
1 617 . 12 1 1 A 53 53 ALA CB C 53 18.800 18.120 0.680 1
1 618 . 12 1 1 A 53 53 ALA N N 53 123.450 122.536 0.914 1
1 619 . 12 1 1 A 54 54 VAL H H 54 8.030 8.044 -0.014 1
1 620 . 12 1 1 A 54 54 VAL HA H 54 3.240 3.617 -0.377 1
1 628 . 12 1 1 A 54 54 VAL C C 54 177.340 177.815 -0.475 1
1 629 . 12 1 1 A 54 54 VAL CA C 54 66.620 66.355 0.265 1
1 630 . 12 1 1 A 54 54 VAL CB C 54 30.480 31.254 -0.774 1
1 633 . 12 1 1 A 54 54 VAL N N 54 116.150 117.950 -1.800 1
1 634 . 12 1 1 A 55 55 ASP H H 55 7.660 7.861 -0.201 1
1 635 . 12 1 1 A 55 55 ASP HA H 55 4.080 4.375 -0.295 1
1 638 . 12 1 1 A 55 55 ASP C C 55 177.260 179.340 -2.080 1
1 639 . 12 1 1 A 55 55 ASP CA C 55 57.640 57.351 0.289 1
1 640 . 12 1 1 A 55 55 ASP CB C 55 40.360 39.947 0.413 1
1 641 . 12 1 1 A 55 55 ASP N N 55 120.830 122.407 -1.577 1
1 642 . 12 1 1 A 56 56 LYS H H 56 7.780 7.560 0.220 1
1 643 . 12 1 1 A 56 56 LYS HA H 56 3.860 4.031 -0.171 1
1 652 . 12 1 1 A 56 56 LYS C C 56 179.530 179.335 0.195 1
1 653 . 12 1 1 A 56 56 LYS CA C 56 59.690 59.775 -0.085 1
1 654 . 12 1 1 A 56 56 LYS CB C 56 31.870 32.442 -0.572 1
1 658 . 12 1 1 A 56 56 LYS N N 56 120.010 119.317 0.693 1
1 659 . 12 1 1 A 57 57 ILE H H 57 8.090 7.745 0.345 1
1 660 . 12 1 1 A 57 57 ILE HA H 57 3.390 3.600 -0.210 1
1 670 . 12 1 1 A 57 57 ILE C C 57 176.710 177.549 -0.839 1
1 671 . 12 1 1 A 57 57 ILE CA C 57 64.960 65.204 -0.244 1
1 672 . 12 1 1 A 57 57 ILE CB C 57 38.080 38.222 -0.142 1
1 676 . 12 1 1 A 57 57 ILE N N 57 120.960 120.335 0.625 1
1 677 . 12 1 1 A 58 58 MET H H 58 8.480 8.402 0.078 1
1 678 . 12 1 1 A 58 58 MET HA H 58 3.800 4.015 -0.215 1
1 686 . 12 1 1 A 58 58 MET C C 58 177.570 177.922 -0.352 1
1 687 . 12 1 1 A 58 58 MET CA C 58 58.570 58.490 0.080 1
1 688 . 12 1 1 A 58 58 MET CB C 58 32.570 31.679 0.891 1
1 691 . 12 1 1 A 58 58 MET N N 58 119.160 120.455 -1.295 1
1 692 . 12 1 1 A 59 59 LYS H H 59 7.550 7.884 -0.334 1
1 693 . 12 1 1 A 59 59 LYS HA H 59 3.930 3.954 -0.024 1
1 702 . 12 1 1 A 59 59 LYS C C 59 179.530 179.238 0.292 1
1 703 . 12 1 1 A 59 59 LYS CA C 59 58.820 59.576 -0.756 1
1 704 . 12 1 1 A 59 59 LYS CB C 59 32.450 32.511 -0.061 1
1 708 . 12 1 1 A 59 59 LYS N N 59 116.730 119.782 -3.052 1
1 709 . 12 1 1 A 60 60 GLU H H 60 7.470 7.638 -0.168 1
1 710 . 12 1 1 A 60 60 GLU HA H 60 4.050 4.050 0.000 1
1 715 . 12 1 1 A 60 60 GLU C C 60 178.950 178.068 0.882 1
1 716 . 12 1 1 A 60 60 GLU CA C 60 58.600 58.684 -0.084 1
1 717 . 12 1 1 A 60 60 GLU CB C 60 31.700 29.530 2.170 1
1 719 . 12 1 1 A 60 60 GLU N N 60 116.820 119.159 -2.339 1
1 720 . 12 1 1 A 61 61 LEU H H 61 8.030 7.511 0.519 1
1 721 . 12 1 1 A 61 61 LEU HA H 61 4.310 4.274 0.036 1
1 731 . 12 1 1 A 61 61 LEU C C 61 179.450 176.975 2.475 1
1 732 . 12 1 1 A 61 61 LEU CA C 61 54.840 55.041 -0.201 1
1 733 . 12 1 1 A 61 61 LEU CB C 61 43.820 42.211 1.609 1
1 737 . 12 1 1 A 61 61 LEU N N 61 116.000 118.345 -2.345 1
1 738 . 12 1 1 A 62 62 ASP H H 62 7.890 8.607 -0.717 1
1 739 . 12 1 1 A 62 62 ASP HA H 62 4.660 4.826 -0.166 1
1 742 . 12 1 1 A 62 62 ASP C C 62 177.030 176.084 0.946 1
1 743 . 12 1 1 A 62 62 ASP CA C 62 53.660 53.955 -0.295 1
1 744 . 12 1 1 A 62 62 ASP CB C 62 38.700 39.912 -1.212 1
1 745 . 12 1 1 A 62 62 ASP N N 62 117.550 119.096 -1.546 1
1 746 . 12 1 1 A 63 63 GLU H H 63 8.430 8.861 -0.431 1
1 747 . 12 1 1 A 63 63 GLU HA H 63 4.020 4.009 0.011 1
1 752 . 12 1 1 A 63 63 GLU C C 63 178.120 178.958 -0.838 1
1 753 . 12 1 1 A 63 63 GLU CA C 63 58.470 59.224 -0.754 1
1 754 . 12 1 1 A 63 63 GLU CB C 63 30.120 29.347 0.773 1
1 756 . 12 1 1 A 63 63 GLU N N 63 130.230 120.191 10.039 1
1 757 . 12 1 1 A 64 64 ASN H H 64 8.010 8.107 -0.097 1
1 758 . 12 1 1 A 64 64 ASN HA H 64 4.680 4.657 0.023 1
1 761 . 12 1 1 A 64 64 ASN C C 64 177.100 176.104 0.996 1
1 762 . 12 1 1 A 64 64 ASN CA C 64 51.780 53.279 -1.499 1
1 763 . 12 1 1 A 64 64 ASN CB C 64 37.260 38.988 -1.728 1
1 764 . 12 1 1 A 64 64 ASN N N 64 113.640 115.652 -2.012 1
1 765 . 12 1 1 A 65 65 GLY H H 65 7.550 7.985 -0.435 1
1 766 . 12 1 1 A 65 65 GLY HA2 H 65 3.770 3.944 -0.174 1
1 767 . 12 1 1 A 65 65 GLY HA3 H 65 3.770 3.945 -0.175 1
1 768 . 12 1 1 A 65 65 GLY C C 65 178.980 175.002 3.978 1
1 769 . 12 1 1 A 65 65 GLY CA C 65 47.200 46.639 0.561 1
1 770 . 12 1 1 A 65 65 GLY N N 65 113.640 107.620 6.020 1
1 771 . 12 1 1 A 66 66 ASP H H 66 8.110 8.153 -0.043 1
1 772 . 12 1 1 A 66 66 ASP HA H 66 4.490 4.590 -0.100 1
1 775 . 12 1 1 A 66 66 ASP C C 66 177.960 177.564 0.396 1
1 776 . 12 1 1 A 66 66 ASP CA C 66 52.960 53.497 -0.537 1
1 777 . 12 1 1 A 66 66 ASP CB C 66 40.540 40.491 0.049 1
1 778 . 12 1 1 A 66 66 ASP N N 66 120.030 120.136 -0.106 1
1 779 . 12 1 1 A 67 67 GLY H H 67 10.260 9.062 1.198 1
1 780 . 12 1 1 A 67 67 GLY HA2 H 67 3.360 3.866 -0.506 1
1 781 . 12 1 1 A 67 67 GLY HA3 H 67 4.000 3.866 0.134 1
1 782 . 12 1 1 A 67 67 GLY C C 67 173.120 173.371 -0.251 1
1 783 . 12 1 1 A 67 67 GLY CA C 67 45.460 45.776 -0.316 1
1 784 . 12 1 1 A 67 67 GLY N N 67 114.100 110.724 3.376 1
1 785 . 12 1 1 A 68 68 GLU H H 68 7.750 8.119 -0.369 1
1 786 . 12 1 1 A 68 68 GLU HA H 68 4.780 4.978 -0.198 1
1 791 . 12 1 1 A 68 68 GLU C C 68 175.930 174.972 0.958 1
1 792 . 12 1 1 A 68 68 GLU CA C 68 54.430 54.460 -0.030 1
1 793 . 12 1 1 A 68 68 GLU CB C 68 35.850 33.572 2.278 1
1 795 . 12 1 1 A 68 68 GLU N N 68 118.000 119.346 -1.346 1
1 796 . 12 1 1 A 69 69 VAL H H 69 9.380 8.452 0.928 1
1 797 . 12 1 1 A 69 69 VAL HA H 69 5.260 5.106 0.154 1
1 805 . 12 1 1 A 69 69 VAL C C 69 176.710 174.462 2.248 1
1 806 . 12 1 1 A 69 69 VAL CA C 69 61.280 60.758 0.522 1
1 807 . 12 1 1 A 69 69 VAL CB C 69 33.980 35.548 -1.568 1
1 810 . 12 1 1 A 69 69 VAL N N 69 125.970 120.775 5.195 1
1 811 . 12 1 1 A 70 70 ASP H H 70 9.100 8.975 0.125 1
1 812 . 12 1 1 A 70 70 ASP HA H 70 5.190 5.076 0.114 1
1 815 . 12 1 1 A 70 70 ASP C C 70 175.700 177.765 -2.065 1
1 816 . 12 1 1 A 70 70 ASP CA C 70 52.370 53.162 -0.792 1
1 817 . 12 1 1 A 70 70 ASP CB C 70 40.950 42.457 -1.507 1
1 818 . 12 1 1 A 70 70 ASP N N 70 130.320 126.676 3.644 1
1 819 . 12 1 1 A 71 71 PHE H H 71 9.090 9.161 -0.071 1
1 820 . 12 1 1 A 71 71 PHE HA H 71 4.100 3.729 0.371 1
1 823 . 12 1 1 A 71 71 PHE C C 71 177.000 177.430 -0.430 1
1 824 . 12 1 1 A 71 71 PHE CA C 71 58.230 61.422 -3.192 1
1 825 . 12 1 1 A 71 71 PHE CB C 71 36.910 39.035 -2.125 1
1 826 . 12 1 1 A 71 71 PHE N N 71 119.760 123.088 -3.328 1
1 827 . 12 1 1 A 72 72 GLN H H 72 8.440 8.374 0.066 1
1 828 . 12 1 1 A 72 72 GLN HA H 72 3.600 3.972 -0.372 1
1 831 . 12 1 1 A 72 72 GLN C C 72 178.820 178.483 0.337 1
1 832 . 12 1 1 A 72 72 GLN CA C 72 59.500 58.432 1.068 1
1 833 . 12 1 1 A 72 72 GLN CB C 72 29.553 28.323 1.230 1
1 835 . 12 1 1 A 72 72 GLN N N 72 121.820 118.303 3.517 1
1 836 . 12 1 1 A 73 73 GLU H H 73 8.290 8.649 -0.359 1
1 837 . 12 1 1 A 73 73 GLU HA H 73 4.070 4.067 0.003 1
1 842 . 12 1 1 A 73 73 GLU C C 73 179.370 178.955 0.415 1
1 843 . 12 1 1 A 73 73 GLU CA C 73 58.030 58.766 -0.736 1
1 844 . 12 1 1 A 73 73 GLU CB C 73 29.530 30.119 -0.589 1
1 846 . 12 1 1 A 73 73 GLU N N 73 120.550 118.752 1.798 1
1 847 . 12 1 1 A 74 74 PHE H H 74 8.630 8.078 0.552 1
1 848 . 12 1 1 A 74 74 PHE HA H 74 4.020 4.162 -0.142 1
1 851 . 12 1 1 A 74 74 PHE C C 74 177.890 177.017 0.873 1
1 852 . 12 1 1 A 74 74 PHE CA C 74 60.090 61.072 -0.982 1
1 853 . 12 1 1 A 74 74 PHE CB C 74 38.020 39.034 -1.014 1
1 854 . 12 1 1 A 74 74 PHE N N 74 121.010 121.672 -0.662 1
1 855 . 12 1 1 A 75 75 VAL H H 75 8.080 8.249 -0.169 1
1 856 . 12 1 1 A 75 75 VAL HA H 75 2.860 3.496 -0.636 1
1 864 . 12 1 1 A 75 75 VAL C C 75 177.030 178.236 -1.206 1
1 865 . 12 1 1 A 75 75 VAL CA C 75 66.430 66.488 -0.058 1
1 866 . 12 1 1 A 75 75 VAL CB C 75 30.600 30.855 -0.255 1
1 869 . 12 1 1 A 75 75 VAL N N 75 119.460 119.497 -0.037 1
1 870 . 12 1 1 A 76 76 VAL H H 76 7.100 8.150 -1.050 1
1 871 . 12 1 1 A 76 76 VAL HA H 76 3.330 3.524 -0.194 1
1 879 . 12 1 1 A 76 76 VAL C C 76 178.670 178.468 0.202 1
1 880 . 12 1 1 A 76 76 VAL CA C 76 67.000 66.632 0.368 1
1 881 . 12 1 1 A 76 76 VAL CB C 76 31.280 31.489 -0.209 1
1 884 . 12 1 1 A 76 76 VAL N N 76 121.030 120.217 0.813 1
1 885 . 12 1 1 A 77 77 LEU H H 77 6.900 8.362 -1.462 1
1 886 . 12 1 1 A 77 77 LEU HA H 77 3.800 4.005 -0.205 1
1 896 . 12 1 1 A 77 77 LEU C C 77 177.960 178.535 -0.575 1
1 897 . 12 1 1 A 77 77 LEU CA C 77 57.710 58.123 -0.413 1
1 898 . 12 1 1 A 77 77 LEU CB C 77 40.070 41.631 -1.561 1
1 902 . 12 1 1 A 77 77 LEU N N 77 120.310 121.072 -0.762 1
1 903 . 12 1 1 A 78 78 VAL H H 78 7.240 8.126 -0.886 1
1 904 . 12 1 1 A 78 78 VAL HA H 78 3.030 3.941 -0.911 1
1 912 . 12 1 1 A 78 78 VAL C C 78 179.600 178.109 1.491 1
1 913 . 12 1 1 A 78 78 VAL CA C 78 66.420 65.185 1.235 1
1 914 . 12 1 1 A 78 78 VAL CB C 78 30.700 31.605 -0.905 1
1 917 . 12 1 1 A 78 78 VAL N N 78 117.180 116.846 0.334 1
1 918 . 12 1 1 A 79 79 ALA H H 79 9.000 8.263 0.737 1
1 919 . 12 1 1 A 79 79 ALA HA H 79 3.610 4.008 -0.398 1
1 923 . 12 1 1 A 79 79 ALA C C 79 182.260 179.967 2.293 1
1 924 . 12 1 1 A 79 79 ALA CA C 79 55.580 55.587 -0.007 1
1 925 . 12 1 1 A 79 79 ALA CB C 79 18.400 18.041 0.359 1
1 926 . 12 1 1 A 79 79 ALA N N 79 126.000 124.822 1.178 1
1 927 . 12 1 1 A 80 80 ALA H H 80 8.000 8.271 -0.271 1
1 928 . 12 1 1 A 80 80 ALA HA H 80 4.100 4.088 0.012 1
1 932 . 12 1 1 A 80 80 ALA C C 80 175.460 179.758 -4.298 1
1 933 . 12 1 1 A 80 80 ALA CA C 80 56.020 54.412 1.608 1
1 934 . 12 1 1 A 80 80 ALA CB C 80 18.040 18.246 -0.206 1
1 935 . 12 1 1 A 80 80 ALA N N 80 120.730 120.847 -0.117 1
1 936 . 12 1 1 A 81 81 LEU H H 81 8.460 7.898 0.562 1
1 937 . 12 1 1 A 81 81 LEU HA H 81 4.000 4.177 -0.177 1
1 941 . 12 1 1 A 81 81 LEU C C 81 177.030 179.254 -2.224 1
1 942 . 12 1 1 A 81 81 LEU CA C 81 57.640 57.467 0.173 1
1 943 . 12 1 1 A 81 81 LEU CB C 81 40.620 41.931 -1.311 1
1 945 . 12 1 1 A 81 81 LEU N N 81 119.890 119.539 0.351 1
1 946 . 12 1 1 A 82 82 THR H H 82 8.320 8.040 0.280 1
1 947 . 12 1 1 A 82 82 THR HA H 82 3.800 4.040 -0.240 1
1 952 . 12 1 1 A 82 82 THR C C 82 181.010 176.928 4.082 1
1 953 . 12 1 1 A 82 82 THR CA C 82 68.500 66.209 2.291 1
1 954 . 12 1 1 A 82 82 THR CB C 82 67.400 68.873 -1.473 1
1 956 . 12 1 1 A 82 82 THR N N 82 117.120 113.011 4.109 1
1 957 . 12 1 1 A 83 83 VAL H H 83 8.530 7.543 0.987 1
1 958 . 12 1 1 A 83 83 VAL HA H 83 3.890 3.834 0.056 1
1 966 . 12 1 1 A 83 83 VAL C C 83 178.120 178.198 -0.078 1
1 967 . 12 1 1 A 83 83 VAL CA C 83 67.400 65.204 2.196 1
1 968 . 12 1 1 A 83 83 VAL CB C 83 31.590 31.543 0.047 1
1 971 . 12 1 1 A 83 83 VAL N N 83 119.760 118.107 1.653 1
1 972 . 12 1 1 A 84 84 ALA H H 84 7.910 8.532 -0.622 1
1 973 . 12 1 1 A 84 84 ALA HA H 84 4.060 4.109 -0.049 1
1 977 . 12 1 1 A 84 84 ALA C C 84 180.560 179.945 0.615 1
1 978 . 12 1 1 A 84 84 ALA CA C 84 55.000 55.432 -0.432 1
1 979 . 12 1 1 A 84 84 ALA CB C 84 17.230 18.248 -1.018 1
1 980 . 12 1 1 A 84 84 ALA N N 84 122.620 124.467 -1.847 1
1 981 . 12 1 1 A 85 85 CYS H H 85 8.580 7.902 0.678 1
1 982 . 12 1 1 A 85 85 CYS HA H 85 4.080 4.432 -0.352 1
1 985 . 12 1 1 A 85 85 CYS C C 85 179.060 177.152 1.908 1
1 986 . 12 1 1 A 85 85 CYS CA C 85 63.210 61.648 1.562 1
1 987 . 12 1 1 A 85 85 CYS CB C 85 26.310 27.337 -1.027 1
1 988 . 12 1 1 A 85 85 CYS N N 85 118.730 117.818 0.912 1
1 989 . 12 1 1 A 86 86 ASN H H 86 8.430 8.200 0.230 1
1 990 . 12 1 1 A 86 86 ASN CA C 86 55.860 56.864 -1.004 1
1 991 . 12 1 1 A 86 86 ASN CB C 86 37.440 40.024 -2.584 1
1 992 . 12 1 1 A 86 86 ASN N N 86 119.360 119.406 -0.046 1
1 993 . 12 1 1 A 87 87 ASN H H 87 7.880 7.944 -0.064 1
1 994 . 12 1 1 A 87 87 ASN HA H 87 4.600 4.536 0.064 1
1 997 . 12 1 1 A 87 87 ASN C C 87 178.510 177.763 0.747 1
1 998 . 12 1 1 A 87 87 ASN CA C 87 56.470 56.361 0.109 1
1 999 . 12 1 1 A 87 87 ASN CB C 87 37.500 39.259 -1.759 1
1 1000 . 12 1 1 A 87 87 ASN N N 87 119.480 117.477 2.003 1
1 1001 . 12 1 1 A 88 88 PHE H H 88 8.050 7.664 0.386 1
1 1002 . 12 1 1 A 88 88 PHE HA H 88 4.200 4.359 -0.159 1
1 1005 . 12 1 1 A 88 88 PHE C C 88 178.510 177.414 1.096 1
1 1006 . 12 1 1 A 88 88 PHE CA C 88 56.460 59.869 -3.409 1
1 1007 . 12 1 1 A 88 88 PHE CB C 88 38.500 39.830 -1.330 1
1 1008 . 12 1 1 A 88 88 PHE N N 88 120.280 119.971 0.309 1
1 1009 . 12 1 1 A 89 89 PHE H H 89 8.020 8.356 -0.336 1
1 1010 . 12 1 1 A 89 89 PHE HA H 89 4.000 4.144 -0.144 1
1 1013 . 12 1 1 A 89 89 PHE C C 89 177.340 177.348 -0.008 1
1 1014 . 12 1 1 A 89 89 PHE CA C 89 59.000 59.721 -0.721 1
1 1015 . 12 1 1 A 89 89 PHE CB C 89 37.430 39.799 -2.369 1
1 1016 . 12 1 1 A 89 89 PHE N N 89 120.910 119.345 1.565 1
1 1017 . 12 1 1 A 90 90 TRP H H 90 7.800 8.233 -0.433 1
1 1018 . 12 1 1 A 90 90 TRP HA H 90 4.460 4.179 0.281 1
1 1021 . 12 1 1 A 90 90 TRP C C 90 177.340 178.003 -0.663 1
1 1022 . 12 1 1 A 90 90 TRP CA C 90 57.930 59.557 -1.627 1
1 1023 . 12 1 1 A 90 90 TRP CB C 90 42.000 29.828 12.172 1
1 1024 . 12 1 1 A 90 90 TRP N N 90 120.050 121.044 -0.994 1
1 1025 . 12 1 1 A 91 91 GLU H H 91 7.800 8.448 -0.648 1
1 1026 . 12 1 1 A 91 91 GLU HA H 91 4.050 3.796 0.254 1
1 1031 . 12 1 1 A 91 91 GLU C C 91 177.570 176.677 0.893 1
1 1032 . 12 1 1 A 91 91 GLU CA C 91 57.350 58.216 -0.866 1
1 1033 . 12 1 1 A 91 91 GLU CB C 91 29.530 27.937 1.593 1
1 1035 . 12 1 1 A 91 91 GLU N N 91 120.730 117.011 3.719 1
1 1036 . 12 1 1 A 92 92 ASN H H 92 7.800 7.213 0.587 1
1 1037 . 12 1 1 A 92 92 ASN HA H 92 4.630 4.339 0.291 1
1 1040 . 12 1 1 A 92 92 ASN C C 92 174.450 175.432 -0.982 1
1 1041 . 12 1 1 A 92 92 ASN CA C 92 52.960 51.737 1.223 1
1 1042 . 12 1 1 A 92 92 ASN CB C 92 29.530 37.207 -7.677 1
1 1043 . 12 1 1 A 92 92 ASN N N 92 119.410 115.932 3.478 1
1 5 . 13 1 1 A 2 2 SER H H 2 9.000 7.958 1.042 1
1 6 . 13 1 1 A 2 2 SER HA H 2 4.690 4.854 -0.164 1
1 9 . 13 1 1 A 2 2 SER C C 2 176.170 174.673 1.497 1
1 10 . 13 1 1 A 2 2 SER CA C 2 57.340 58.121 -0.781 1
1 11 . 13 1 1 A 2 2 SER CB C 2 65.550 63.508 2.042 1
1 12 . 13 1 1 A 2 2 SER N N 2 119.330 115.367 3.963 1
1 13 . 13 1 1 A 3 3 GLU H H 3 9.350 8.175 1.175 1
1 14 . 13 1 1 A 3 3 GLU HA H 3 4.060 4.092 -0.032 1
1 17 . 13 1 1 A 3 3 GLU C C 3 180.150 179.029 1.121 1
1 18 . 13 1 1 A 3 3 GLU CA C 3 60.280 59.018 1.262 1
1 19 . 13 1 1 A 3 3 GLU CB C 3 29.230 29.280 -0.050 1
1 21 . 13 1 1 A 3 3 GLU N N 3 125.350 122.209 3.141 1
1 22 . 13 1 1 A 4 4 LEU H H 4 9.060 8.106 0.954 1
1 23 . 13 1 1 A 4 4 LEU HA H 4 4.080 4.077 0.003 1
1 33 . 13 1 1 A 4 4 LEU C C 4 177.890 178.331 -0.441 1
1 34 . 13 1 1 A 4 4 LEU CA C 4 58.090 57.858 0.232 1
1 35 . 13 1 1 A 4 4 LEU CB C 4 42.120 41.778 0.342 1
1 39 . 13 1 1 A 4 4 LEU N N 4 121.090 120.881 0.209 1
1 40 . 13 1 1 A 5 5 GLU H H 5 8.340 8.334 0.006 1
1 41 . 13 1 1 A 5 5 GLU HA H 5 4.050 3.903 0.147 1
1 46 . 13 1 1 A 5 5 GLU C C 5 177.030 179.097 -2.067 1
1 47 . 13 1 1 A 5 5 GLU CA C 5 59.840 59.583 0.257 1
1 48 . 13 1 1 A 5 5 GLU CB C 5 28.940 29.394 -0.454 1
1 50 . 13 1 1 A 5 5 GLU N N 5 119.780 118.566 1.214 1
1 51 . 13 1 1 A 6 6 THR H H 6 8.370 8.039 0.331 1
1 52 . 13 1 1 A 6 6 THR HA H 6 4.310 3.887 0.423 1
1 57 . 13 1 1 A 6 6 THR C C 6 177.340 177.148 0.192 1
1 58 . 13 1 1 A 6 6 THR CA C 6 66.630 65.962 0.668 1
1 59 . 13 1 1 A 6 6 THR CB C 6 68.650 68.810 -0.160 1
1 61 . 13 1 1 A 6 6 THR N N 6 116.940 116.385 0.555 1
1 62 . 13 1 1 A 7 7 ALA H H 7 8.270 7.762 0.508 1
1 63 . 13 1 1 A 7 7 ALA HA H 7 4.190 4.287 -0.097 1
1 67 . 13 1 1 A 7 7 ALA C C 7 179.760 179.369 0.391 1
1 68 . 13 1 1 A 7 7 ALA CA C 7 55.880 54.906 0.974 1
1 69 . 13 1 1 A 7 7 ALA CB C 7 17.720 18.065 -0.345 1
1 70 . 13 1 1 A 7 7 ALA N N 7 127.400 124.062 3.338 1
1 71 . 13 1 1 A 8 8 MET H H 8 8.110 7.721 0.389 1
1 72 . 13 1 1 A 8 8 MET HA H 8 4.020 4.210 -0.190 1
1 80 . 13 1 1 A 8 8 MET C C 8 178.510 178.156 0.354 1
1 81 . 13 1 1 A 8 8 MET CA C 8 60.580 58.031 2.549 1
1 82 . 13 1 1 A 8 8 MET CB C 8 33.630 32.274 1.356 1
1 85 . 13 1 1 A 8 8 MET N N 8 117.520 118.322 -0.802 1
1 86 . 13 1 1 A 9 9 GLU H H 9 8.210 7.640 0.570 1
1 87 . 13 1 1 A 9 9 GLU HA H 9 3.830 4.103 -0.273 1
1 92 . 13 1 1 A 9 9 GLU C C 9 179.140 179.137 0.003 1
1 93 . 13 1 1 A 9 9 GLU CA C 9 59.690 58.912 0.778 1
1 94 . 13 1 1 A 9 9 GLU CB C 9 29.530 28.922 0.608 1
1 96 . 13 1 1 A 9 9 GLU N N 9 118.560 118.255 0.305 1
1 97 . 13 1 1 A 10 10 THR H H 10 8.490 7.466 1.024 1
1 98 . 13 1 1 A 10 10 THR HA H 10 4.000 3.825 0.175 1
1 103 . 13 1 1 A 10 10 THR C C 10 176.010 176.493 -0.483 1
1 104 . 13 1 1 A 10 10 THR CA C 10 67.110 66.480 0.630 1
1 105 . 13 1 1 A 10 10 THR CB C 10 67.770 68.469 -0.699 1
1 107 . 13 1 1 A 10 10 THR N N 10 118.310 115.672 2.638 1
1 108 . 13 1 1 A 11 11 LEU H H 11 7.920 7.609 0.311 1
1 109 . 13 1 1 A 11 11 LEU HA H 11 3.930 2.924 1.006 1
1 119 . 13 1 1 A 11 11 LEU C C 11 178.820 178.618 0.202 1
1 120 . 13 1 1 A 11 11 LEU CA C 11 59.690 57.428 2.262 1
1 121 . 13 1 1 A 11 11 LEU CB C 11 41.920 41.331 0.589 1
1 125 . 13 1 1 A 11 11 LEU N N 11 121.150 120.920 0.230 1
1 126 . 13 1 1 A 12 12 ILE H H 12 7.440 7.472 -0.032 1
1 127 . 13 1 1 A 12 12 ILE HA H 12 3.640 3.297 0.343 1
1 137 . 13 1 1 A 12 12 ILE C C 12 179.530 178.421 1.109 1
1 138 . 13 1 1 A 12 12 ILE CA C 12 63.740 64.933 -1.193 1
1 139 . 13 1 1 A 12 12 ILE CB C 12 38.800 37.570 1.230 1
1 143 . 13 1 1 A 12 12 ILE N N 12 118.010 120.501 -2.491 1
1 144 . 13 1 1 A 13 13 ASN H H 13 8.930 7.621 1.309 1
1 145 . 13 1 1 A 13 13 ASN HA H 13 4.520 4.604 -0.084 1
1 148 . 13 1 1 A 13 13 ASN C C 13 179.450 177.723 1.727 1
1 149 . 13 1 1 A 13 13 ASN CA C 13 56.470 55.569 0.901 1
1 150 . 13 1 1 A 13 13 ASN CB C 13 37.930 38.632 -0.702 1
1 151 . 13 1 1 A 13 13 ASN N N 13 121.820 118.948 2.872 1
1 152 . 13 1 1 A 14 14 VAL H H 14 9.180 8.018 1.162 1
1 153 . 13 1 1 A 14 14 VAL HA H 14 3.830 3.778 0.052 1
1 161 . 13 1 1 A 14 14 VAL CA C 14 65.840 65.220 0.620 1
1 162 . 13 1 1 A 14 14 VAL CB C 14 31.290 31.391 -0.101 1
1 165 . 13 1 1 A 14 14 VAL N N 14 122.040 119.082 2.958 1
1 166 . 13 1 1 A 15 15 PHE H H 15 7.590 7.657 -0.067 1
1 167 . 13 1 1 A 15 15 PHE HA H 15 3.360 4.095 -0.735 1
1 170 . 13 1 1 A 15 15 PHE C C 15 177.890 178.626 -0.736 1
1 171 . 13 1 1 A 15 15 PHE CA C 15 62.030 60.315 1.715 1
1 172 . 13 1 1 A 15 15 PHE CB C 15 38.900 38.172 0.728 1
1 173 . 13 1 1 A 15 15 PHE N N 15 118.290 120.290 -2.000 1
1 174 . 13 1 1 A 16 16 HIS H H 16 7.790 7.740 0.050 1
1 175 . 13 1 1 A 16 16 HIS HA H 16 4.890 4.245 0.645 1
1 178 . 13 1 1 A 16 16 HIS C C 16 177.810 176.928 0.882 1
1 179 . 13 1 1 A 16 16 HIS CA C 16 59.100 60.011 -0.911 1
1 180 . 13 1 1 A 16 16 HIS CB C 16 28.060 29.248 -1.188 1
1 181 . 13 1 1 A 16 16 HIS N N 16 118.290 119.134 -0.844 1
1 182 . 13 1 1 A 17 17 ALA H H 17 8.040 7.952 0.088 1
1 183 . 13 1 1 A 17 17 ALA HA H 17 4.050 3.893 0.157 1
1 187 . 13 1 1 A 17 17 ALA C C 17 179.600 179.896 -0.296 1
1 188 . 13 1 1 A 17 17 ALA CA C 17 54.000 55.204 -1.204 1
1 189 . 13 1 1 A 17 17 ALA CB C 17 17.520 18.726 -1.206 1
1 190 . 13 1 1 A 17 17 ALA N N 17 124.410 120.767 3.643 1
1 191 . 13 1 1 A 18 18 HIS H H 18 7.000 7.620 -0.620 1
1 192 . 13 1 1 A 18 18 HIS HA H 18 4.330 4.261 0.069 1
1 195 . 13 1 1 A 18 18 HIS C C 18 176.320 177.978 -1.658 1
1 196 . 13 1 1 A 18 18 HIS CA C 18 57.350 59.652 -2.302 1
1 197 . 13 1 1 A 18 18 HIS CB C 18 32.920 30.204 2.716 1
1 198 . 13 1 1 A 18 18 HIS N N 18 115.160 116.069 -0.909 1
1 199 . 13 1 1 A 19 19 SER H H 19 8.380 8.154 0.226 1
1 200 . 13 1 1 A 19 19 SER HA H 19 3.640 4.133 -0.493 1
1 203 . 13 1 1 A 19 19 SER C C 19 177.340 175.882 1.458 1
1 204 . 13 1 1 A 19 19 SER CA C 19 60.160 60.703 -0.543 1
1 205 . 13 1 1 A 19 19 SER CB C 19 61.000 62.915 -1.915 1
1 206 . 13 1 1 A 19 19 SER N N 19 114.380 114.746 -0.366 1
1 207 . 13 1 1 A 20 20 GLY H H 20 7.600 7.778 -0.178 1
1 208 . 13 1 1 A 20 20 GLY HA2 H 20 3.680 3.775 -0.095 1
1 209 . 13 1 1 A 20 20 GLY HA3 H 20 4.000 3.938 0.062 1
1 210 . 13 1 1 A 20 20 GLY C C 20 174.140 174.347 -0.207 1
1 211 . 13 1 1 A 20 20 GLY CA C 20 47.000 45.168 1.832 1
1 212 . 13 1 1 A 20 20 GLY N N 20 112.550 107.062 5.488 1
1 213 . 13 1 1 A 21 21 LYS H H 21 7.230 7.730 -0.500 1
1 214 . 13 1 1 A 21 21 LYS HA H 21 3.860 4.593 -0.733 1
1 223 . 13 1 1 A 21 21 LYS C C 21 177.730 178.060 -0.330 1
1 224 . 13 1 1 A 21 21 LYS CA C 21 59.110 57.467 1.643 1
1 225 . 13 1 1 A 21 21 LYS CB C 21 32.460 34.401 -1.941 1
1 229 . 13 1 1 A 21 21 LYS N N 21 123.240 120.427 2.813 1
1 230 . 13 1 1 A 22 22 GLU H H 22 9.350 8.182 1.168 1
1 231 . 13 1 1 A 22 22 GLU HA H 22 4.610 4.244 0.366 1
1 236 . 13 1 1 A 22 22 GLU C C 22 177.420 176.018 1.402 1
1 237 . 13 1 1 A 22 22 GLU CA C 22 53.700 57.144 -3.444 1
1 238 . 13 1 1 A 22 22 GLU CB C 22 32.000 29.377 2.623 1
1 240 . 13 1 1 A 22 22 GLU N N 22 116.770 118.756 -1.986 1
1 241 . 13 1 1 A 23 23 GLY H H 23 7.570 7.986 -0.416 1
1 242 . 13 1 1 A 23 23 GLY HA2 H 23 3.630 3.932 -0.302 1
1 243 . 13 1 1 A 23 23 GLY HA3 H 23 3.880 3.938 -0.058 1
1 244 . 13 1 1 A 23 23 GLY C C 23 173.980 171.887 2.093 1
1 245 . 13 1 1 A 23 23 GLY CA C 23 45.250 45.276 -0.026 1
1 246 . 13 1 1 A 23 23 GLY N N 23 112.180 106.920 5.260 1
1 247 . 13 1 1 A 24 24 ASP H H 24 8.680 8.438 0.242 1
1 248 . 13 1 1 A 24 24 ASP HA H 24 4.380 4.742 -0.362 1
1 251 . 13 1 1 A 24 24 ASP C C 24 178.590 175.639 2.951 1
1 252 . 13 1 1 A 24 24 ASP CA C 24 60.000 53.755 6.245 1
1 253 . 13 1 1 A 24 24 ASP CB C 24 27.480 41.616 -14.136 1
1 254 . 13 1 1 A 24 24 ASP N N 24 127.470 119.866 7.604 1
1 255 . 13 1 1 A 25 25 LYS H H 25 9.270 8.436 0.834 1
1 256 . 13 1 1 A 25 25 LYS HA H 25 4.250 4.326 -0.076 1
1 265 . 13 1 1 A 25 25 LYS C C 25 177.030 175.799 1.231 1
1 266 . 13 1 1 A 25 25 LYS CA C 25 60.000 56.178 3.822 1
1 267 . 13 1 1 A 25 25 LYS CB C 25 31.170 31.553 -0.383 1
1 271 . 13 1 1 A 25 25 LYS N N 25 132.960 123.613 9.347 1
1 272 . 13 1 1 A 26 26 TYR H H 26 9.430 9.072 0.358 1
1 273 . 13 1 1 A 26 26 TYR HA H 26 4.640 4.772 -0.132 1
1 276 . 13 1 1 A 26 26 TYR C C 26 174.290 174.987 -0.697 1
1 277 . 13 1 1 A 26 26 TYR CA C 26 56.010 58.925 -2.915 1
1 278 . 13 1 1 A 26 26 TYR CB C 26 37.730 40.825 -3.095 1
1 279 . 13 1 1 A 26 26 TYR N N 26 120.650 128.103 -7.453 1
1 280 . 13 1 1 A 27 27 LYS H H 27 7.110 7.739 -0.629 1
1 281 . 13 1 1 A 27 27 LYS HA H 27 5.110 4.684 0.426 1
1 290 . 13 1 1 A 27 27 LYS C C 27 175.150 173.953 1.197 1
1 291 . 13 1 1 A 27 27 LYS CA C 27 55.070 55.776 -0.706 1
1 292 . 13 1 1 A 27 27 LYS CB C 27 38.900 35.525 3.375 1
1 296 . 13 1 1 A 27 27 LYS N N 27 115.830 118.214 -2.384 1
1 297 . 13 1 1 A 28 28 LEU H H 28 9.820 8.238 1.582 1
1 298 . 13 1 1 A 28 28 LEU HA H 28 5.080 4.712 0.368 1
1 308 . 13 1 1 A 28 28 LEU C C 28 176.640 176.060 0.580 1
1 309 . 13 1 1 A 28 28 LEU CA C 28 52.660 53.858 -1.198 1
1 310 . 13 1 1 A 28 28 LEU CB C 28 42.710 42.859 -0.149 1
1 314 . 13 1 1 A 28 28 LEU N N 28 126.930 122.867 4.063 1
1 315 . 13 1 1 A 29 29 SER H H 29 9.890 10.012 -0.122 1
1 316 . 13 1 1 A 29 29 SER HA H 29 4.530 4.505 0.025 1
1 319 . 13 1 1 A 29 29 SER C C 29 174.990 175.554 -0.564 1
1 320 . 13 1 1 A 29 29 SER CA C 29 56.180 58.191 -2.011 1
1 321 . 13 1 1 A 29 29 SER CB C 29 65.550 64.236 1.314 1
1 322 . 13 1 1 A 29 29 SER N N 29 121.600 123.323 -1.723 1
1 323 . 13 1 1 A 30 30 LYS H H 30 8.850 8.980 -0.130 1
1 324 . 13 1 1 A 30 30 LYS HA H 30 3.850 3.991 -0.141 1
1 333 . 13 1 1 A 30 30 LYS C C 30 175.620 178.420 -2.800 1
1 334 . 13 1 1 A 30 30 LYS CA C 30 60.860 59.744 1.116 1
1 335 . 13 1 1 A 30 30 LYS CB C 30 31.290 32.229 -0.939 1
1 339 . 13 1 1 A 30 30 LYS N N 30 121.260 124.635 -3.375 1
1 340 . 13 1 1 A 31 31 LYS H H 31 7.970 8.066 -0.096 1
1 341 . 13 1 1 A 31 31 LYS HA H 31 3.880 4.115 -0.235 1
1 350 . 13 1 1 A 31 31 LYS C C 31 179.290 178.561 0.729 1
1 351 . 13 1 1 A 31 31 LYS CA C 31 59.110 59.005 0.105 1
1 352 . 13 1 1 A 31 31 LYS CB C 31 32.640 32.214 0.426 1
1 356 . 13 1 1 A 31 31 LYS N N 31 121.260 118.070 3.190 1
1 357 . 13 1 1 A 32 32 GLU H H 32 7.510 8.618 -1.108 1
1 358 . 13 1 1 A 32 32 GLU HA H 32 3.830 4.075 -0.245 1
1 363 . 13 1 1 A 32 32 GLU C C 32 179.290 179.645 -0.355 1
1 364 . 13 1 1 A 32 32 GLU CA C 32 58.590 58.845 -0.255 1
1 365 . 13 1 1 A 32 32 GLU CB C 32 30.120 30.024 0.096 1
1 367 . 13 1 1 A 32 32 GLU N N 32 120.090 119.541 0.549 1
1 368 . 13 1 1 A 33 33 LEU H H 33 8.970 7.700 1.270 1
1 369 . 13 1 1 A 33 33 LEU HA H 33 3.830 3.826 0.004 1
1 379 . 13 1 1 A 33 33 LEU C C 33 178.200 178.851 -0.651 1
1 380 . 13 1 1 A 33 33 LEU CA C 33 57.930 58.011 -0.081 1
1 381 . 13 1 1 A 33 33 LEU CB C 33 40.660 41.636 -0.976 1
1 385 . 13 1 1 A 33 33 LEU N N 33 120.200 119.186 1.014 1
1 386 . 13 1 1 A 34 34 LYS H H 34 8.230 7.552 0.678 1
1 387 . 13 1 1 A 34 34 LYS HA H 34 3.550 3.985 -0.435 1
1 396 . 13 1 1 A 34 34 LYS C C 34 178.040 178.010 0.030 1
1 397 . 13 1 1 A 34 34 LYS CA C 34 60.720 59.864 0.856 1
1 398 . 13 1 1 A 34 34 LYS CB C 34 31.980 32.270 -0.290 1
1 402 . 13 1 1 A 34 34 LYS N N 34 120.780 119.337 1.443 1
1 403 . 13 1 1 A 35 35 ASP H H 35 7.990 7.909 0.081 1
1 404 . 13 1 1 A 35 35 ASP HA H 35 4.250 4.479 -0.229 1
1 407 . 13 1 1 A 35 35 ASP C C 35 179.060 178.426 0.634 1
1 408 . 13 1 1 A 35 35 ASP CA C 35 56.830 57.337 -0.507 1
1 409 . 13 1 1 A 35 35 ASP CB C 35 40.440 40.953 -0.513 1
1 410 . 13 1 1 A 35 35 ASP N N 35 119.550 120.037 -0.487 1
1 411 . 13 1 1 A 36 36 LEU H H 36 8.130 7.732 0.398 1
1 412 . 13 1 1 A 36 36 LEU HA H 36 2.580 3.896 -1.316 1
1 422 . 13 1 1 A 36 36 LEU C C 36 179.450 179.048 0.402 1
1 423 . 13 1 1 A 36 36 LEU CA C 36 59.980 57.950 2.030 1
1 424 . 13 1 1 A 36 36 LEU CB C 36 42.180 41.759 0.421 1
1 428 . 13 1 1 A 36 36 LEU N N 36 125.560 120.824 4.736 1
1 429 . 13 1 1 A 37 37 LEU H H 37 8.740 7.695 1.045 1
1 430 . 13 1 1 A 37 37 LEU HA H 37 3.580 4.181 -0.601 1
1 440 . 13 1 1 A 37 37 LEU C C 37 179.290 179.496 -0.206 1
1 441 . 13 1 1 A 37 37 LEU CA C 37 58.230 58.007 0.223 1
1 442 . 13 1 1 A 37 37 LEU CB C 37 41.590 42.033 -0.443 1
1 446 . 13 1 1 A 37 37 LEU N N 37 120.520 118.686 1.834 1
1 447 . 13 1 1 A 38 38 GLN H H 38 8.520 8.218 0.302 1
1 448 . 13 1 1 A 38 38 GLN HA H 38 4.000 4.115 -0.115 1
1 453 . 13 1 1 A 38 38 GLN C C 38 177.960 177.914 0.046 1
1 454 . 13 1 1 A 38 38 GLN CA C 38 58.210 58.195 0.015 1
1 455 . 13 1 1 A 38 38 GLN CB C 38 28.650 27.096 1.554 1
1 457 . 13 1 1 A 38 38 GLN N N 38 116.740 117.836 -1.096 1
1 458 . 13 1 1 A 39 39 THR H H 39 7.910 7.470 0.440 1
1 459 . 13 1 1 A 39 39 THR HA H 39 4.210 3.907 0.303 1
1 464 . 13 1 1 A 39 39 THR C C 39 177.180 175.839 1.341 1
1 465 . 13 1 1 A 39 39 THR CA C 39 64.730 67.233 -2.503 1
1 466 . 13 1 1 A 39 39 THR CB C 39 69.650 68.709 0.941 1
1 468 . 13 1 1 A 39 39 THR N N 39 111.400 117.095 -5.695 1
1 469 . 13 1 1 A 40 40 GLU H H 40 8.590 8.010 0.580 1
1 470 . 13 1 1 A 40 40 GLU HA H 40 4.680 4.598 0.082 1
1 475 . 13 1 1 A 40 40 GLU C C 40 178.280 177.148 1.132 1
1 476 . 13 1 1 A 40 40 GLU CA C 40 55.880 56.420 -0.540 1
1 477 . 13 1 1 A 40 40 GLU CB C 40 30.990 30.954 0.036 1
1 479 . 13 1 1 A 40 40 GLU N N 40 117.840 116.534 1.306 1
1 480 . 13 1 1 A 41 41 LEU H H 41 7.680 7.668 0.012 1
1 481 . 13 1 1 A 41 41 LEU HA H 41 5.080 4.809 0.271 1
1 491 . 13 1 1 A 41 41 LEU C C 41 179.450 177.399 2.051 1
1 492 . 13 1 1 A 41 41 LEU CA C 41 53.830 53.630 0.200 1
1 493 . 13 1 1 A 41 41 LEU CB C 41 41.360 42.666 -1.306 1
1 497 . 13 1 1 A 41 41 LEU N N 41 121.410 119.891 1.519 1
1 498 . 13 1 1 A 42 42 SER H H 42 8.380 8.010 0.370 1
1 499 . 13 1 1 A 42 42 SER HA H 42 4.130 4.129 0.001 1
1 502 . 13 1 1 A 42 42 SER C C 42 176.640 177.163 -0.523 1
1 503 . 13 1 1 A 42 42 SER CA C 42 61.280 61.660 -0.380 1
1 504 . 13 1 1 A 42 42 SER CB C 42 63.040 63.006 0.034 1
1 505 . 13 1 1 A 42 42 SER N N 42 117.420 117.668 -0.248 1
1 506 . 13 1 1 A 43 43 SER H H 43 8.900 8.128 0.772 1
1 507 . 13 1 1 A 43 43 SER HA H 43 4.290 4.256 0.034 1
1 510 . 13 1 1 A 43 43 SER C C 43 175.620 177.102 -1.482 1
1 511 . 13 1 1 A 43 43 SER CA C 43 60.860 61.270 -0.410 1
1 512 . 13 1 1 A 43 43 SER CB C 43 62.910 63.088 -0.178 1
1 513 . 13 1 1 A 43 43 SER N N 43 117.580 115.681 1.899 1
1 514 . 13 1 1 A 44 44 PHE H H 44 7.880 8.026 -0.146 1
1 515 . 13 1 1 A 44 44 PHE HA H 44 4.240 4.246 -0.006 1
1 518 . 13 1 1 A 44 44 PHE C C 44 176.950 175.777 1.173 1
1 519 . 13 1 1 A 44 44 PHE CA C 44 62.710 61.244 1.466 1
1 520 . 13 1 1 A 44 44 PHE CB C 44 39.020 39.230 -0.210 1
1 521 . 13 1 1 A 44 44 PHE N N 44 119.480 121.784 -2.304 1
1 522 . 13 1 1 A 45 45 LEU H H 45 8.060 8.118 -0.058 1
1 523 . 13 1 1 A 45 45 LEU HA H 45 3.810 3.997 -0.187 1
1 533 . 13 1 1 A 45 45 LEU C C 45 177.500 176.054 1.446 1
1 534 . 13 1 1 A 45 45 LEU CA C 45 59.980 55.840 4.140 1
1 535 . 13 1 1 A 45 45 LEU CB C 45 39.640 42.473 -2.833 1
1 538 . 13 1 1 A 45 45 LEU N N 45 118.010 120.852 -2.842 1
1 539 . 13 1 1 A 46 46 ASP H H 46 8.150 8.641 -0.491 1
1 540 . 13 1 1 A 46 46 ASP HA H 46 4.470 4.849 -0.379 1
1 543 . 13 1 1 A 46 46 ASP C C 46 179.920 175.520 4.400 1
1 544 . 13 1 1 A 46 46 ASP CA C 46 52.950 54.077 -1.127 1
1 545 . 13 1 1 A 46 46 ASP CB C 46 40.000 41.513 -1.513 1
1 546 . 13 1 1 A 46 46 ASP N N 46 119.460 125.072 -5.612 1
1 547 . 13 1 1 A 47 47 VAL H H 47 8.010 8.496 -0.486 1
1 548 . 13 1 1 A 47 47 VAL HA H 47 3.800 4.348 -0.548 1
1 556 . 13 1 1 A 47 47 VAL C C 47 175.460 176.775 -1.315 1
1 557 . 13 1 1 A 47 47 VAL CA C 47 60.000 63.192 -3.192 1
1 558 . 13 1 1 A 47 47 VAL CB C 47 31.580 33.332 -1.752 1
1 561 . 13 1 1 A 47 47 VAL N N 47 117.720 122.559 -4.839 1
1 562 . 13 1 1 A 48 48 GLN H H 48 7.960 8.403 -0.443 1
1 563 . 13 1 1 A 48 48 GLN HA H 48 4.060 4.036 0.024 1
1 568 . 13 1 1 A 48 48 GLN C C 48 179.370 177.929 1.441 1
1 569 . 13 1 1 A 48 48 GLN CA C 48 57.350 58.581 -1.231 1
1 570 . 13 1 1 A 48 48 GLN CB C 48 28.990 28.508 0.482 1
1 572 . 13 1 1 A 48 48 GLN N N 48 119.900 119.494 0.406 1
1 573 . 13 1 1 A 49 49 LYS H H 49 7.810 7.780 0.030 1
1 574 . 13 1 1 A 49 49 LYS HA H 49 3.860 4.125 -0.265 1
1 583 . 13 1 1 A 49 49 LYS C C 49 177.890 176.145 1.745 1
1 584 . 13 1 1 A 49 49 LYS CA C 49 58.230 58.976 -0.746 1
1 585 . 13 1 1 A 49 49 LYS CB C 49 30.990 32.619 -1.629 1
1 587 . 13 1 1 A 49 49 LYS N N 49 120.030 118.310 1.720 1
1 588 . 13 1 1 A 50 50 ASP H H 50 7.570 7.704 -0.134 1
1 589 . 13 1 1 A 50 50 ASP HA H 50 4.700 4.901 -0.201 1
1 590 . 13 1 1 A 50 50 ASP CA C 50 52.950 52.840 0.110 1
1 591 . 13 1 1 A 50 50 ASP CB C 50 38.900 41.288 -2.388 1
1 592 . 13 1 1 A 50 50 ASP N N 50 116.730 118.568 -1.838 1
1 593 . 13 1 1 A 51 51 ALA H H 51 7.570 8.821 -1.251 1
1 594 . 13 1 1 A 51 51 ALA HA H 51 4.200 4.010 0.190 1
1 598 . 13 1 1 A 51 51 ALA C C 51 179.760 179.310 0.450 1
1 599 . 13 1 1 A 51 51 ALA CA C 51 54.200 55.329 -1.129 1
1 600 . 13 1 1 A 51 51 ALA CB C 51 18.110 18.450 -0.340 1
1 601 . 13 1 1 A 51 51 ALA N N 51 118.390 127.922 -9.532 1
1 602 . 13 1 1 A 52 52 ASP H H 52 8.430 8.372 0.058 1
1 603 . 13 1 1 A 52 52 ASP HA H 52 4.600 4.358 0.242 1
1 606 . 13 1 1 A 52 52 ASP C C 52 177.570 178.357 -0.787 1
1 607 . 13 1 1 A 52 52 ASP CA C 52 54.420 56.759 -2.339 1
1 608 . 13 1 1 A 52 52 ASP CB C 52 40.360 40.094 0.266 1
1 609 . 13 1 1 A 52 52 ASP N N 52 117.530 119.357 -1.827 1
1 610 . 13 1 1 A 53 53 ALA H H 53 7.660 7.770 -0.110 1
1 611 . 13 1 1 A 53 53 ALA HA H 53 3.860 4.002 -0.142 1
1 615 . 13 1 1 A 53 53 ALA C C 53 180.070 180.665 -0.595 1
1 616 . 13 1 1 A 53 53 ALA CA C 53 55.590 55.476 0.114 1
1 617 . 13 1 1 A 53 53 ALA CB C 53 18.800 18.000 0.800 1
1 618 . 13 1 1 A 53 53 ALA N N 53 123.450 122.598 0.852 1
1 619 . 13 1 1 A 54 54 VAL H H 54 8.030 7.722 0.308 1
1 620 . 13 1 1 A 54 54 VAL HA H 54 3.240 3.698 -0.458 1
1 628 . 13 1 1 A 54 54 VAL C C 54 177.340 177.826 -0.486 1
1 629 . 13 1 1 A 54 54 VAL CA C 54 66.620 65.938 0.682 1
1 630 . 13 1 1 A 54 54 VAL CB C 54 30.480 31.119 -0.639 1
1 633 . 13 1 1 A 54 54 VAL N N 54 116.150 117.387 -1.237 1
1 634 . 13 1 1 A 55 55 ASP H H 55 7.660 7.851 -0.191 1
1 635 . 13 1 1 A 55 55 ASP HA H 55 4.080 4.388 -0.308 1
1 638 . 13 1 1 A 55 55 ASP C C 55 177.260 179.328 -2.068 1
1 639 . 13 1 1 A 55 55 ASP CA C 55 57.640 57.336 0.304 1
1 640 . 13 1 1 A 55 55 ASP CB C 55 40.360 40.208 0.152 1
1 641 . 13 1 1 A 55 55 ASP N N 55 120.830 122.530 -1.700 1
1 642 . 13 1 1 A 56 56 LYS H H 56 7.780 7.538 0.242 1
1 643 . 13 1 1 A 56 56 LYS HA H 56 3.860 4.044 -0.184 1
1 652 . 13 1 1 A 56 56 LYS C C 56 179.530 179.396 0.134 1
1 653 . 13 1 1 A 56 56 LYS CA C 56 59.690 59.775 -0.085 1
1 654 . 13 1 1 A 56 56 LYS CB C 56 31.870 32.463 -0.593 1
1 658 . 13 1 1 A 56 56 LYS N N 56 120.010 118.978 1.032 1
1 659 . 13 1 1 A 57 57 ILE H H 57 8.090 7.864 0.226 1
1 660 . 13 1 1 A 57 57 ILE HA H 57 3.390 3.576 -0.186 1
1 670 . 13 1 1 A 57 57 ILE C C 57 176.710 177.559 -0.849 1
1 671 . 13 1 1 A 57 57 ILE CA C 57 64.960 65.332 -0.372 1
1 672 . 13 1 1 A 57 57 ILE CB C 57 38.080 38.273 -0.193 1
1 676 . 13 1 1 A 57 57 ILE N N 57 120.960 120.361 0.599 1
1 677 . 13 1 1 A 58 58 MET H H 58 8.480 8.304 0.176 1
1 678 . 13 1 1 A 58 58 MET HA H 58 3.800 4.190 -0.390 1
1 686 . 13 1 1 A 58 58 MET C C 58 177.570 178.158 -0.588 1
1 687 . 13 1 1 A 58 58 MET CA C 58 58.570 58.424 0.146 1
1 688 . 13 1 1 A 58 58 MET CB C 58 32.570 31.994 0.576 1
1 691 . 13 1 1 A 58 58 MET N N 58 119.160 120.782 -1.622 1
1 692 . 13 1 1 A 59 59 LYS H H 59 7.550 7.878 -0.328 1
1 693 . 13 1 1 A 59 59 LYS HA H 59 3.930 3.987 -0.057 1
1 702 . 13 1 1 A 59 59 LYS C C 59 179.530 179.753 -0.223 1
1 703 . 13 1 1 A 59 59 LYS CA C 59 58.820 60.076 -1.256 1
1 704 . 13 1 1 A 59 59 LYS CB C 59 32.450 32.181 0.269 1
1 708 . 13 1 1 A 59 59 LYS N N 59 116.730 118.938 -2.208 1
1 709 . 13 1 1 A 60 60 GLU H H 60 7.470 7.788 -0.318 1
1 710 . 13 1 1 A 60 60 GLU HA H 60 4.050 4.082 -0.032 1
1 715 . 13 1 1 A 60 60 GLU C C 60 178.950 177.758 1.192 1
1 716 . 13 1 1 A 60 60 GLU CA C 60 58.600 58.937 -0.337 1
1 717 . 13 1 1 A 60 60 GLU CB C 60 31.700 29.392 2.308 1
1 719 . 13 1 1 A 60 60 GLU N N 60 116.820 120.585 -3.765 1
1 720 . 13 1 1 A 61 61 LEU H H 61 8.030 7.886 0.144 1
1 721 . 13 1 1 A 61 61 LEU HA H 61 4.310 4.345 -0.035 1
1 731 . 13 1 1 A 61 61 LEU C C 61 179.450 177.734 1.716 1
1 732 . 13 1 1 A 61 61 LEU CA C 61 54.840 55.372 -0.532 1
1 733 . 13 1 1 A 61 61 LEU CB C 61 43.820 42.455 1.365 1
1 737 . 13 1 1 A 61 61 LEU N N 61 116.000 117.913 -1.913 1
1 738 . 13 1 1 A 62 62 ASP H H 62 7.890 8.830 -0.940 1
1 739 . 13 1 1 A 62 62 ASP HA H 62 4.660 4.653 0.007 1
1 742 . 13 1 1 A 62 62 ASP C C 62 177.030 176.961 0.069 1
1 743 . 13 1 1 A 62 62 ASP CA C 62 53.660 52.661 0.999 1
1 744 . 13 1 1 A 62 62 ASP CB C 62 38.700 39.043 -0.343 1
1 745 . 13 1 1 A 62 62 ASP N N 62 117.550 118.566 -1.016 1
1 746 . 13 1 1 A 63 63 GLU H H 63 8.430 9.705 -1.275 1
1 747 . 13 1 1 A 63 63 GLU HA H 63 4.020 4.044 -0.024 1
1 752 . 13 1 1 A 63 63 GLU C C 63 178.120 178.761 -0.641 1
1 753 . 13 1 1 A 63 63 GLU CA C 63 58.470 59.227 -0.757 1
1 754 . 13 1 1 A 63 63 GLU CB C 63 30.120 29.481 0.639 1
1 756 . 13 1 1 A 63 63 GLU N N 63 130.230 124.775 5.455 1
1 757 . 13 1 1 A 64 64 ASN H H 64 8.010 7.733 0.277 1
1 758 . 13 1 1 A 64 64 ASN HA H 64 4.680 4.808 -0.128 1
1 761 . 13 1 1 A 64 64 ASN C C 64 177.100 175.647 1.453 1
1 762 . 13 1 1 A 64 64 ASN CA C 64 51.780 53.397 -1.617 1
1 763 . 13 1 1 A 64 64 ASN CB C 64 37.260 39.175 -1.915 1
1 764 . 13 1 1 A 64 64 ASN N N 64 113.640 115.217 -1.577 1
1 765 . 13 1 1 A 65 65 GLY H H 65 7.550 7.901 -0.351 1
1 766 . 13 1 1 A 65 65 GLY HA2 H 65 3.770 3.975 -0.205 1
1 767 . 13 1 1 A 65 65 GLY HA3 H 65 3.770 3.976 -0.206 1
1 768 . 13 1 1 A 65 65 GLY C C 65 178.980 175.008 3.972 1
1 769 . 13 1 1 A 65 65 GLY CA C 65 47.200 46.512 0.688 1
1 770 . 13 1 1 A 65 65 GLY N N 65 113.640 107.352 6.288 1
1 771 . 13 1 1 A 66 66 ASP H H 66 8.110 8.225 -0.115 1
1 772 . 13 1 1 A 66 66 ASP HA H 66 4.490 4.605 -0.115 1
1 775 . 13 1 1 A 66 66 ASP C C 66 177.960 177.472 0.488 1
1 776 . 13 1 1 A 66 66 ASP CA C 66 52.960 53.611 -0.651 1
1 777 . 13 1 1 A 66 66 ASP CB C 66 40.540 40.698 -0.158 1
1 778 . 13 1 1 A 66 66 ASP N N 66 120.030 120.415 -0.385 1
1 779 . 13 1 1 A 67 67 GLY H H 67 10.260 9.825 0.435 1
1 780 . 13 1 1 A 67 67 GLY HA2 H 67 3.360 3.904 -0.544 1
1 781 . 13 1 1 A 67 67 GLY HA3 H 67 4.000 3.904 0.096 1
1 782 . 13 1 1 A 67 67 GLY C C 67 173.120 173.433 -0.313 1
1 783 . 13 1 1 A 67 67 GLY CA C 67 45.460 45.597 -0.137 1
1 784 . 13 1 1 A 67 67 GLY N N 67 114.100 111.066 3.034 1
1 785 . 13 1 1 A 68 68 GLU H H 68 7.750 7.741 0.009 1
1 786 . 13 1 1 A 68 68 GLU HA H 68 4.780 5.141 -0.361 1
1 791 . 13 1 1 A 68 68 GLU C C 68 175.930 174.876 1.054 1
1 792 . 13 1 1 A 68 68 GLU CA C 68 54.430 54.508 -0.078 1
1 793 . 13 1 1 A 68 68 GLU CB C 68 35.850 33.997 1.853 1
1 795 . 13 1 1 A 68 68 GLU N N 68 118.000 119.074 -1.074 1
1 796 . 13 1 1 A 69 69 VAL H H 69 9.380 8.554 0.826 1
1 797 . 13 1 1 A 69 69 VAL HA H 69 5.260 5.194 0.066 1
1 805 . 13 1 1 A 69 69 VAL C C 69 176.710 173.543 3.167 1
1 806 . 13 1 1 A 69 69 VAL CA C 69 61.280 60.843 0.437 1
1 807 . 13 1 1 A 69 69 VAL CB C 69 33.980 34.432 -0.452 1
1 810 . 13 1 1 A 69 69 VAL N N 69 125.970 120.972 4.998 1
1 811 . 13 1 1 A 70 70 ASP H H 70 9.100 8.631 0.469 1
1 812 . 13 1 1 A 70 70 ASP HA H 70 5.190 5.115 0.075 1
1 815 . 13 1 1 A 70 70 ASP C C 70 175.700 176.924 -1.224 1
1 816 . 13 1 1 A 70 70 ASP CA C 70 52.370 53.448 -1.078 1
1 817 . 13 1 1 A 70 70 ASP CB C 70 40.950 42.795 -1.845 1
1 818 . 13 1 1 A 70 70 ASP N N 70 130.320 127.183 3.137 1
1 819 . 13 1 1 A 71 71 PHE H H 71 9.090 9.401 -0.311 1
1 820 . 13 1 1 A 71 71 PHE HA H 71 4.100 4.303 -0.203 1
1 823 . 13 1 1 A 71 71 PHE C C 71 177.000 177.193 -0.193 1
1 824 . 13 1 1 A 71 71 PHE CA C 71 58.230 61.937 -3.707 1
1 825 . 13 1 1 A 71 71 PHE CB C 71 36.910 39.702 -2.792 1
1 826 . 13 1 1 A 71 71 PHE N N 71 119.760 127.636 -7.876 1
1 827 . 13 1 1 A 72 72 GLN H H 72 8.440 8.213 0.227 1
1 828 . 13 1 1 A 72 72 GLN HA H 72 3.600 3.981 -0.381 1
1 831 . 13 1 1 A 72 72 GLN C C 72 178.820 178.463 0.357 1
1 832 . 13 1 1 A 72 72 GLN CA C 72 59.500 58.566 0.934 1
1 833 . 13 1 1 A 72 72 GLN CB C 72 29.553 28.365 1.188 1
1 835 . 13 1 1 A 72 72 GLN N N 72 121.820 118.251 3.569 1
1 836 . 13 1 1 A 73 73 GLU H H 73 8.290 8.750 -0.460 1
1 837 . 13 1 1 A 73 73 GLU HA H 73 4.070 4.098 -0.028 1
1 842 . 13 1 1 A 73 73 GLU C C 73 179.370 178.884 0.486 1
1 843 . 13 1 1 A 73 73 GLU CA C 73 58.030 58.920 -0.890 1
1 844 . 13 1 1 A 73 73 GLU CB C 73 29.530 29.910 -0.380 1
1 846 . 13 1 1 A 73 73 GLU N N 73 120.550 120.682 -0.132 1
1 847 . 13 1 1 A 74 74 PHE H H 74 8.630 8.931 -0.301 1
1 848 . 13 1 1 A 74 74 PHE HA H 74 4.020 4.100 -0.080 1
1 851 . 13 1 1 A 74 74 PHE C C 74 177.890 177.051 0.839 1
1 852 . 13 1 1 A 74 74 PHE CA C 74 60.090 61.343 -1.253 1
1 853 . 13 1 1 A 74 74 PHE CB C 74 38.020 39.302 -1.282 1
1 854 . 13 1 1 A 74 74 PHE N N 74 121.010 121.723 -0.713 1
1 855 . 13 1 1 A 75 75 VAL H H 75 8.080 8.490 -0.410 1
1 856 . 13 1 1 A 75 75 VAL HA H 75 2.860 3.617 -0.757 1
1 864 . 13 1 1 A 75 75 VAL C C 75 177.030 178.316 -1.286 1
1 865 . 13 1 1 A 75 75 VAL CA C 75 66.430 66.625 -0.195 1
1 866 . 13 1 1 A 75 75 VAL CB C 75 30.600 31.160 -0.560 1
1 869 . 13 1 1 A 75 75 VAL N N 75 119.460 118.891 0.569 1
1 870 . 13 1 1 A 76 76 VAL H H 76 7.100 8.091 -0.991 1
1 871 . 13 1 1 A 76 76 VAL HA H 76 3.330 3.587 -0.257 1
1 879 . 13 1 1 A 76 76 VAL C C 76 178.670 178.554 0.116 1
1 880 . 13 1 1 A 76 76 VAL CA C 76 67.000 66.509 0.491 1
1 881 . 13 1 1 A 76 76 VAL CB C 76 31.280 31.746 -0.466 1
1 884 . 13 1 1 A 76 76 VAL N N 76 121.030 119.848 1.182 1
1 885 . 13 1 1 A 77 77 LEU H H 77 6.900 7.567 -0.667 1
1 886 . 13 1 1 A 77 77 LEU HA H 77 3.800 4.091 -0.291 1
1 896 . 13 1 1 A 77 77 LEU C C 77 177.960 178.542 -0.582 1
1 897 . 13 1 1 A 77 77 LEU CA C 77 57.710 57.642 0.068 1
1 898 . 13 1 1 A 77 77 LEU CB C 77 40.070 41.706 -1.636 1
1 902 . 13 1 1 A 77 77 LEU N N 77 120.310 121.687 -1.377 1
1 903 . 13 1 1 A 78 78 VAL H H 78 7.240 7.554 -0.314 1
1 904 . 13 1 1 A 78 78 VAL HA H 78 3.030 3.769 -0.739 1
1 912 . 13 1 1 A 78 78 VAL C C 78 179.600 178.130 1.470 1
1 913 . 13 1 1 A 78 78 VAL CA C 78 66.420 64.838 1.582 1
1 914 . 13 1 1 A 78 78 VAL CB C 78 30.700 31.417 -0.717 1
1 917 . 13 1 1 A 78 78 VAL N N 78 117.180 116.610 0.570 1
1 918 . 13 1 1 A 79 79 ALA H H 79 9.000 7.848 1.152 1
1 919 . 13 1 1 A 79 79 ALA HA H 79 3.610 4.140 -0.530 1
1 923 . 13 1 1 A 79 79 ALA C C 79 182.260 180.093 2.167 1
1 924 . 13 1 1 A 79 79 ALA CA C 79 55.580 55.266 0.314 1
1 925 . 13 1 1 A 79 79 ALA CB C 79 18.400 18.227 0.173 1
1 926 . 13 1 1 A 79 79 ALA N N 79 126.000 124.962 1.038 1
1 927 . 13 1 1 A 80 80 ALA H H 80 8.000 7.690 0.310 1
1 928 . 13 1 1 A 80 80 ALA HA H 80 4.100 4.064 0.036 1
1 932 . 13 1 1 A 80 80 ALA C C 80 175.460 179.355 -3.895 1
1 933 . 13 1 1 A 80 80 ALA CA C 80 56.020 54.571 1.449 1
1 934 . 13 1 1 A 80 80 ALA CB C 80 18.040 18.307 -0.267 1
1 935 . 13 1 1 A 80 80 ALA N N 80 120.730 120.990 -0.260 1
1 936 . 13 1 1 A 81 81 LEU H H 81 8.460 7.747 0.713 1
1 937 . 13 1 1 A 81 81 LEU HA H 81 4.000 4.007 -0.007 1
1 941 . 13 1 1 A 81 81 LEU C C 81 177.030 178.772 -1.742 1
1 942 . 13 1 1 A 81 81 LEU CA C 81 57.640 57.845 -0.205 1
1 943 . 13 1 1 A 81 81 LEU CB C 81 40.620 41.432 -0.812 1
1 945 . 13 1 1 A 81 81 LEU N N 81 119.890 117.468 2.422 1
1 946 . 13 1 1 A 82 82 THR H H 82 8.320 7.701 0.619 1
1 947 . 13 1 1 A 82 82 THR HA H 82 3.800 4.016 -0.216 1
1 952 . 13 1 1 A 82 82 THR C C 82 181.010 176.895 4.115 1
1 953 . 13 1 1 A 82 82 THR CA C 82 68.500 66.140 2.360 1
1 954 . 13 1 1 A 82 82 THR CB C 82 67.400 68.812 -1.412 1
1 956 . 13 1 1 A 82 82 THR N N 82 117.120 114.644 2.476 1
1 957 . 13 1 1 A 83 83 VAL H H 83 8.530 7.519 1.011 1
1 958 . 13 1 1 A 83 83 VAL HA H 83 3.890 3.833 0.057 1
1 966 . 13 1 1 A 83 83 VAL C C 83 178.120 178.200 -0.080 1
1 967 . 13 1 1 A 83 83 VAL CA C 83 67.400 65.110 2.290 1
1 968 . 13 1 1 A 83 83 VAL CB C 83 31.590 31.669 -0.079 1
1 971 . 13 1 1 A 83 83 VAL N N 83 119.760 117.915 1.845 1
1 972 . 13 1 1 A 84 84 ALA H H 84 7.910 8.291 -0.381 1
1 973 . 13 1 1 A 84 84 ALA HA H 84 4.060 4.100 -0.040 1
1 977 . 13 1 1 A 84 84 ALA C C 84 180.560 179.855 0.705 1
1 978 . 13 1 1 A 84 84 ALA CA C 84 55.000 55.162 -0.162 1
1 979 . 13 1 1 A 84 84 ALA CB C 84 17.230 18.189 -0.959 1
1 980 . 13 1 1 A 84 84 ALA N N 84 122.620 124.786 -2.166 1
1 981 . 13 1 1 A 85 85 CYS H H 85 8.580 8.035 0.545 1
1 982 . 13 1 1 A 85 85 CYS HA H 85 4.080 4.550 -0.470 1
1 985 . 13 1 1 A 85 85 CYS C C 85 179.060 177.061 1.999 1
1 986 . 13 1 1 A 85 85 CYS CA C 85 63.210 61.687 1.523 1
1 987 . 13 1 1 A 85 85 CYS CB C 85 26.310 27.213 -0.903 1
1 988 . 13 1 1 A 85 85 CYS N N 85 118.730 117.456 1.274 1
1 989 . 13 1 1 A 86 86 ASN H H 86 8.430 8.219 0.211 1
1 990 . 13 1 1 A 86 86 ASN CA C 86 55.860 56.863 -1.003 1
1 991 . 13 1 1 A 86 86 ASN CB C 86 37.440 40.121 -2.681 1
1 992 . 13 1 1 A 86 86 ASN N N 86 119.360 119.394 -0.034 1
1 993 . 13 1 1 A 87 87 ASN H H 87 7.880 7.862 0.018 1
1 994 . 13 1 1 A 87 87 ASN HA H 87 4.600 4.553 0.047 1
1 997 . 13 1 1 A 87 87 ASN C C 87 178.510 177.518 0.992 1
1 998 . 13 1 1 A 87 87 ASN CA C 87 56.470 56.409 0.061 1
1 999 . 13 1 1 A 87 87 ASN CB C 87 37.500 39.435 -1.935 1
1 1000 . 13 1 1 A 87 87 ASN N N 87 119.480 117.442 2.038 1
1 1001 . 13 1 1 A 88 88 PHE H H 88 8.050 7.614 0.436 1
1 1002 . 13 1 1 A 88 88 PHE HA H 88 4.200 4.370 -0.170 1
1 1005 . 13 1 1 A 88 88 PHE C C 88 178.510 177.391 1.119 1
1 1006 . 13 1 1 A 88 88 PHE CA C 88 56.460 59.837 -3.377 1
1 1007 . 13 1 1 A 88 88 PHE CB C 88 38.500 39.802 -1.302 1
1 1008 . 13 1 1 A 88 88 PHE N N 88 120.280 120.040 0.240 1
1 1009 . 13 1 1 A 89 89 PHE H H 89 8.020 8.116 -0.096 1
1 1010 . 13 1 1 A 89 89 PHE HA H 89 4.000 4.005 -0.005 1
1 1013 . 13 1 1 A 89 89 PHE C C 89 177.340 177.451 -0.111 1
1 1014 . 13 1 1 A 89 89 PHE CA C 89 59.000 59.732 -0.732 1
1 1015 . 13 1 1 A 89 89 PHE CB C 89 37.430 39.605 -2.175 1
1 1016 . 13 1 1 A 89 89 PHE N N 89 120.910 118.978 1.932 1
1 1017 . 13 1 1 A 90 90 TRP H H 90 7.800 8.078 -0.278 1
1 1018 . 13 1 1 A 90 90 TRP HA H 90 4.460 4.244 0.216 1
1 1021 . 13 1 1 A 90 90 TRP C C 90 177.340 178.704 -1.364 1
1 1022 . 13 1 1 A 90 90 TRP CA C 90 57.930 60.516 -2.586 1
1 1023 . 13 1 1 A 90 90 TRP CB C 90 42.000 29.857 12.143 1
1 1024 . 13 1 1 A 90 90 TRP N N 90 120.050 121.321 -1.271 1
1 1025 . 13 1 1 A 91 91 GLU H H 91 7.800 8.563 -0.763 1
1 1026 . 13 1 1 A 91 91 GLU HA H 91 4.050 3.801 0.249 1
1 1031 . 13 1 1 A 91 91 GLU C C 91 177.570 178.299 -0.729 1
1 1032 . 13 1 1 A 91 91 GLU CA C 91 57.350 59.457 -2.107 1
1 1033 . 13 1 1 A 91 91 GLU CB C 91 29.530 29.337 0.193 1
1 1035 . 13 1 1 A 91 91 GLU N N 91 120.730 117.685 3.045 1
1 1036 . 13 1 1 A 92 92 ASN H H 92 7.800 7.593 0.207 1
1 1037 . 13 1 1 A 92 92 ASN HA H 92 4.630 4.541 0.089 1
1 1040 . 13 1 1 A 92 92 ASN C C 92 174.450 174.117 0.333 1
1 1041 . 13 1 1 A 92 92 ASN CA C 92 52.960 52.421 0.539 1
1 1042 . 13 1 1 A 92 92 ASN CB C 92 29.530 38.092 -8.562 1
1 1043 . 13 1 1 A 92 92 ASN N N 92 119.410 115.310 4.100 1
1 5 . 14 1 1 A 2 2 SER H H 2 9.000 8.406 0.594 1
1 6 . 14 1 1 A 2 2 SER HA H 2 4.690 4.778 -0.088 1
1 9 . 14 1 1 A 2 2 SER C C 2 176.170 175.196 0.974 1
1 10 . 14 1 1 A 2 2 SER CA C 2 57.340 57.698 -0.358 1
1 11 . 14 1 1 A 2 2 SER CB C 2 65.550 63.688 1.862 1
1 12 . 14 1 1 A 2 2 SER N N 2 119.330 118.961 0.369 1
1 13 . 14 1 1 A 3 3 GLU H H 3 9.350 9.026 0.324 1
1 14 . 14 1 1 A 3 3 GLU HA H 3 4.060 4.050 0.010 1
1 17 . 14 1 1 A 3 3 GLU C C 3 180.150 179.577 0.573 1
1 18 . 14 1 1 A 3 3 GLU CA C 3 60.280 59.113 1.167 1
1 19 . 14 1 1 A 3 3 GLU CB C 3 29.230 29.362 -0.132 1
1 21 . 14 1 1 A 3 3 GLU N N 3 125.350 121.985 3.365 1
1 22 . 14 1 1 A 4 4 LEU H H 4 9.060 8.291 0.769 1
1 23 . 14 1 1 A 4 4 LEU HA H 4 4.080 4.004 0.076 1
1 33 . 14 1 1 A 4 4 LEU C C 4 177.890 179.124 -1.234 1
1 34 . 14 1 1 A 4 4 LEU CA C 4 58.090 57.969 0.121 1
1 35 . 14 1 1 A 4 4 LEU CB C 4 42.120 41.377 0.743 1
1 39 . 14 1 1 A 4 4 LEU N N 4 121.090 120.307 0.783 1
1 40 . 14 1 1 A 5 5 GLU H H 5 8.340 8.287 0.053 1
1 41 . 14 1 1 A 5 5 GLU HA H 5 4.050 4.023 0.027 1
1 46 . 14 1 1 A 5 5 GLU C C 5 177.030 179.339 -2.309 1
1 47 . 14 1 1 A 5 5 GLU CA C 5 59.840 59.515 0.325 1
1 48 . 14 1 1 A 5 5 GLU CB C 5 28.940 29.259 -0.319 1
1 50 . 14 1 1 A 5 5 GLU N N 5 119.780 120.293 -0.513 1
1 51 . 14 1 1 A 6 6 THR H H 6 8.370 8.035 0.335 1
1 52 . 14 1 1 A 6 6 THR HA H 6 4.310 3.907 0.403 1
1 57 . 14 1 1 A 6 6 THR C C 6 177.340 177.014 0.326 1
1 58 . 14 1 1 A 6 6 THR CA C 6 66.630 66.462 0.168 1
1 59 . 14 1 1 A 6 6 THR CB C 6 68.650 68.585 0.065 1
1 61 . 14 1 1 A 6 6 THR N N 6 116.940 117.169 -0.229 1
1 62 . 14 1 1 A 7 7 ALA H H 7 8.270 7.867 0.403 1
1 63 . 14 1 1 A 7 7 ALA HA H 7 4.190 4.099 0.091 1
1 67 . 14 1 1 A 7 7 ALA C C 7 179.760 179.808 -0.048 1
1 68 . 14 1 1 A 7 7 ALA CA C 7 55.880 54.924 0.956 1
1 69 . 14 1 1 A 7 7 ALA CB C 7 17.720 18.093 -0.373 1
1 70 . 14 1 1 A 7 7 ALA N N 7 127.400 124.260 3.140 1
1 71 . 14 1 1 A 8 8 MET H H 8 8.110 8.058 0.052 1
1 72 . 14 1 1 A 8 8 MET HA H 8 4.020 4.169 -0.149 1
1 80 . 14 1 1 A 8 8 MET C C 8 178.510 178.660 -0.150 1
1 81 . 14 1 1 A 8 8 MET CA C 8 60.580 58.428 2.152 1
1 82 . 14 1 1 A 8 8 MET CB C 8 33.630 32.414 1.216 1
1 85 . 14 1 1 A 8 8 MET N N 8 117.520 115.696 1.824 1
1 86 . 14 1 1 A 9 9 GLU H H 9 8.210 7.679 0.531 1
1 87 . 14 1 1 A 9 9 GLU HA H 9 3.830 4.123 -0.293 1
1 92 . 14 1 1 A 9 9 GLU C C 9 179.140 178.712 0.428 1
1 93 . 14 1 1 A 9 9 GLU CA C 9 59.690 59.343 0.347 1
1 94 . 14 1 1 A 9 9 GLU CB C 9 29.530 29.442 0.088 1
1 96 . 14 1 1 A 9 9 GLU N N 9 118.560 120.894 -2.334 1
1 97 . 14 1 1 A 10 10 THR H H 10 8.490 7.790 0.700 1
1 98 . 14 1 1 A 10 10 THR HA H 10 4.000 4.035 -0.035 1
1 103 . 14 1 1 A 10 10 THR C C 10 176.010 176.309 -0.299 1
1 104 . 14 1 1 A 10 10 THR CA C 10 67.110 65.709 1.401 1
1 105 . 14 1 1 A 10 10 THR CB C 10 67.770 69.166 -1.396 1
1 107 . 14 1 1 A 10 10 THR N N 10 118.310 116.005 2.305 1
1 108 . 14 1 1 A 11 11 LEU H H 11 7.920 7.774 0.146 1
1 109 . 14 1 1 A 11 11 LEU HA H 11 3.930 3.785 0.145 1
1 119 . 14 1 1 A 11 11 LEU C C 11 178.820 178.859 -0.039 1
1 120 . 14 1 1 A 11 11 LEU CA C 11 59.690 58.234 1.456 1
1 121 . 14 1 1 A 11 11 LEU CB C 11 41.920 41.889 0.031 1
1 125 . 14 1 1 A 11 11 LEU N N 11 121.150 120.923 0.227 1
1 126 . 14 1 1 A 12 12 ILE H H 12 7.440 7.795 -0.355 1
1 127 . 14 1 1 A 12 12 ILE HA H 12 3.640 3.901 -0.261 1
1 137 . 14 1 1 A 12 12 ILE C C 12 179.530 178.861 0.669 1
1 138 . 14 1 1 A 12 12 ILE CA C 12 63.740 64.923 -1.183 1
1 139 . 14 1 1 A 12 12 ILE CB C 12 38.800 37.463 1.337 1
1 143 . 14 1 1 A 12 12 ILE N N 12 118.010 120.059 -2.049 1
1 144 . 14 1 1 A 13 13 ASN H H 13 8.930 8.929 0.001 1
1 145 . 14 1 1 A 13 13 ASN HA H 13 4.520 4.598 -0.078 1
1 148 . 14 1 1 A 13 13 ASN C C 13 179.450 177.283 2.167 1
1 149 . 14 1 1 A 13 13 ASN CA C 13 56.470 56.452 0.018 1
1 150 . 14 1 1 A 13 13 ASN CB C 13 37.930 38.749 -0.819 1
1 151 . 14 1 1 A 13 13 ASN N N 13 121.820 120.712 1.108 1
1 152 . 14 1 1 A 14 14 VAL H H 14 9.180 7.917 1.263 1
1 153 . 14 1 1 A 14 14 VAL HA H 14 3.830 3.715 0.115 1
1 161 . 14 1 1 A 14 14 VAL CA C 14 65.840 65.183 0.657 1
1 162 . 14 1 1 A 14 14 VAL CB C 14 31.290 31.428 -0.138 1
1 165 . 14 1 1 A 14 14 VAL N N 14 122.040 118.170 3.870 1
1 166 . 14 1 1 A 15 15 PHE H H 15 7.590 7.719 -0.129 1
1 167 . 14 1 1 A 15 15 PHE HA H 15 3.360 3.884 -0.524 1
1 170 . 14 1 1 A 15 15 PHE C C 15 177.890 177.799 0.091 1
1 171 . 14 1 1 A 15 15 PHE CA C 15 62.030 60.002 2.028 1
1 172 . 14 1 1 A 15 15 PHE CB C 15 38.900 37.609 1.291 1
1 173 . 14 1 1 A 15 15 PHE N N 15 118.290 120.090 -1.800 1
1 174 . 14 1 1 A 16 16 HIS H H 16 7.790 7.559 0.231 1
1 175 . 14 1 1 A 16 16 HIS HA H 16 4.890 4.257 0.633 1
1 178 . 14 1 1 A 16 16 HIS C C 16 177.810 177.458 0.352 1
1 179 . 14 1 1 A 16 16 HIS CA C 16 59.100 59.851 -0.751 1
1 180 . 14 1 1 A 16 16 HIS CB C 16 28.060 29.275 -1.215 1
1 181 . 14 1 1 A 16 16 HIS N N 16 118.290 117.303 0.987 1
1 182 . 14 1 1 A 17 17 ALA H H 17 8.040 7.730 0.310 1
1 183 . 14 1 1 A 17 17 ALA HA H 17 4.050 3.898 0.152 1
1 187 . 14 1 1 A 17 17 ALA C C 17 179.600 179.757 -0.157 1
1 188 . 14 1 1 A 17 17 ALA CA C 17 54.000 55.222 -1.222 1
1 189 . 14 1 1 A 17 17 ALA CB C 17 17.520 18.476 -0.956 1
1 190 . 14 1 1 A 17 17 ALA N N 17 124.410 121.651 2.759 1
1 191 . 14 1 1 A 18 18 HIS H H 18 7.000 7.418 -0.418 1
1 192 . 14 1 1 A 18 18 HIS HA H 18 4.330 4.420 -0.090 1
1 195 . 14 1 1 A 18 18 HIS C C 18 176.320 178.210 -1.890 1
1 196 . 14 1 1 A 18 18 HIS CA C 18 57.350 59.190 -1.840 1
1 197 . 14 1 1 A 18 18 HIS CB C 18 32.920 30.454 2.466 1
1 198 . 14 1 1 A 18 18 HIS N N 18 115.160 116.010 -0.850 1
1 199 . 14 1 1 A 19 19 SER H H 19 8.380 8.500 -0.120 1
1 200 . 14 1 1 A 19 19 SER HA H 19 3.640 4.433 -0.793 1
1 203 . 14 1 1 A 19 19 SER C C 19 177.340 176.142 1.198 1
1 204 . 14 1 1 A 19 19 SER CA C 19 60.160 61.352 -1.192 1
1 205 . 14 1 1 A 19 19 SER CB C 19 61.000 62.302 -1.302 1
1 206 . 14 1 1 A 19 19 SER N N 19 114.380 116.108 -1.728 1
1 207 . 14 1 1 A 20 20 GLY H H 20 7.600 7.857 -0.257 1
1 208 . 14 1 1 A 20 20 GLY HA2 H 20 3.680 3.908 -0.228 1
1 209 . 14 1 1 A 20 20 GLY HA3 H 20 4.000 3.923 0.077 1
1 210 . 14 1 1 A 20 20 GLY C C 20 174.140 174.353 -0.213 1
1 211 . 14 1 1 A 20 20 GLY CA C 20 47.000 45.292 1.708 1
1 212 . 14 1 1 A 20 20 GLY N N 20 112.550 108.880 3.670 1
1 213 . 14 1 1 A 21 21 LYS H H 21 7.230 7.862 -0.632 1
1 214 . 14 1 1 A 21 21 LYS HA H 21 3.860 4.626 -0.766 1
1 223 . 14 1 1 A 21 21 LYS C C 21 177.730 177.133 0.597 1
1 224 . 14 1 1 A 21 21 LYS CA C 21 59.110 57.545 1.565 1
1 225 . 14 1 1 A 21 21 LYS CB C 21 32.460 34.975 -2.515 1
1 229 . 14 1 1 A 21 21 LYS N N 21 123.240 119.344 3.896 1
1 230 . 14 1 1 A 22 22 GLU H H 22 9.350 7.877 1.473 1
1 231 . 14 1 1 A 22 22 GLU HA H 22 4.610 4.361 0.249 1
1 236 . 14 1 1 A 22 22 GLU C C 22 177.420 176.134 1.286 1
1 237 . 14 1 1 A 22 22 GLU CA C 22 53.700 56.492 -2.792 1
1 238 . 14 1 1 A 22 22 GLU CB C 22 32.000 27.780 4.220 1
1 240 . 14 1 1 A 22 22 GLU N N 22 116.770 118.618 -1.848 1
1 241 . 14 1 1 A 23 23 GLY H H 23 7.570 7.776 -0.206 1
1 242 . 14 1 1 A 23 23 GLY HA2 H 23 3.630 4.140 -0.510 1
1 243 . 14 1 1 A 23 23 GLY HA3 H 23 3.880 4.144 -0.264 1
1 244 . 14 1 1 A 23 23 GLY C C 23 173.980 171.682 2.298 1
1 245 . 14 1 1 A 23 23 GLY CA C 23 45.250 45.857 -0.607 1
1 246 . 14 1 1 A 23 23 GLY N N 23 112.180 108.325 3.855 1
1 247 . 14 1 1 A 24 24 ASP H H 24 8.680 8.382 0.298 1
1 248 . 14 1 1 A 24 24 ASP HA H 24 4.380 4.779 -0.399 1
1 251 . 14 1 1 A 24 24 ASP C C 24 178.590 177.894 0.696 1
1 252 . 14 1 1 A 24 24 ASP CA C 24 60.000 53.769 6.231 1
1 253 . 14 1 1 A 24 24 ASP CB C 24 27.480 41.788 -14.308 1
1 254 . 14 1 1 A 24 24 ASP N N 24 127.470 123.472 3.998 1
1 255 . 14 1 1 A 25 25 LYS H H 25 9.270 8.793 0.477 1
1 256 . 14 1 1 A 25 25 LYS HA H 25 4.250 3.761 0.489 1
1 265 . 14 1 1 A 25 25 LYS C C 25 177.030 177.053 -0.023 1
1 266 . 14 1 1 A 25 25 LYS CA C 25 60.000 60.015 -0.015 1
1 267 . 14 1 1 A 25 25 LYS CB C 25 31.170 32.179 -1.009 1
1 271 . 14 1 1 A 25 25 LYS N N 25 132.960 122.666 10.294 1
1 272 . 14 1 1 A 26 26 TYR H H 26 9.430 7.963 1.467 1
1 273 . 14 1 1 A 26 26 TYR HA H 26 4.640 4.845 -0.205 1
1 276 . 14 1 1 A 26 26 TYR C C 26 174.290 174.911 -0.621 1
1 277 . 14 1 1 A 26 26 TYR CA C 26 56.010 57.144 -1.134 1
1 278 . 14 1 1 A 26 26 TYR CB C 26 37.730 38.533 -0.803 1
1 279 . 14 1 1 A 26 26 TYR N N 26 120.650 114.163 6.487 1
1 280 . 14 1 1 A 27 27 LYS H H 27 7.110 7.479 -0.369 1
1 281 . 14 1 1 A 27 27 LYS HA H 27 5.110 4.935 0.175 1
1 290 . 14 1 1 A 27 27 LYS C C 27 175.150 174.002 1.148 1
1 291 . 14 1 1 A 27 27 LYS CA C 27 55.070 55.378 -0.308 1
1 292 . 14 1 1 A 27 27 LYS CB C 27 38.900 36.204 2.696 1
1 296 . 14 1 1 A 27 27 LYS N N 27 115.830 120.463 -4.633 1
1 297 . 14 1 1 A 28 28 LEU H H 28 9.820 8.516 1.304 1
1 298 . 14 1 1 A 28 28 LEU HA H 28 5.080 5.077 0.003 1
1 308 . 14 1 1 A 28 28 LEU C C 28 176.640 175.673 0.967 1
1 309 . 14 1 1 A 28 28 LEU CA C 28 52.660 53.914 -1.254 1
1 310 . 14 1 1 A 28 28 LEU CB C 28 42.710 44.151 -1.441 1
1 314 . 14 1 1 A 28 28 LEU N N 28 126.930 128.340 -1.410 1
1 315 . 14 1 1 A 29 29 SER H H 29 9.890 8.546 1.344 1
1 316 . 14 1 1 A 29 29 SER HA H 29 4.530 4.956 -0.426 1
1 319 . 14 1 1 A 29 29 SER C C 29 174.990 174.821 0.169 1
1 320 . 14 1 1 A 29 29 SER CA C 29 56.180 57.154 -0.974 1
1 321 . 14 1 1 A 29 29 SER CB C 29 65.550 67.245 -1.695 1
1 322 . 14 1 1 A 29 29 SER N N 29 121.600 119.623 1.977 1
1 323 . 14 1 1 A 30 30 LYS H H 30 8.850 8.880 -0.030 1
1 324 . 14 1 1 A 30 30 LYS HA H 30 3.850 3.979 -0.129 1
1 333 . 14 1 1 A 30 30 LYS C C 30 175.620 177.556 -1.936 1
1 334 . 14 1 1 A 30 30 LYS CA C 30 60.860 60.168 0.692 1
1 335 . 14 1 1 A 30 30 LYS CB C 30 31.290 32.124 -0.834 1
1 339 . 14 1 1 A 30 30 LYS N N 30 121.260 124.689 -3.429 1
1 340 . 14 1 1 A 31 31 LYS H H 31 7.970 7.955 0.015 1
1 341 . 14 1 1 A 31 31 LYS HA H 31 3.880 4.118 -0.238 1
1 350 . 14 1 1 A 31 31 LYS C C 31 179.290 179.431 -0.141 1
1 351 . 14 1 1 A 31 31 LYS CA C 31 59.110 59.243 -0.133 1
1 352 . 14 1 1 A 31 31 LYS CB C 31 32.640 31.703 0.937 1
1 356 . 14 1 1 A 31 31 LYS N N 31 121.260 118.661 2.599 1
1 357 . 14 1 1 A 32 32 GLU H H 32 7.510 8.019 -0.509 1
1 358 . 14 1 1 A 32 32 GLU HA H 32 3.830 4.397 -0.567 1
1 363 . 14 1 1 A 32 32 GLU C C 32 179.290 179.760 -0.470 1
1 364 . 14 1 1 A 32 32 GLU CA C 32 58.590 59.035 -0.445 1
1 365 . 14 1 1 A 32 32 GLU CB C 32 30.120 29.908 0.212 1
1 367 . 14 1 1 A 32 32 GLU N N 32 120.090 119.241 0.849 1
1 368 . 14 1 1 A 33 33 LEU H H 33 8.970 7.830 1.140 1
1 369 . 14 1 1 A 33 33 LEU HA H 33 3.830 4.265 -0.435 1
1 379 . 14 1 1 A 33 33 LEU C C 33 178.200 178.693 -0.493 1
1 380 . 14 1 1 A 33 33 LEU CA C 33 57.930 58.187 -0.257 1
1 381 . 14 1 1 A 33 33 LEU CB C 33 40.660 41.498 -0.838 1
1 385 . 14 1 1 A 33 33 LEU N N 33 120.200 119.461 0.739 1
1 386 . 14 1 1 A 34 34 LYS H H 34 8.230 7.733 0.497 1
1 387 . 14 1 1 A 34 34 LYS HA H 34 3.550 3.865 -0.315 1
1 396 . 14 1 1 A 34 34 LYS C C 34 178.040 178.822 -0.782 1
1 397 . 14 1 1 A 34 34 LYS CA C 34 60.720 60.314 0.406 1
1 398 . 14 1 1 A 34 34 LYS CB C 34 31.980 32.095 -0.115 1
1 402 . 14 1 1 A 34 34 LYS N N 34 120.780 119.585 1.195 1
1 403 . 14 1 1 A 35 35 ASP H H 35 7.990 7.954 0.036 1
1 404 . 14 1 1 A 35 35 ASP HA H 35 4.250 4.405 -0.155 1
1 407 . 14 1 1 A 35 35 ASP C C 35 179.060 178.679 0.381 1
1 408 . 14 1 1 A 35 35 ASP CA C 35 56.830 56.837 -0.007 1
1 409 . 14 1 1 A 35 35 ASP CB C 35 40.440 39.992 0.448 1
1 410 . 14 1 1 A 35 35 ASP N N 35 119.550 119.666 -0.116 1
1 411 . 14 1 1 A 36 36 LEU H H 36 8.130 7.681 0.449 1
1 412 . 14 1 1 A 36 36 LEU HA H 36 2.580 3.558 -0.978 1
1 422 . 14 1 1 A 36 36 LEU C C 36 179.450 178.224 1.226 1
1 423 . 14 1 1 A 36 36 LEU CA C 36 59.980 58.156 1.824 1
1 424 . 14 1 1 A 36 36 LEU CB C 36 42.180 41.660 0.520 1
1 428 . 14 1 1 A 36 36 LEU N N 36 125.560 122.829 2.731 1
1 429 . 14 1 1 A 37 37 LEU H H 37 8.740 8.117 0.623 1
1 430 . 14 1 1 A 37 37 LEU HA H 37 3.580 3.929 -0.349 1
1 440 . 14 1 1 A 37 37 LEU C C 37 179.290 179.143 0.147 1
1 441 . 14 1 1 A 37 37 LEU CA C 37 58.230 58.140 0.090 1
1 442 . 14 1 1 A 37 37 LEU CB C 37 41.590 40.871 0.719 1
1 446 . 14 1 1 A 37 37 LEU N N 37 120.520 118.643 1.877 1
1 447 . 14 1 1 A 38 38 GLN H H 38 8.520 7.886 0.634 1
1 448 . 14 1 1 A 38 38 GLN HA H 38 4.000 3.983 0.017 1
1 453 . 14 1 1 A 38 38 GLN C C 38 177.960 178.514 -0.554 1
1 454 . 14 1 1 A 38 38 GLN CA C 38 58.210 58.986 -0.776 1
1 455 . 14 1 1 A 38 38 GLN CB C 38 28.650 28.238 0.412 1
1 457 . 14 1 1 A 38 38 GLN N N 38 116.740 118.833 -2.093 1
1 458 . 14 1 1 A 39 39 THR H H 39 7.910 8.204 -0.294 1
1 459 . 14 1 1 A 39 39 THR HA H 39 4.210 3.782 0.428 1
1 464 . 14 1 1 A 39 39 THR C C 39 177.180 175.752 1.428 1
1 465 . 14 1 1 A 39 39 THR CA C 39 64.730 67.184 -2.454 1
1 466 . 14 1 1 A 39 39 THR CB C 39 69.650 68.691 0.959 1
1 468 . 14 1 1 A 39 39 THR N N 39 111.400 117.355 -5.955 1
1 469 . 14 1 1 A 40 40 GLU H H 40 8.590 7.320 1.270 1
1 470 . 14 1 1 A 40 40 GLU HA H 40 4.680 4.408 0.272 1
1 475 . 14 1 1 A 40 40 GLU C C 40 178.280 176.814 1.466 1
1 476 . 14 1 1 A 40 40 GLU CA C 40 55.880 56.608 -0.728 1
1 477 . 14 1 1 A 40 40 GLU CB C 40 30.990 30.536 0.454 1
1 479 . 14 1 1 A 40 40 GLU N N 40 117.840 116.727 1.113 1
1 480 . 14 1 1 A 41 41 LEU H H 41 7.680 7.675 0.005 1
1 481 . 14 1 1 A 41 41 LEU HA H 41 5.080 4.735 0.345 1
1 491 . 14 1 1 A 41 41 LEU C C 41 179.450 176.487 2.963 1
1 492 . 14 1 1 A 41 41 LEU CA C 41 53.830 53.469 0.361 1
1 493 . 14 1 1 A 41 41 LEU CB C 41 41.360 42.683 -1.323 1
1 497 . 14 1 1 A 41 41 LEU N N 41 121.410 120.128 1.282 1
1 498 . 14 1 1 A 42 42 SER H H 42 8.380 8.327 0.053 1
1 499 . 14 1 1 A 42 42 SER HA H 42 4.130 4.222 -0.092 1
1 502 . 14 1 1 A 42 42 SER C C 42 176.640 176.741 -0.101 1
1 503 . 14 1 1 A 42 42 SER CA C 42 61.280 61.581 -0.301 1
1 504 . 14 1 1 A 42 42 SER CB C 42 63.040 62.424 0.616 1
1 505 . 14 1 1 A 42 42 SER N N 42 117.420 115.946 1.474 1
1 506 . 14 1 1 A 43 43 SER H H 43 8.900 7.977 0.923 1
1 507 . 14 1 1 A 43 43 SER HA H 43 4.290 4.265 0.025 1
1 510 . 14 1 1 A 43 43 SER C C 43 175.620 177.254 -1.634 1
1 511 . 14 1 1 A 43 43 SER CA C 43 60.860 61.460 -0.600 1
1 512 . 14 1 1 A 43 43 SER CB C 43 62.910 62.757 0.153 1
1 513 . 14 1 1 A 43 43 SER N N 43 117.580 116.959 0.621 1
1 514 . 14 1 1 A 44 44 PHE H H 44 7.880 8.016 -0.136 1
1 515 . 14 1 1 A 44 44 PHE HA H 44 4.240 4.207 0.033 1
1 518 . 14 1 1 A 44 44 PHE C C 44 176.950 175.632 1.318 1
1 519 . 14 1 1 A 44 44 PHE CA C 44 62.710 61.503 1.207 1
1 520 . 14 1 1 A 44 44 PHE CB C 44 39.020 38.923 0.097 1
1 521 . 14 1 1 A 44 44 PHE N N 44 119.480 121.960 -2.480 1
1 522 . 14 1 1 A 45 45 LEU H H 45 8.060 8.118 -0.058 1
1 523 . 14 1 1 A 45 45 LEU HA H 45 3.810 3.970 -0.160 1
1 533 . 14 1 1 A 45 45 LEU C C 45 177.500 175.691 1.809 1
1 534 . 14 1 1 A 45 45 LEU CA C 45 59.980 55.830 4.150 1
1 535 . 14 1 1 A 45 45 LEU CB C 45 39.640 42.463 -2.823 1
1 538 . 14 1 1 A 45 45 LEU N N 45 118.010 121.575 -3.565 1
1 539 . 14 1 1 A 46 46 ASP H H 46 8.150 8.556 -0.406 1
1 540 . 14 1 1 A 46 46 ASP HA H 46 4.470 4.949 -0.479 1
1 543 . 14 1 1 A 46 46 ASP C C 46 179.920 176.229 3.691 1
1 544 . 14 1 1 A 46 46 ASP CA C 46 52.950 52.944 0.006 1
1 545 . 14 1 1 A 46 46 ASP CB C 46 40.000 41.504 -1.504 1
1 546 . 14 1 1 A 46 46 ASP N N 46 119.460 124.152 -4.692 1
1 547 . 14 1 1 A 47 47 VAL H H 47 8.010 8.462 -0.452 1
1 548 . 14 1 1 A 47 47 VAL HA H 47 3.800 4.400 -0.600 1
1 556 . 14 1 1 A 47 47 VAL C C 47 175.460 177.031 -1.571 1
1 557 . 14 1 1 A 47 47 VAL CA C 47 60.000 62.396 -2.396 1
1 558 . 14 1 1 A 47 47 VAL CB C 47 31.580 33.866 -2.286 1
1 561 . 14 1 1 A 47 47 VAL N N 47 117.720 119.101 -1.381 1
1 562 . 14 1 1 A 48 48 GLN H H 48 7.960 8.030 -0.070 1
1 563 . 14 1 1 A 48 48 GLN HA H 48 4.060 4.233 -0.173 1
1 568 . 14 1 1 A 48 48 GLN C C 48 179.370 178.579 0.791 1
1 569 . 14 1 1 A 48 48 GLN CA C 48 57.350 58.032 -0.682 1
1 570 . 14 1 1 A 48 48 GLN CB C 48 28.990 29.151 -0.161 1
1 572 . 14 1 1 A 48 48 GLN N N 48 119.900 121.738 -1.838 1
1 573 . 14 1 1 A 49 49 LYS H H 49 7.810 7.927 -0.117 1
1 574 . 14 1 1 A 49 49 LYS HA H 49 3.860 4.148 -0.288 1
1 583 . 14 1 1 A 49 49 LYS C C 49 177.890 176.374 1.516 1
1 584 . 14 1 1 A 49 49 LYS CA C 49 58.230 58.757 -0.527 1
1 585 . 14 1 1 A 49 49 LYS CB C 49 30.990 32.483 -1.493 1
1 587 . 14 1 1 A 49 49 LYS N N 49 120.030 119.855 0.175 1
1 588 . 14 1 1 A 50 50 ASP H H 50 7.570 7.855 -0.285 1
1 589 . 14 1 1 A 50 50 ASP HA H 50 4.700 4.815 -0.115 1
1 590 . 14 1 1 A 50 50 ASP CA C 50 52.950 52.990 -0.040 1
1 591 . 14 1 1 A 50 50 ASP CB C 50 38.900 41.074 -2.174 1
1 592 . 14 1 1 A 50 50 ASP N N 50 116.730 119.785 -3.055 1
1 593 . 14 1 1 A 51 51 ALA H H 51 7.570 8.771 -1.201 1
1 594 . 14 1 1 A 51 51 ALA HA H 51 4.200 4.009 0.191 1
1 598 . 14 1 1 A 51 51 ALA C C 51 179.760 179.127 0.633 1
1 599 . 14 1 1 A 51 51 ALA CA C 51 54.200 55.376 -1.176 1
1 600 . 14 1 1 A 51 51 ALA CB C 51 18.110 18.335 -0.225 1
1 601 . 14 1 1 A 51 51 ALA N N 51 118.390 127.239 -8.849 1
1 602 . 14 1 1 A 52 52 ASP H H 52 8.430 8.371 0.059 1
1 603 . 14 1 1 A 52 52 ASP HA H 52 4.600 4.336 0.264 1
1 606 . 14 1 1 A 52 52 ASP C C 52 177.570 178.369 -0.799 1
1 607 . 14 1 1 A 52 52 ASP CA C 52 54.420 56.741 -2.321 1
1 608 . 14 1 1 A 52 52 ASP CB C 52 40.360 40.108 0.252 1
1 609 . 14 1 1 A 52 52 ASP N N 52 117.530 119.669 -2.139 1
1 610 . 14 1 1 A 53 53 ALA H H 53 7.660 7.649 0.011 1
1 611 . 14 1 1 A 53 53 ALA HA H 53 3.860 3.986 -0.126 1
1 615 . 14 1 1 A 53 53 ALA C C 53 180.070 180.403 -0.333 1
1 616 . 14 1 1 A 53 53 ALA CA C 53 55.590 55.422 0.168 1
1 617 . 14 1 1 A 53 53 ALA CB C 53 18.800 17.989 0.811 1
1 618 . 14 1 1 A 53 53 ALA N N 53 123.450 122.604 0.846 1
1 619 . 14 1 1 A 54 54 VAL H H 54 8.030 7.894 0.136 1
1 620 . 14 1 1 A 54 54 VAL HA H 54 3.240 3.557 -0.317 1
1 628 . 14 1 1 A 54 54 VAL C C 54 177.340 177.340 0.000 1
1 629 . 14 1 1 A 54 54 VAL CA C 54 66.620 66.414 0.206 1
1 630 . 14 1 1 A 54 54 VAL CB C 54 30.480 31.168 -0.688 1
1 633 . 14 1 1 A 54 54 VAL N N 54 116.150 117.949 -1.799 1
1 634 . 14 1 1 A 55 55 ASP H H 55 7.660 8.070 -0.410 1
1 635 . 14 1 1 A 55 55 ASP HA H 55 4.080 4.285 -0.205 1
1 638 . 14 1 1 A 55 55 ASP C C 55 177.260 178.443 -1.183 1
1 639 . 14 1 1 A 55 55 ASP CA C 55 57.640 57.508 0.132 1
1 640 . 14 1 1 A 55 55 ASP CB C 55 40.360 42.033 -1.673 1
1 641 . 14 1 1 A 55 55 ASP N N 55 120.830 121.319 -0.489 1
1 642 . 14 1 1 A 56 56 LYS H H 56 7.780 7.538 0.242 1
1 643 . 14 1 1 A 56 56 LYS HA H 56 3.860 4.025 -0.165 1
1 652 . 14 1 1 A 56 56 LYS C C 56 179.530 179.399 0.131 1
1 653 . 14 1 1 A 56 56 LYS CA C 56 59.690 59.750 -0.060 1
1 654 . 14 1 1 A 56 56 LYS CB C 56 31.870 32.436 -0.566 1
1 658 . 14 1 1 A 56 56 LYS N N 56 120.010 118.561 1.449 1
1 659 . 14 1 1 A 57 57 ILE H H 57 8.090 7.794 0.296 1
1 660 . 14 1 1 A 57 57 ILE HA H 57 3.390 3.549 -0.159 1
1 670 . 14 1 1 A 57 57 ILE C C 57 176.710 177.678 -0.968 1
1 671 . 14 1 1 A 57 57 ILE CA C 57 64.960 65.108 -0.148 1
1 672 . 14 1 1 A 57 57 ILE CB C 57 38.080 38.252 -0.172 1
1 676 . 14 1 1 A 57 57 ILE N N 57 120.960 120.230 0.730 1
1 677 . 14 1 1 A 58 58 MET H H 58 8.480 8.352 0.128 1
1 678 . 14 1 1 A 58 58 MET HA H 58 3.800 3.996 -0.196 1
1 686 . 14 1 1 A 58 58 MET C C 58 177.570 177.929 -0.359 1
1 687 . 14 1 1 A 58 58 MET CA C 58 58.570 58.413 0.157 1
1 688 . 14 1 1 A 58 58 MET CB C 58 32.570 31.617 0.953 1
1 691 . 14 1 1 A 58 58 MET N N 58 119.160 120.651 -1.491 1
1 692 . 14 1 1 A 59 59 LYS H H 59 7.550 7.889 -0.339 1
1 693 . 14 1 1 A 59 59 LYS HA H 59 3.930 3.917 0.013 1
1 702 . 14 1 1 A 59 59 LYS C C 59 179.530 179.390 0.140 1
1 703 . 14 1 1 A 59 59 LYS CA C 59 58.820 59.512 -0.692 1
1 704 . 14 1 1 A 59 59 LYS CB C 59 32.450 32.207 0.243 1
1 708 . 14 1 1 A 59 59 LYS N N 59 116.730 119.711 -2.981 1
1 709 . 14 1 1 A 60 60 GLU H H 60 7.470 7.648 -0.178 1
1 710 . 14 1 1 A 60 60 GLU HA H 60 4.050 4.084 -0.034 1
1 715 . 14 1 1 A 60 60 GLU C C 60 178.950 178.235 0.715 1
1 716 . 14 1 1 A 60 60 GLU CA C 60 58.600 58.888 -0.288 1
1 717 . 14 1 1 A 60 60 GLU CB C 60 31.700 29.520 2.180 1
1 719 . 14 1 1 A 60 60 GLU N N 60 116.820 118.971 -2.151 1
1 720 . 14 1 1 A 61 61 LEU H H 61 8.030 7.683 0.347 1
1 721 . 14 1 1 A 61 61 LEU HA H 61 4.310 4.204 0.106 1
1 731 . 14 1 1 A 61 61 LEU C C 61 179.450 177.894 1.556 1
1 732 . 14 1 1 A 61 61 LEU CA C 61 54.840 56.436 -1.596 1
1 733 . 14 1 1 A 61 61 LEU CB C 61 43.820 42.050 1.770 1
1 737 . 14 1 1 A 61 61 LEU N N 61 116.000 119.079 -3.079 1
1 738 . 14 1 1 A 62 62 ASP H H 62 7.890 8.549 -0.659 1
1 739 . 14 1 1 A 62 62 ASP HA H 62 4.660 4.618 0.042 1
1 742 . 14 1 1 A 62 62 ASP C C 62 177.030 176.934 0.096 1
1 743 . 14 1 1 A 62 62 ASP CA C 62 53.660 52.626 1.034 1
1 744 . 14 1 1 A 62 62 ASP CB C 62 38.700 39.011 -0.311 1
1 745 . 14 1 1 A 62 62 ASP N N 62 117.550 118.472 -0.922 1
1 746 . 14 1 1 A 63 63 GLU H H 63 8.430 9.734 -1.304 1
1 747 . 14 1 1 A 63 63 GLU HA H 63 4.020 4.021 -0.001 1
1 752 . 14 1 1 A 63 63 GLU C C 63 178.120 178.883 -0.763 1
1 753 . 14 1 1 A 63 63 GLU CA C 63 58.470 59.255 -0.785 1
1 754 . 14 1 1 A 63 63 GLU CB C 63 30.120 29.319 0.801 1
1 756 . 14 1 1 A 63 63 GLU N N 63 130.230 124.754 5.476 1
1 757 . 14 1 1 A 64 64 ASN H H 64 8.010 7.783 0.227 1
1 758 . 14 1 1 A 64 64 ASN HA H 64 4.680 4.778 -0.098 1
1 761 . 14 1 1 A 64 64 ASN C C 64 177.100 175.500 1.600 1
1 762 . 14 1 1 A 64 64 ASN CA C 64 51.780 53.321 -1.541 1
1 763 . 14 1 1 A 64 64 ASN CB C 64 37.260 39.065 -1.805 1
1 764 . 14 1 1 A 64 64 ASN N N 64 113.640 115.221 -1.581 1
1 765 . 14 1 1 A 65 65 GLY H H 65 7.550 8.039 -0.489 1
1 766 . 14 1 1 A 65 65 GLY HA2 H 65 3.770 3.949 -0.179 1
1 767 . 14 1 1 A 65 65 GLY HA3 H 65 3.770 3.951 -0.181 1
1 768 . 14 1 1 A 65 65 GLY C C 65 178.980 174.023 4.957 1
1 769 . 14 1 1 A 65 65 GLY CA C 65 47.200 46.047 1.153 1
1 770 . 14 1 1 A 65 65 GLY N N 65 113.640 107.273 6.367 1
1 771 . 14 1 1 A 66 66 ASP H H 66 8.110 8.173 -0.063 1
1 772 . 14 1 1 A 66 66 ASP HA H 66 4.490 5.030 -0.540 1
1 775 . 14 1 1 A 66 66 ASP C C 66 177.960 175.635 2.325 1
1 776 . 14 1 1 A 66 66 ASP CA C 66 52.960 53.274 -0.314 1
1 777 . 14 1 1 A 66 66 ASP CB C 66 40.540 41.491 -0.951 1
1 778 . 14 1 1 A 66 66 ASP N N 66 120.030 119.530 0.500 1
1 779 . 14 1 1 A 67 67 GLY H H 67 10.260 8.058 2.202 1
1 780 . 14 1 1 A 67 67 GLY HA2 H 67 3.360 4.143 -0.783 1
1 781 . 14 1 1 A 67 67 GLY HA3 H 67 4.000 4.147 -0.147 1
1 782 . 14 1 1 A 67 67 GLY C C 67 173.120 173.351 -0.231 1
1 783 . 14 1 1 A 67 67 GLY CA C 67 45.460 45.720 -0.260 1
1 784 . 14 1 1 A 67 67 GLY N N 67 114.100 109.588 4.512 1
1 785 . 14 1 1 A 68 68 GLU H H 68 7.750 7.760 -0.010 1
1 786 . 14 1 1 A 68 68 GLU HA H 68 4.780 4.938 -0.158 1
1 791 . 14 1 1 A 68 68 GLU C C 68 175.930 175.173 0.757 1
1 792 . 14 1 1 A 68 68 GLU CA C 68 54.430 54.522 -0.092 1
1 793 . 14 1 1 A 68 68 GLU CB C 68 35.850 33.727 2.123 1
1 795 . 14 1 1 A 68 68 GLU N N 68 118.000 119.475 -1.475 1
1 796 . 14 1 1 A 69 69 VAL H H 69 9.380 8.346 1.034 1
1 797 . 14 1 1 A 69 69 VAL HA H 69 5.260 5.061 0.199 1
1 805 . 14 1 1 A 69 69 VAL C C 69 176.710 174.717 1.993 1
1 806 . 14 1 1 A 69 69 VAL CA C 69 61.280 60.763 0.517 1
1 807 . 14 1 1 A 69 69 VAL CB C 69 33.980 34.922 -0.942 1
1 810 . 14 1 1 A 69 69 VAL N N 69 125.970 120.927 5.043 1
1 811 . 14 1 1 A 70 70 ASP H H 70 9.100 9.062 0.038 1
1 812 . 14 1 1 A 70 70 ASP HA H 70 5.190 4.926 0.264 1
1 815 . 14 1 1 A 70 70 ASP C C 70 175.700 178.010 -2.310 1
1 816 . 14 1 1 A 70 70 ASP CA C 70 52.370 52.935 -0.565 1
1 817 . 14 1 1 A 70 70 ASP CB C 70 40.950 41.884 -0.934 1
1 818 . 14 1 1 A 70 70 ASP N N 70 130.320 126.846 3.474 1
1 819 . 14 1 1 A 71 71 PHE H H 71 9.090 9.046 0.044 1
1 820 . 14 1 1 A 71 71 PHE HA H 71 4.100 3.885 0.215 1
1 823 . 14 1 1 A 71 71 PHE C C 71 177.000 177.623 -0.623 1
1 824 . 14 1 1 A 71 71 PHE CA C 71 58.230 62.102 -3.872 1
1 825 . 14 1 1 A 71 71 PHE CB C 71 36.910 39.220 -2.310 1
1 826 . 14 1 1 A 71 71 PHE N N 71 119.760 123.022 -3.262 1
1 827 . 14 1 1 A 72 72 GLN H H 72 8.440 8.428 0.012 1
1 828 . 14 1 1 A 72 72 GLN HA H 72 3.600 4.089 -0.489 1
1 831 . 14 1 1 A 72 72 GLN C C 72 178.820 178.110 0.710 1
1 832 . 14 1 1 A 72 72 GLN CA C 72 59.500 58.866 0.634 1
1 833 . 14 1 1 A 72 72 GLN CB C 72 29.553 28.276 1.277 1
1 835 . 14 1 1 A 72 72 GLN N N 72 121.820 117.991 3.829 1
1 836 . 14 1 1 A 73 73 GLU H H 73 8.290 7.791 0.499 1
1 837 . 14 1 1 A 73 73 GLU HA H 73 4.070 4.131 -0.061 1
1 842 . 14 1 1 A 73 73 GLU C C 73 179.370 178.808 0.562 1
1 843 . 14 1 1 A 73 73 GLU CA C 73 58.030 58.862 -0.832 1
1 844 . 14 1 1 A 73 73 GLU CB C 73 29.530 29.594 -0.064 1
1 846 . 14 1 1 A 73 73 GLU N N 73 120.550 119.266 1.284 1
1 847 . 14 1 1 A 74 74 PHE H H 74 8.630 8.923 -0.293 1
1 848 . 14 1 1 A 74 74 PHE HA H 74 4.020 4.165 -0.145 1
1 851 . 14 1 1 A 74 74 PHE C C 74 177.890 177.460 0.430 1
1 852 . 14 1 1 A 74 74 PHE CA C 74 60.090 61.086 -0.996 1
1 853 . 14 1 1 A 74 74 PHE CB C 74 38.020 38.802 -0.782 1
1 854 . 14 1 1 A 74 74 PHE N N 74 121.010 122.781 -1.771 1
1 855 . 14 1 1 A 75 75 VAL H H 75 8.080 8.315 -0.235 1
1 856 . 14 1 1 A 75 75 VAL HA H 75 2.860 3.964 -1.104 1
1 864 . 14 1 1 A 75 75 VAL C C 75 177.030 177.551 -0.521 1
1 865 . 14 1 1 A 75 75 VAL CA C 75 66.430 65.388 1.042 1
1 866 . 14 1 1 A 75 75 VAL CB C 75 30.600 31.333 -0.733 1
1 869 . 14 1 1 A 75 75 VAL N N 75 119.460 119.074 0.386 1
1 870 . 14 1 1 A 76 76 VAL H H 76 7.100 7.962 -0.862 1
1 871 . 14 1 1 A 76 76 VAL HA H 76 3.330 3.842 -0.512 1
1 879 . 14 1 1 A 76 76 VAL C C 76 178.670 178.117 0.553 1
1 880 . 14 1 1 A 76 76 VAL CA C 76 67.000 65.825 1.175 1
1 881 . 14 1 1 A 76 76 VAL CB C 76 31.280 31.408 -0.128 1
1 884 . 14 1 1 A 76 76 VAL N N 76 121.030 118.354 2.676 1
1 885 . 14 1 1 A 77 77 LEU H H 77 6.900 7.929 -1.029 1
1 886 . 14 1 1 A 77 77 LEU HA H 77 3.800 4.046 -0.246 1
1 896 . 14 1 1 A 77 77 LEU C C 77 177.960 178.715 -0.755 1
1 897 . 14 1 1 A 77 77 LEU CA C 77 57.710 58.178 -0.468 1
1 898 . 14 1 1 A 77 77 LEU CB C 77 40.070 41.874 -1.804 1
1 902 . 14 1 1 A 77 77 LEU N N 77 120.310 125.139 -4.829 1
1 903 . 14 1 1 A 78 78 VAL H H 78 7.240 7.916 -0.676 1
1 904 . 14 1 1 A 78 78 VAL HA H 78 3.030 3.980 -0.950 1
1 912 . 14 1 1 A 78 78 VAL C C 78 179.600 178.191 1.409 1
1 913 . 14 1 1 A 78 78 VAL CA C 78 66.420 64.908 1.512 1
1 914 . 14 1 1 A 78 78 VAL CB C 78 30.700 31.726 -1.026 1
1 917 . 14 1 1 A 78 78 VAL N N 78 117.180 116.466 0.714 1
1 918 . 14 1 1 A 79 79 ALA H H 79 9.000 7.952 1.048 1
1 919 . 14 1 1 A 79 79 ALA HA H 79 3.610 4.192 -0.582 1
1 923 . 14 1 1 A 79 79 ALA C C 79 182.260 180.302 1.958 1
1 924 . 14 1 1 A 79 79 ALA CA C 79 55.580 55.407 0.173 1
1 925 . 14 1 1 A 79 79 ALA CB C 79 18.400 18.321 0.079 1
1 926 . 14 1 1 A 79 79 ALA N N 79 126.000 125.107 0.893 1
1 927 . 14 1 1 A 80 80 ALA H H 80 8.000 7.816 0.184 1
1 928 . 14 1 1 A 80 80 ALA HA H 80 4.100 4.091 0.009 1
1 932 . 14 1 1 A 80 80 ALA C C 80 175.460 179.574 -4.114 1
1 933 . 14 1 1 A 80 80 ALA CA C 80 56.020 54.611 1.409 1
1 934 . 14 1 1 A 80 80 ALA CB C 80 18.040 18.362 -0.322 1
1 935 . 14 1 1 A 80 80 ALA N N 80 120.730 121.033 -0.303 1
1 936 . 14 1 1 A 81 81 LEU H H 81 8.460 7.653 0.807 1
1 937 . 14 1 1 A 81 81 LEU HA H 81 4.000 4.022 -0.022 1
1 941 . 14 1 1 A 81 81 LEU C C 81 177.030 178.768 -1.738 1
1 942 . 14 1 1 A 81 81 LEU CA C 81 57.640 57.844 -0.204 1
1 943 . 14 1 1 A 81 81 LEU CB C 81 40.620 41.531 -0.911 1
1 945 . 14 1 1 A 81 81 LEU N N 81 119.890 117.818 2.072 1
1 946 . 14 1 1 A 82 82 THR H H 82 8.320 7.812 0.508 1
1 947 . 14 1 1 A 82 82 THR HA H 82 3.800 3.939 -0.139 1
1 952 . 14 1 1 A 82 82 THR C C 82 181.010 176.766 4.244 1
1 953 . 14 1 1 A 82 82 THR CA C 82 68.500 66.190 2.310 1
1 954 . 14 1 1 A 82 82 THR CB C 82 67.400 69.316 -1.916 1
1 956 . 14 1 1 A 82 82 THR N N 82 117.120 114.756 2.364 1
1 957 . 14 1 1 A 83 83 VAL H H 83 8.530 7.604 0.926 1
1 958 . 14 1 1 A 83 83 VAL HA H 83 3.890 4.076 -0.186 1
1 966 . 14 1 1 A 83 83 VAL C C 83 178.120 178.226 -0.106 1
1 967 . 14 1 1 A 83 83 VAL CA C 83 67.400 65.190 2.210 1
1 968 . 14 1 1 A 83 83 VAL CB C 83 31.590 31.537 0.053 1
1 971 . 14 1 1 A 83 83 VAL N N 83 119.760 118.126 1.634 1
1 972 . 14 1 1 A 84 84 ALA H H 84 7.910 8.482 -0.572 1
1 973 . 14 1 1 A 84 84 ALA HA H 84 4.060 4.140 -0.080 1
1 977 . 14 1 1 A 84 84 ALA C C 84 180.560 179.884 0.676 1
1 978 . 14 1 1 A 84 84 ALA CA C 84 55.000 54.953 0.047 1
1 979 . 14 1 1 A 84 84 ALA CB C 84 17.230 18.283 -1.053 1
1 980 . 14 1 1 A 84 84 ALA N N 84 122.620 124.595 -1.975 1
1 981 . 14 1 1 A 85 85 CYS H H 85 8.580 8.175 0.405 1
1 982 . 14 1 1 A 85 85 CYS HA H 85 4.080 4.579 -0.499 1
1 985 . 14 1 1 A 85 85 CYS C C 85 179.060 176.772 2.288 1
1 986 . 14 1 1 A 85 85 CYS CA C 85 63.210 61.612 1.598 1
1 987 . 14 1 1 A 85 85 CYS CB C 85 26.310 27.241 -0.931 1
1 988 . 14 1 1 A 85 85 CYS N N 85 118.730 117.135 1.595 1
1 989 . 14 1 1 A 86 86 ASN H H 86 8.430 8.103 0.327 1
1 990 . 14 1 1 A 86 86 ASN CA C 86 55.860 56.032 -0.172 1
1 991 . 14 1 1 A 86 86 ASN CB C 86 37.440 37.575 -0.135 1
1 992 . 14 1 1 A 86 86 ASN N N 86 119.360 117.853 1.507 1
1 993 . 14 1 1 A 87 87 ASN H H 87 7.880 7.854 0.026 1
1 994 . 14 1 1 A 87 87 ASN HA H 87 4.600 4.640 -0.040 1
1 997 . 14 1 1 A 87 87 ASN C C 87 178.510 177.502 1.008 1
1 998 . 14 1 1 A 87 87 ASN CA C 87 56.470 56.404 0.066 1
1 999 . 14 1 1 A 87 87 ASN CB C 87 37.500 38.835 -1.335 1
1 1000 . 14 1 1 A 87 87 ASN N N 87 119.480 119.772 -0.292 1
1 1001 . 14 1 1 A 88 88 PHE H H 88 8.050 7.913 0.137 1
1 1002 . 14 1 1 A 88 88 PHE HA H 88 4.200 4.352 -0.152 1
1 1005 . 14 1 1 A 88 88 PHE C C 88 178.510 177.372 1.138 1
1 1006 . 14 1 1 A 88 88 PHE CA C 88 56.460 59.874 -3.414 1
1 1007 . 14 1 1 A 88 88 PHE CB C 88 38.500 39.908 -1.408 1
1 1008 . 14 1 1 A 88 88 PHE N N 88 120.280 119.935 0.345 1
1 1009 . 14 1 1 A 89 89 PHE H H 89 8.020 8.059 -0.039 1
1 1010 . 14 1 1 A 89 89 PHE HA H 89 4.000 4.229 -0.229 1
1 1013 . 14 1 1 A 89 89 PHE C C 89 177.340 177.585 -0.245 1
1 1014 . 14 1 1 A 89 89 PHE CA C 89 59.000 60.008 -1.008 1
1 1015 . 14 1 1 A 89 89 PHE CB C 89 37.430 39.812 -2.382 1
1 1016 . 14 1 1 A 89 89 PHE N N 89 120.910 119.133 1.777 1
1 1017 . 14 1 1 A 90 90 TRP H H 90 7.800 7.669 0.131 1
1 1018 . 14 1 1 A 90 90 TRP HA H 90 4.460 4.471 -0.011 1
1 1021 . 14 1 1 A 90 90 TRP C C 90 177.340 175.148 2.192 1
1 1022 . 14 1 1 A 90 90 TRP CA C 90 57.930 59.202 -1.272 1
1 1023 . 14 1 1 A 90 90 TRP CB C 90 42.000 30.353 11.647 1
1 1024 . 14 1 1 A 90 90 TRP N N 90 120.050 120.801 -0.751 1
1 1025 . 14 1 1 A 91 91 GLU H H 91 7.800 7.412 0.388 1
1 1026 . 14 1 1 A 91 91 GLU HA H 91 4.050 3.975 0.075 1
1 1031 . 14 1 1 A 91 91 GLU C C 91 177.570 175.932 1.638 1
1 1032 . 14 1 1 A 91 91 GLU CA C 91 57.350 56.144 1.206 1
1 1033 . 14 1 1 A 91 91 GLU CB C 91 29.530 30.392 -0.862 1
1 1035 . 14 1 1 A 91 91 GLU N N 91 120.730 117.238 3.492 1
1 1036 . 14 1 1 A 92 92 ASN H H 92 7.800 9.114 -1.314 1
1 1037 . 14 1 1 A 92 92 ASN HA H 92 4.630 4.229 0.401 1
1 1040 . 14 1 1 A 92 92 ASN C C 92 174.450 174.306 0.144 1
1 1041 . 14 1 1 A 92 92 ASN CA C 92 52.960 54.280 -1.320 1
1 1042 . 14 1 1 A 92 92 ASN CB C 92 29.530 36.851 -7.321 1
1 1043 . 14 1 1 A 92 92 ASN N N 92 119.410 116.135 3.275 1
1 5 . 15 1 1 A 2 2 SER H H 2 9.000 7.548 1.452 1
1 6 . 15 1 1 A 2 2 SER HA H 2 4.690 4.417 0.273 1
1 9 . 15 1 1 A 2 2 SER C C 2 176.170 175.064 1.106 1
1 10 . 15 1 1 A 2 2 SER CA C 2 57.340 58.242 -0.902 1
1 11 . 15 1 1 A 2 2 SER CB C 2 65.550 65.164 0.386 1
1 12 . 15 1 1 A 2 2 SER N N 2 119.330 115.613 3.717 1
1 13 . 15 1 1 A 3 3 GLU H H 3 9.350 9.098 0.252 1
1 14 . 15 1 1 A 3 3 GLU HA H 3 4.060 4.009 0.051 1
1 17 . 15 1 1 A 3 3 GLU C C 3 180.150 178.526 1.624 1
1 18 . 15 1 1 A 3 3 GLU CA C 3 60.280 59.382 0.898 1
1 19 . 15 1 1 A 3 3 GLU CB C 3 29.230 29.467 -0.237 1
1 21 . 15 1 1 A 3 3 GLU N N 3 125.350 120.395 4.955 1
1 22 . 15 1 1 A 4 4 LEU H H 4 9.060 8.484 0.576 1
1 23 . 15 1 1 A 4 4 LEU HA H 4 4.080 3.955 0.125 1
1 33 . 15 1 1 A 4 4 LEU C C 4 177.890 179.381 -1.491 1
1 34 . 15 1 1 A 4 4 LEU CA C 4 58.090 58.070 0.020 1
1 35 . 15 1 1 A 4 4 LEU CB C 4 42.120 41.513 0.607 1
1 39 . 15 1 1 A 4 4 LEU N N 4 121.090 120.547 0.543 1
1 40 . 15 1 1 A 5 5 GLU H H 5 8.340 7.670 0.670 1
1 41 . 15 1 1 A 5 5 GLU HA H 5 4.050 3.949 0.101 1
1 46 . 15 1 1 A 5 5 GLU C C 5 177.030 179.419 -2.389 1
1 47 . 15 1 1 A 5 5 GLU CA C 5 59.840 59.236 0.604 1
1 48 . 15 1 1 A 5 5 GLU CB C 5 28.940 29.399 -0.459 1
1 50 . 15 1 1 A 5 5 GLU N N 5 119.780 119.146 0.634 1
1 51 . 15 1 1 A 6 6 THR H H 6 8.370 7.806 0.564 1
1 52 . 15 1 1 A 6 6 THR HA H 6 4.310 3.887 0.423 1
1 57 . 15 1 1 A 6 6 THR C C 6 177.340 176.761 0.579 1
1 58 . 15 1 1 A 6 6 THR CA C 6 66.630 66.355 0.275 1
1 59 . 15 1 1 A 6 6 THR CB C 6 68.650 68.487 0.163 1
1 61 . 15 1 1 A 6 6 THR N N 6 116.940 117.672 -0.732 1
1 62 . 15 1 1 A 7 7 ALA H H 7 8.270 7.761 0.509 1
1 63 . 15 1 1 A 7 7 ALA HA H 7 4.190 3.981 0.209 1
1 67 . 15 1 1 A 7 7 ALA C C 7 179.760 179.233 0.527 1
1 68 . 15 1 1 A 7 7 ALA CA C 7 55.880 55.225 0.655 1
1 69 . 15 1 1 A 7 7 ALA CB C 7 17.720 17.957 -0.237 1
1 70 . 15 1 1 A 7 7 ALA N N 7 127.400 123.939 3.461 1
1 71 . 15 1 1 A 8 8 MET H H 8 8.110 7.636 0.474 1
1 72 . 15 1 1 A 8 8 MET HA H 8 4.020 4.170 -0.150 1
1 80 . 15 1 1 A 8 8 MET C C 8 178.510 178.033 0.477 1
1 81 . 15 1 1 A 8 8 MET CA C 8 60.580 57.998 2.582 1
1 82 . 15 1 1 A 8 8 MET CB C 8 33.630 32.240 1.390 1
1 85 . 15 1 1 A 8 8 MET N N 8 117.520 118.417 -0.897 1
1 86 . 15 1 1 A 9 9 GLU H H 9 8.210 7.707 0.503 1
1 87 . 15 1 1 A 9 9 GLU HA H 9 3.830 4.052 -0.222 1
1 92 . 15 1 1 A 9 9 GLU C C 9 179.140 178.623 0.517 1
1 93 . 15 1 1 A 9 9 GLU CA C 9 59.690 59.239 0.451 1
1 94 . 15 1 1 A 9 9 GLU CB C 9 29.530 29.411 0.119 1
1 96 . 15 1 1 A 9 9 GLU N N 9 118.560 118.217 0.343 1
1 97 . 15 1 1 A 10 10 THR H H 10 8.490 7.523 0.967 1
1 98 . 15 1 1 A 10 10 THR HA H 10 4.000 4.013 -0.013 1
1 103 . 15 1 1 A 10 10 THR C C 10 176.010 176.149 -0.139 1
1 104 . 15 1 1 A 10 10 THR CA C 10 67.110 65.674 1.436 1
1 105 . 15 1 1 A 10 10 THR CB C 10 67.770 69.100 -1.330 1
1 107 . 15 1 1 A 10 10 THR N N 10 118.310 116.041 2.269 1
1 108 . 15 1 1 A 11 11 LEU H H 11 7.920 7.576 0.344 1
1 109 . 15 1 1 A 11 11 LEU HA H 11 3.930 3.465 0.465 1
1 119 . 15 1 1 A 11 11 LEU C C 11 178.820 178.674 0.146 1
1 120 . 15 1 1 A 11 11 LEU CA C 11 59.690 57.791 1.899 1
1 121 . 15 1 1 A 11 11 LEU CB C 11 41.920 41.251 0.669 1
1 125 . 15 1 1 A 11 11 LEU N N 11 121.150 120.786 0.364 1
1 126 . 15 1 1 A 12 12 ILE H H 12 7.440 7.526 -0.086 1
1 127 . 15 1 1 A 12 12 ILE HA H 12 3.640 3.565 0.075 1
1 137 . 15 1 1 A 12 12 ILE C C 12 179.530 178.747 0.783 1
1 138 . 15 1 1 A 12 12 ILE CA C 12 63.740 65.168 -1.428 1
1 139 . 15 1 1 A 12 12 ILE CB C 12 38.800 37.619 1.181 1
1 143 . 15 1 1 A 12 12 ILE N N 12 118.010 119.706 -1.696 1
1 144 . 15 1 1 A 13 13 ASN H H 13 8.930 7.728 1.202 1
1 145 . 15 1 1 A 13 13 ASN HA H 13 4.520 4.646 -0.126 1
1 148 . 15 1 1 A 13 13 ASN C C 13 179.450 177.924 1.526 1
1 149 . 15 1 1 A 13 13 ASN CA C 13 56.470 55.693 0.777 1
1 150 . 15 1 1 A 13 13 ASN CB C 13 37.930 38.810 -0.880 1
1 151 . 15 1 1 A 13 13 ASN N N 13 121.820 118.887 2.933 1
1 152 . 15 1 1 A 14 14 VAL H H 14 9.180 8.141 1.039 1
1 153 . 15 1 1 A 14 14 VAL HA H 14 3.830 3.935 -0.105 1
1 161 . 15 1 1 A 14 14 VAL CA C 14 65.840 65.434 0.406 1
1 162 . 15 1 1 A 14 14 VAL CB C 14 31.290 31.369 -0.079 1
1 165 . 15 1 1 A 14 14 VAL N N 14 122.040 119.215 2.825 1
1 166 . 15 1 1 A 15 15 PHE H H 15 7.590 8.134 -0.544 1
1 167 . 15 1 1 A 15 15 PHE HA H 15 3.360 4.313 -0.953 1
1 170 . 15 1 1 A 15 15 PHE C C 15 177.890 178.890 -1.000 1
1 171 . 15 1 1 A 15 15 PHE CA C 15 62.030 60.480 1.550 1
1 172 . 15 1 1 A 15 15 PHE CB C 15 38.900 38.435 0.465 1
1 173 . 15 1 1 A 15 15 PHE N N 15 118.290 120.817 -2.527 1
1 174 . 15 1 1 A 16 16 HIS H H 16 7.790 8.067 -0.277 1
1 175 . 15 1 1 A 16 16 HIS HA H 16 4.890 4.489 0.401 1
1 178 . 15 1 1 A 16 16 HIS C C 16 177.810 177.735 0.075 1
1 179 . 15 1 1 A 16 16 HIS CA C 16 59.100 59.987 -0.887 1
1 180 . 15 1 1 A 16 16 HIS CB C 16 28.060 29.464 -1.404 1
1 181 . 15 1 1 A 16 16 HIS N N 16 118.290 119.308 -1.018 1
1 182 . 15 1 1 A 17 17 ALA H H 17 8.040 8.153 -0.113 1
1 183 . 15 1 1 A 17 17 ALA HA H 17 4.050 4.046 0.004 1
1 187 . 15 1 1 A 17 17 ALA C C 17 179.600 179.988 -0.388 1
1 188 . 15 1 1 A 17 17 ALA CA C 17 54.000 55.362 -1.362 1
1 189 . 15 1 1 A 17 17 ALA CB C 17 17.520 18.861 -1.341 1
1 190 . 15 1 1 A 17 17 ALA N N 17 124.410 121.202 3.208 1
1 191 . 15 1 1 A 18 18 HIS H H 18 7.000 7.598 -0.598 1
1 192 . 15 1 1 A 18 18 HIS HA H 18 4.330 4.381 -0.051 1
1 195 . 15 1 1 A 18 18 HIS C C 18 176.320 178.346 -2.026 1
1 196 . 15 1 1 A 18 18 HIS CA C 18 57.350 59.514 -2.164 1
1 197 . 15 1 1 A 18 18 HIS CB C 18 32.920 30.348 2.572 1
1 198 . 15 1 1 A 18 18 HIS N N 18 115.160 116.073 -0.913 1
1 199 . 15 1 1 A 19 19 SER H H 19 8.380 8.442 -0.062 1
1 200 . 15 1 1 A 19 19 SER HA H 19 3.640 4.139 -0.499 1
1 203 . 15 1 1 A 19 19 SER C C 19 177.340 176.094 1.246 1
1 204 . 15 1 1 A 19 19 SER CA C 19 60.160 61.226 -1.066 1
1 205 . 15 1 1 A 19 19 SER CB C 19 61.000 62.761 -1.761 1
1 206 . 15 1 1 A 19 19 SER N N 19 114.380 116.190 -1.810 1
1 207 . 15 1 1 A 20 20 GLY H H 20 7.600 7.871 -0.271 1
1 208 . 15 1 1 A 20 20 GLY HA2 H 20 3.680 3.779 -0.099 1
1 209 . 15 1 1 A 20 20 GLY HA3 H 20 4.000 3.910 0.090 1
1 210 . 15 1 1 A 20 20 GLY C C 20 174.140 174.431 -0.291 1
1 211 . 15 1 1 A 20 20 GLY CA C 20 47.000 45.300 1.700 1
1 212 . 15 1 1 A 20 20 GLY N N 20 112.550 109.663 2.887 1
1 213 . 15 1 1 A 21 21 LYS H H 21 7.230 7.619 -0.389 1
1 214 . 15 1 1 A 21 21 LYS HA H 21 3.860 4.405 -0.545 1
1 223 . 15 1 1 A 21 21 LYS C C 21 177.730 177.807 -0.077 1
1 224 . 15 1 1 A 21 21 LYS CA C 21 59.110 56.978 2.132 1
1 225 . 15 1 1 A 21 21 LYS CB C 21 32.460 34.904 -2.444 1
1 229 . 15 1 1 A 21 21 LYS N N 21 123.240 118.294 4.946 1
1 230 . 15 1 1 A 22 22 GLU H H 22 9.350 7.762 1.588 1
1 231 . 15 1 1 A 22 22 GLU HA H 22 4.610 4.436 0.174 1
1 236 . 15 1 1 A 22 22 GLU C C 22 177.420 175.728 1.692 1
1 237 . 15 1 1 A 22 22 GLU CA C 22 53.700 56.193 -2.493 1
1 238 . 15 1 1 A 22 22 GLU CB C 22 32.000 29.488 2.512 1
1 240 . 15 1 1 A 22 22 GLU N N 22 116.770 116.043 0.727 1
1 241 . 15 1 1 A 23 23 GLY H H 23 7.570 7.413 0.157 1
1 242 . 15 1 1 A 23 23 GLY HA2 H 23 3.630 4.123 -0.493 1
1 243 . 15 1 1 A 23 23 GLY HA3 H 23 3.880 4.129 -0.249 1
1 244 . 15 1 1 A 23 23 GLY C C 23 173.980 171.744 2.236 1
1 245 . 15 1 1 A 23 23 GLY CA C 23 45.250 45.618 -0.368 1
1 246 . 15 1 1 A 23 23 GLY N N 23 112.180 108.386 3.794 1
1 247 . 15 1 1 A 24 24 ASP H H 24 8.680 8.570 0.110 1
1 248 . 15 1 1 A 24 24 ASP HA H 24 4.380 4.765 -0.385 1
1 251 . 15 1 1 A 24 24 ASP C C 24 178.590 178.024 0.566 1
1 252 . 15 1 1 A 24 24 ASP CA C 24 60.000 53.557 6.443 1
1 253 . 15 1 1 A 24 24 ASP CB C 24 27.480 41.677 -14.197 1
1 254 . 15 1 1 A 24 24 ASP N N 24 127.470 121.890 5.580 1
1 255 . 15 1 1 A 25 25 LYS H H 25 9.270 8.795 0.475 1
1 256 . 15 1 1 A 25 25 LYS HA H 25 4.250 3.938 0.312 1
1 265 . 15 1 1 A 25 25 LYS C C 25 177.030 177.212 -0.182 1
1 266 . 15 1 1 A 25 25 LYS CA C 25 60.000 59.926 0.074 1
1 267 . 15 1 1 A 25 25 LYS CB C 25 31.170 32.417 -1.247 1
1 271 . 15 1 1 A 25 25 LYS N N 25 132.960 122.430 10.530 1
1 272 . 15 1 1 A 26 26 TYR H H 26 9.430 7.945 1.485 1
1 273 . 15 1 1 A 26 26 TYR HA H 26 4.640 4.766 -0.126 1
1 276 . 15 1 1 A 26 26 TYR C C 26 174.290 174.785 -0.495 1
1 277 . 15 1 1 A 26 26 TYR CA C 26 56.010 57.573 -1.563 1
1 278 . 15 1 1 A 26 26 TYR CB C 26 37.730 39.086 -1.356 1
1 279 . 15 1 1 A 26 26 TYR N N 26 120.650 119.140 1.510 1
1 280 . 15 1 1 A 27 27 LYS H H 27 7.110 7.311 -0.201 1
1 281 . 15 1 1 A 27 27 LYS HA H 27 5.110 4.867 0.243 1
1 290 . 15 1 1 A 27 27 LYS C C 27 175.150 173.626 1.524 1
1 291 . 15 1 1 A 27 27 LYS CA C 27 55.070 54.950 0.120 1
1 292 . 15 1 1 A 27 27 LYS CB C 27 38.900 36.177 2.723 1
1 296 . 15 1 1 A 27 27 LYS N N 27 115.830 121.394 -5.564 1
1 297 . 15 1 1 A 28 28 LEU H H 28 9.820 8.402 1.418 1
1 298 . 15 1 1 A 28 28 LEU HA H 28 5.080 4.899 0.181 1
1 308 . 15 1 1 A 28 28 LEU C C 28 176.640 175.568 1.072 1
1 309 . 15 1 1 A 28 28 LEU CA C 28 52.660 54.008 -1.348 1
1 310 . 15 1 1 A 28 28 LEU CB C 28 42.710 43.835 -1.125 1
1 314 . 15 1 1 A 28 28 LEU N N 28 126.930 128.341 -1.411 1
1 315 . 15 1 1 A 29 29 SER H H 29 9.890 7.959 1.931 1
1 316 . 15 1 1 A 29 29 SER HA H 29 4.530 4.974 -0.444 1
1 319 . 15 1 1 A 29 29 SER C C 29 174.990 175.027 -0.037 1
1 320 . 15 1 1 A 29 29 SER CA C 29 56.180 55.485 0.695 1
1 321 . 15 1 1 A 29 29 SER CB C 29 65.550 66.875 -1.325 1
1 322 . 15 1 1 A 29 29 SER N N 29 121.600 117.896 3.704 1
1 323 . 15 1 1 A 30 30 LYS H H 30 8.850 8.803 0.047 1
1 324 . 15 1 1 A 30 30 LYS HA H 30 3.850 3.890 -0.040 1
1 333 . 15 1 1 A 30 30 LYS C C 30 175.620 177.456 -1.836 1
1 334 . 15 1 1 A 30 30 LYS CA C 30 60.860 60.127 0.733 1
1 335 . 15 1 1 A 30 30 LYS CB C 30 31.290 32.115 -0.825 1
1 339 . 15 1 1 A 30 30 LYS N N 30 121.260 121.751 -0.491 1
1 340 . 15 1 1 A 31 31 LYS H H 31 7.970 7.907 0.063 1
1 341 . 15 1 1 A 31 31 LYS HA H 31 3.880 4.043 -0.163 1
1 350 . 15 1 1 A 31 31 LYS C C 31 179.290 179.261 0.029 1
1 351 . 15 1 1 A 31 31 LYS CA C 31 59.110 59.196 -0.086 1
1 352 . 15 1 1 A 31 31 LYS CB C 31 32.640 31.574 1.066 1
1 356 . 15 1 1 A 31 31 LYS N N 31 121.260 118.570 2.690 1
1 357 . 15 1 1 A 32 32 GLU H H 32 7.510 7.775 -0.265 1
1 358 . 15 1 1 A 32 32 GLU HA H 32 3.830 4.076 -0.246 1
1 363 . 15 1 1 A 32 32 GLU C C 32 179.290 179.497 -0.207 1
1 364 . 15 1 1 A 32 32 GLU CA C 32 58.590 58.895 -0.305 1
1 365 . 15 1 1 A 32 32 GLU CB C 32 30.120 29.742 0.378 1
1 367 . 15 1 1 A 32 32 GLU N N 32 120.090 119.488 0.602 1
1 368 . 15 1 1 A 33 33 LEU H H 33 8.970 7.670 1.300 1
1 369 . 15 1 1 A 33 33 LEU HA H 33 3.830 3.473 0.357 1
1 379 . 15 1 1 A 33 33 LEU C C 33 178.200 178.655 -0.455 1
1 380 . 15 1 1 A 33 33 LEU CA C 33 57.930 57.778 0.152 1
1 381 . 15 1 1 A 33 33 LEU CB C 33 40.660 41.301 -0.641 1
1 385 . 15 1 1 A 33 33 LEU N N 33 120.200 119.242 0.958 1
1 386 . 15 1 1 A 34 34 LYS H H 34 8.230 7.489 0.741 1
1 387 . 15 1 1 A 34 34 LYS HA H 34 3.550 3.860 -0.310 1
1 396 . 15 1 1 A 34 34 LYS C C 34 178.040 179.286 -1.246 1
1 397 . 15 1 1 A 34 34 LYS CA C 34 60.720 60.205 0.515 1
1 398 . 15 1 1 A 34 34 LYS CB C 34 31.980 31.859 0.121 1
1 402 . 15 1 1 A 34 34 LYS N N 34 120.780 119.268 1.512 1
1 403 . 15 1 1 A 35 35 ASP H H 35 7.990 7.761 0.229 1
1 404 . 15 1 1 A 35 35 ASP HA H 35 4.250 4.489 -0.239 1
1 407 . 15 1 1 A 35 35 ASP C C 35 179.060 178.555 0.505 1
1 408 . 15 1 1 A 35 35 ASP CA C 35 56.830 57.162 -0.332 1
1 409 . 15 1 1 A 35 35 ASP CB C 35 40.440 40.678 -0.238 1
1 410 . 15 1 1 A 35 35 ASP N N 35 119.550 120.156 -0.606 1
1 411 . 15 1 1 A 36 36 LEU H H 36 8.130 7.609 0.521 1
1 412 . 15 1 1 A 36 36 LEU HA H 36 2.580 3.318 -0.738 1
1 422 . 15 1 1 A 36 36 LEU C C 36 179.450 178.229 1.221 1
1 423 . 15 1 1 A 36 36 LEU CA C 36 59.980 57.917 2.063 1
1 424 . 15 1 1 A 36 36 LEU CB C 36 42.180 41.255 0.925 1
1 428 . 15 1 1 A 36 36 LEU N N 36 125.560 121.213 4.347 1
1 429 . 15 1 1 A 37 37 LEU H H 37 8.740 7.719 1.021 1
1 430 . 15 1 1 A 37 37 LEU HA H 37 3.580 3.916 -0.336 1
1 440 . 15 1 1 A 37 37 LEU C C 37 179.290 178.760 0.530 1
1 441 . 15 1 1 A 37 37 LEU CA C 37 58.230 58.072 0.158 1
1 442 . 15 1 1 A 37 37 LEU CB C 37 41.590 41.188 0.402 1
1 446 . 15 1 1 A 37 37 LEU N N 37 120.520 118.557 1.963 1
1 447 . 15 1 1 A 38 38 GLN H H 38 8.520 8.043 0.477 1
1 448 . 15 1 1 A 38 38 GLN HA H 38 4.000 4.064 -0.064 1
1 453 . 15 1 1 A 38 38 GLN C C 38 177.960 178.323 -0.363 1
1 454 . 15 1 1 A 38 38 GLN CA C 38 58.210 58.159 0.051 1
1 455 . 15 1 1 A 38 38 GLN CB C 38 28.650 28.191 0.459 1
1 457 . 15 1 1 A 38 38 GLN N N 38 116.740 117.577 -0.837 1
1 458 . 15 1 1 A 39 39 THR H H 39 7.910 7.725 0.185 1
1 459 . 15 1 1 A 39 39 THR HA H 39 4.210 3.867 0.343 1
1 464 . 15 1 1 A 39 39 THR C C 39 177.180 175.746 1.434 1
1 465 . 15 1 1 A 39 39 THR CA C 39 64.730 67.198 -2.468 1
1 466 . 15 1 1 A 39 39 THR CB C 39 69.650 68.811 0.839 1
1 468 . 15 1 1 A 39 39 THR N N 39 111.400 116.921 -5.521 1
1 469 . 15 1 1 A 40 40 GLU H H 40 8.590 7.854 0.736 1
1 470 . 15 1 1 A 40 40 GLU HA H 40 4.680 4.447 0.233 1
1 475 . 15 1 1 A 40 40 GLU C C 40 178.280 177.043 1.237 1
1 476 . 15 1 1 A 40 40 GLU CA C 40 55.880 56.608 -0.728 1
1 477 . 15 1 1 A 40 40 GLU CB C 40 30.990 30.331 0.659 1
1 479 . 15 1 1 A 40 40 GLU N N 40 117.840 116.186 1.654 1
1 480 . 15 1 1 A 41 41 LEU H H 41 7.680 7.809 -0.129 1
1 481 . 15 1 1 A 41 41 LEU HA H 41 5.080 4.802 0.278 1
1 491 . 15 1 1 A 41 41 LEU C C 41 179.450 177.284 2.166 1
1 492 . 15 1 1 A 41 41 LEU CA C 41 53.830 53.758 0.072 1
1 493 . 15 1 1 A 41 41 LEU CB C 41 41.360 42.829 -1.469 1
1 497 . 15 1 1 A 41 41 LEU N N 41 121.410 119.619 1.791 1
1 498 . 15 1 1 A 42 42 SER H H 42 8.380 7.969 0.411 1
1 499 . 15 1 1 A 42 42 SER HA H 42 4.130 3.959 0.171 1
1 502 . 15 1 1 A 42 42 SER C C 42 176.640 176.384 0.256 1
1 503 . 15 1 1 A 42 42 SER CA C 42 61.280 62.110 -0.830 1
1 504 . 15 1 1 A 42 42 SER CB C 42 63.040 62.863 0.177 1
1 505 . 15 1 1 A 42 42 SER N N 42 117.420 117.023 0.397 1
1 506 . 15 1 1 A 43 43 SER H H 43 8.900 8.098 0.802 1
1 507 . 15 1 1 A 43 43 SER HA H 43 4.290 4.236 0.054 1
1 510 . 15 1 1 A 43 43 SER C C 43 175.620 177.232 -1.612 1
1 511 . 15 1 1 A 43 43 SER CA C 43 60.860 61.276 -0.416 1
1 512 . 15 1 1 A 43 43 SER CB C 43 62.910 62.933 -0.023 1
1 513 . 15 1 1 A 43 43 SER N N 43 117.580 116.300 1.280 1
1 514 . 15 1 1 A 44 44 PHE H H 44 7.880 8.008 -0.128 1
1 515 . 15 1 1 A 44 44 PHE HA H 44 4.240 4.206 0.034 1
1 518 . 15 1 1 A 44 44 PHE C C 44 176.950 175.554 1.396 1
1 519 . 15 1 1 A 44 44 PHE CA C 44 62.710 61.448 1.262 1
1 520 . 15 1 1 A 44 44 PHE CB C 44 39.020 38.985 0.035 1
1 521 . 15 1 1 A 44 44 PHE N N 44 119.480 121.731 -2.251 1
1 522 . 15 1 1 A 45 45 LEU H H 45 8.060 8.280 -0.220 1
1 523 . 15 1 1 A 45 45 LEU HA H 45 3.810 3.799 0.011 1
1 533 . 15 1 1 A 45 45 LEU C C 45 177.500 175.649 1.851 1
1 534 . 15 1 1 A 45 45 LEU CA C 45 59.980 55.910 4.070 1
1 535 . 15 1 1 A 45 45 LEU CB C 45 39.640 42.488 -2.848 1
1 538 . 15 1 1 A 45 45 LEU N N 45 118.010 122.986 -4.976 1
1 539 . 15 1 1 A 46 46 ASP H H 46 8.150 8.508 -0.358 1
1 540 . 15 1 1 A 46 46 ASP HA H 46 4.470 4.594 -0.124 1
1 543 . 15 1 1 A 46 46 ASP C C 46 179.920 176.090 3.830 1
1 544 . 15 1 1 A 46 46 ASP CA C 46 52.950 53.194 -0.244 1
1 545 . 15 1 1 A 46 46 ASP CB C 46 40.000 40.782 -0.782 1
1 546 . 15 1 1 A 46 46 ASP N N 46 119.460 125.816 -6.356 1
1 547 . 15 1 1 A 47 47 VAL H H 47 8.010 8.437 -0.427 1
1 548 . 15 1 1 A 47 47 VAL HA H 47 3.800 4.370 -0.570 1
1 556 . 15 1 1 A 47 47 VAL C C 47 175.460 176.881 -1.421 1
1 557 . 15 1 1 A 47 47 VAL CA C 47 60.000 62.560 -2.560 1
1 558 . 15 1 1 A 47 47 VAL CB C 47 31.580 33.468 -1.888 1
1 561 . 15 1 1 A 47 47 VAL N N 47 117.720 120.117 -2.397 1
1 562 . 15 1 1 A 48 48 GLN H H 48 7.960 8.236 -0.276 1
1 563 . 15 1 1 A 48 48 GLN HA H 48 4.060 4.215 -0.155 1
1 568 . 15 1 1 A 48 48 GLN C C 48 179.370 178.038 1.332 1
1 569 . 15 1 1 A 48 48 GLN CA C 48 57.350 58.023 -0.673 1
1 570 . 15 1 1 A 48 48 GLN CB C 48 28.990 29.194 -0.204 1
1 572 . 15 1 1 A 48 48 GLN N N 48 119.900 121.401 -1.501 1
1 573 . 15 1 1 A 49 49 LYS H H 49 7.810 8.057 -0.247 1
1 574 . 15 1 1 A 49 49 LYS HA H 49 3.860 3.986 -0.126 1
1 583 . 15 1 1 A 49 49 LYS C C 49 177.890 177.162 0.728 1
1 584 . 15 1 1 A 49 49 LYS CA C 49 58.230 59.320 -1.090 1
1 585 . 15 1 1 A 49 49 LYS CB C 49 30.990 32.127 -1.137 1
1 587 . 15 1 1 A 49 49 LYS N N 49 120.030 120.038 -0.008 1
1 588 . 15 1 1 A 50 50 ASP H H 50 7.570 7.771 -0.201 1
1 589 . 15 1 1 A 50 50 ASP HA H 50 4.700 4.721 -0.021 1
1 590 . 15 1 1 A 50 50 ASP CA C 50 52.950 52.820 0.130 1
1 591 . 15 1 1 A 50 50 ASP CB C 50 38.900 40.485 -1.585 1
1 592 . 15 1 1 A 50 50 ASP N N 50 116.730 118.591 -1.861 1
1 593 . 15 1 1 A 51 51 ALA H H 51 7.570 8.717 -1.147 1
1 594 . 15 1 1 A 51 51 ALA HA H 51 4.200 3.919 0.281 1
1 598 . 15 1 1 A 51 51 ALA C C 51 179.760 179.356 0.404 1
1 599 . 15 1 1 A 51 51 ALA CA C 51 54.200 55.479 -1.279 1
1 600 . 15 1 1 A 51 51 ALA CB C 51 18.110 18.313 -0.203 1
1 601 . 15 1 1 A 51 51 ALA N N 51 118.390 128.357 -9.967 1
1 602 . 15 1 1 A 52 52 ASP H H 52 8.430 7.992 0.438 1
1 603 . 15 1 1 A 52 52 ASP HA H 52 4.600 4.334 0.266 1
1 606 . 15 1 1 A 52 52 ASP C C 52 177.570 178.291 -0.721 1
1 607 . 15 1 1 A 52 52 ASP CA C 52 54.420 57.278 -2.858 1
1 608 . 15 1 1 A 52 52 ASP CB C 52 40.360 42.223 -1.863 1
1 609 . 15 1 1 A 52 52 ASP N N 52 117.530 118.452 -0.922 1
1 610 . 15 1 1 A 53 53 ALA H H 53 7.660 8.054 -0.394 1
1 611 . 15 1 1 A 53 53 ALA HA H 53 3.860 3.979 -0.119 1
1 615 . 15 1 1 A 53 53 ALA C C 53 180.070 180.042 0.028 1
1 616 . 15 1 1 A 53 53 ALA CA C 53 55.590 55.358 0.232 1
1 617 . 15 1 1 A 53 53 ALA CB C 53 18.800 17.949 0.851 1
1 618 . 15 1 1 A 53 53 ALA N N 53 123.450 121.121 2.329 1
1 619 . 15 1 1 A 54 54 VAL H H 54 8.030 7.872 0.158 1
1 620 . 15 1 1 A 54 54 VAL HA H 54 3.240 3.514 -0.274 1
1 628 . 15 1 1 A 54 54 VAL C C 54 177.340 177.616 -0.276 1
1 629 . 15 1 1 A 54 54 VAL CA C 54 66.620 66.594 0.026 1
1 630 . 15 1 1 A 54 54 VAL CB C 54 30.480 31.118 -0.638 1
1 633 . 15 1 1 A 54 54 VAL N N 54 116.150 118.754 -2.604 1
1 634 . 15 1 1 A 55 55 ASP H H 55 7.660 7.867 -0.207 1
1 635 . 15 1 1 A 55 55 ASP HA H 55 4.080 4.272 -0.192 1
1 638 . 15 1 1 A 55 55 ASP C C 55 177.260 178.754 -1.494 1
1 639 . 15 1 1 A 55 55 ASP CA C 55 57.640 57.721 -0.081 1
1 640 . 15 1 1 A 55 55 ASP CB C 55 40.360 40.871 -0.511 1
1 641 . 15 1 1 A 55 55 ASP N N 55 120.830 121.341 -0.511 1
1 642 . 15 1 1 A 56 56 LYS H H 56 7.780 7.580 0.200 1
1 643 . 15 1 1 A 56 56 LYS HA H 56 3.860 4.001 -0.141 1
1 652 . 15 1 1 A 56 56 LYS C C 56 179.530 179.464 0.066 1
1 653 . 15 1 1 A 56 56 LYS CA C 56 59.690 59.662 0.028 1
1 654 . 15 1 1 A 56 56 LYS CB C 56 31.870 32.489 -0.619 1
1 658 . 15 1 1 A 56 56 LYS N N 56 120.010 118.413 1.597 1
1 659 . 15 1 1 A 57 57 ILE H H 57 8.090 7.908 0.182 1
1 660 . 15 1 1 A 57 57 ILE HA H 57 3.390 3.579 -0.189 1
1 670 . 15 1 1 A 57 57 ILE C C 57 176.710 177.730 -1.020 1
1 671 . 15 1 1 A 57 57 ILE CA C 57 64.960 65.218 -0.258 1
1 672 . 15 1 1 A 57 57 ILE CB C 57 38.080 38.283 -0.203 1
1 676 . 15 1 1 A 57 57 ILE N N 57 120.960 120.591 0.369 1
1 677 . 15 1 1 A 58 58 MET H H 58 8.480 8.323 0.157 1
1 678 . 15 1 1 A 58 58 MET HA H 58 3.800 4.078 -0.278 1
1 686 . 15 1 1 A 58 58 MET C C 58 177.570 178.028 -0.458 1
1 687 . 15 1 1 A 58 58 MET CA C 58 58.570 58.379 0.191 1
1 688 . 15 1 1 A 58 58 MET CB C 58 32.570 31.660 0.910 1
1 691 . 15 1 1 A 58 58 MET N N 58 119.160 120.760 -1.600 1
1 692 . 15 1 1 A 59 59 LYS H H 59 7.550 7.908 -0.358 1
1 693 . 15 1 1 A 59 59 LYS HA H 59 3.930 3.927 0.003 1
1 702 . 15 1 1 A 59 59 LYS C C 59 179.530 179.149 0.381 1
1 703 . 15 1 1 A 59 59 LYS CA C 59 58.820 59.776 -0.956 1
1 704 . 15 1 1 A 59 59 LYS CB C 59 32.450 32.552 -0.102 1
1 708 . 15 1 1 A 59 59 LYS N N 59 116.730 119.763 -3.033 1
1 709 . 15 1 1 A 60 60 GLU H H 60 7.470 7.720 -0.250 1
1 710 . 15 1 1 A 60 60 GLU HA H 60 4.050 4.123 -0.073 1
1 715 . 15 1 1 A 60 60 GLU C C 60 178.950 178.761 0.189 1
1 716 . 15 1 1 A 60 60 GLU CA C 60 58.600 58.831 -0.231 1
1 717 . 15 1 1 A 60 60 GLU CB C 60 31.700 29.439 2.261 1
1 719 . 15 1 1 A 60 60 GLU N N 60 116.820 118.794 -1.974 1
1 720 . 15 1 1 A 61 61 LEU H H 61 8.030 7.852 0.178 1
1 721 . 15 1 1 A 61 61 LEU HA H 61 4.310 4.114 0.196 1
1 731 . 15 1 1 A 61 61 LEU C C 61 179.450 177.201 2.249 1
1 732 . 15 1 1 A 61 61 LEU CA C 61 54.840 57.251 -2.411 1
1 733 . 15 1 1 A 61 61 LEU CB C 61 43.820 42.180 1.640 1
1 737 . 15 1 1 A 61 61 LEU N N 61 116.000 120.993 -4.993 1
1 738 . 15 1 1 A 62 62 ASP H H 62 7.890 9.486 -1.596 1
1 739 . 15 1 1 A 62 62 ASP HA H 62 4.660 4.867 -0.207 1
1 742 . 15 1 1 A 62 62 ASP C C 62 177.030 176.210 0.820 1
1 743 . 15 1 1 A 62 62 ASP CA C 62 53.660 53.340 0.320 1
1 744 . 15 1 1 A 62 62 ASP CB C 62 38.700 38.620 0.080 1
1 745 . 15 1 1 A 62 62 ASP N N 62 117.550 118.492 -0.942 1
1 746 . 15 1 1 A 63 63 GLU H H 63 8.430 9.633 -1.203 1
1 747 . 15 1 1 A 63 63 GLU HA H 63 4.020 4.036 -0.016 1
1 752 . 15 1 1 A 63 63 GLU C C 63 178.120 178.636 -0.516 1
1 753 . 15 1 1 A 63 63 GLU CA C 63 58.470 59.113 -0.643 1
1 754 . 15 1 1 A 63 63 GLU CB C 63 30.120 29.497 0.623 1
1 756 . 15 1 1 A 63 63 GLU N N 63 130.230 121.209 9.021 1
1 757 . 15 1 1 A 64 64 ASN H H 64 8.010 8.117 -0.107 1
1 758 . 15 1 1 A 64 64 ASN HA H 64 4.680 4.664 0.016 1
1 761 . 15 1 1 A 64 64 ASN C C 64 177.100 176.100 1.000 1
1 762 . 15 1 1 A 64 64 ASN CA C 64 51.780 53.305 -1.525 1
1 763 . 15 1 1 A 64 64 ASN CB C 64 37.260 38.997 -1.737 1
1 764 . 15 1 1 A 64 64 ASN N N 64 113.640 115.664 -2.024 1
1 765 . 15 1 1 A 65 65 GLY H H 65 7.550 7.894 -0.344 1
1 766 . 15 1 1 A 65 65 GLY HA2 H 65 3.770 3.953 -0.183 1
1 767 . 15 1 1 A 65 65 GLY HA3 H 65 3.770 3.956 -0.186 1
1 768 . 15 1 1 A 65 65 GLY C C 65 178.980 175.002 3.978 1
1 769 . 15 1 1 A 65 65 GLY CA C 65 47.200 46.541 0.659 1
1 770 . 15 1 1 A 65 65 GLY N N 65 113.640 107.615 6.025 1
1 771 . 15 1 1 A 66 66 ASP H H 66 8.110 8.106 0.004 1
1 772 . 15 1 1 A 66 66 ASP HA H 66 4.490 4.583 -0.093 1
1 775 . 15 1 1 A 66 66 ASP C C 66 177.960 177.536 0.424 1
1 776 . 15 1 1 A 66 66 ASP CA C 66 52.960 53.464 -0.504 1
1 777 . 15 1 1 A 66 66 ASP CB C 66 40.540 40.469 0.071 1
1 778 . 15 1 1 A 66 66 ASP N N 66 120.030 120.243 -0.213 1
1 779 . 15 1 1 A 67 67 GLY H H 67 10.260 9.252 1.008 1
1 780 . 15 1 1 A 67 67 GLY HA2 H 67 3.360 3.827 -0.467 1
1 781 . 15 1 1 A 67 67 GLY HA3 H 67 4.000 3.831 0.169 1
1 782 . 15 1 1 A 67 67 GLY C C 67 173.120 173.395 -0.275 1
1 783 . 15 1 1 A 67 67 GLY CA C 67 45.460 45.761 -0.301 1
1 784 . 15 1 1 A 67 67 GLY N N 67 114.100 110.884 3.216 1
1 785 . 15 1 1 A 68 68 GLU H H 68 7.750 8.311 -0.561 1
1 786 . 15 1 1 A 68 68 GLU HA H 68 4.780 4.896 -0.116 1
1 791 . 15 1 1 A 68 68 GLU C C 68 175.930 174.721 1.209 1
1 792 . 15 1 1 A 68 68 GLU CA C 68 54.430 54.337 0.093 1
1 793 . 15 1 1 A 68 68 GLU CB C 68 35.850 33.656 2.194 1
1 795 . 15 1 1 A 68 68 GLU N N 68 118.000 119.202 -1.202 1
1 796 . 15 1 1 A 69 69 VAL H H 69 9.380 8.258 1.122 1
1 797 . 15 1 1 A 69 69 VAL HA H 69 5.260 4.770 0.490 1
1 805 . 15 1 1 A 69 69 VAL C C 69 176.710 173.741 2.969 1
1 806 . 15 1 1 A 69 69 VAL CA C 69 61.280 60.653 0.627 1
1 807 . 15 1 1 A 69 69 VAL CB C 69 33.980 34.797 -0.817 1
1 810 . 15 1 1 A 69 69 VAL N N 69 125.970 120.842 5.128 1
1 811 . 15 1 1 A 70 70 ASP H H 70 9.100 8.649 0.451 1
1 812 . 15 1 1 A 70 70 ASP HA H 70 5.190 4.930 0.260 1
1 815 . 15 1 1 A 70 70 ASP C C 70 175.700 176.874 -1.174 1
1 816 . 15 1 1 A 70 70 ASP CA C 70 52.370 53.087 -0.717 1
1 817 . 15 1 1 A 70 70 ASP CB C 70 40.950 42.389 -1.439 1
1 818 . 15 1 1 A 70 70 ASP N N 70 130.320 127.091 3.229 1
1 819 . 15 1 1 A 71 71 PHE H H 71 9.090 9.069 0.021 1
1 820 . 15 1 1 A 71 71 PHE HA H 71 4.100 4.310 -0.210 1
1 823 . 15 1 1 A 71 71 PHE C C 71 177.000 177.745 -0.745 1
1 824 . 15 1 1 A 71 71 PHE CA C 71 58.230 62.432 -4.202 1
1 825 . 15 1 1 A 71 71 PHE CB C 71 36.910 39.464 -2.554 1
1 826 . 15 1 1 A 71 71 PHE N N 71 119.760 126.448 -6.688 1
1 827 . 15 1 1 A 72 72 GLN H H 72 8.440 8.443 -0.003 1
1 828 . 15 1 1 A 72 72 GLN HA H 72 3.600 4.053 -0.453 1
1 831 . 15 1 1 A 72 72 GLN C C 72 178.820 178.485 0.335 1
1 832 . 15 1 1 A 72 72 GLN CA C 72 59.500 58.780 0.720 1
1 833 . 15 1 1 A 72 72 GLN CB C 72 29.553 28.675 0.878 1
1 835 . 15 1 1 A 72 72 GLN N N 72 121.820 118.018 3.802 1
1 836 . 15 1 1 A 73 73 GLU H H 73 8.290 7.835 0.455 1
1 837 . 15 1 1 A 73 73 GLU HA H 73 4.070 4.070 0.000 1
1 842 . 15 1 1 A 73 73 GLU C C 73 179.370 178.975 0.395 1
1 843 . 15 1 1 A 73 73 GLU CA C 73 58.030 58.808 -0.778 1
1 844 . 15 1 1 A 73 73 GLU CB C 73 29.530 29.980 -0.450 1
1 846 . 15 1 1 A 73 73 GLU N N 73 120.550 119.590 0.960 1
1 847 . 15 1 1 A 74 74 PHE H H 74 8.630 8.847 -0.217 1
1 848 . 15 1 1 A 74 74 PHE HA H 74 4.020 3.986 0.034 1
1 851 . 15 1 1 A 74 74 PHE C C 74 177.890 176.944 0.946 1
1 852 . 15 1 1 A 74 74 PHE CA C 74 60.090 61.312 -1.222 1
1 853 . 15 1 1 A 74 74 PHE CB C 74 38.020 39.032 -1.012 1
1 854 . 15 1 1 A 74 74 PHE N N 74 121.010 121.433 -0.423 1
1 855 . 15 1 1 A 75 75 VAL H H 75 8.080 8.328 -0.248 1
1 856 . 15 1 1 A 75 75 VAL HA H 75 2.860 3.323 -0.463 1
1 864 . 15 1 1 A 75 75 VAL C C 75 177.030 178.354 -1.324 1
1 865 . 15 1 1 A 75 75 VAL CA C 75 66.430 66.272 0.158 1
1 866 . 15 1 1 A 75 75 VAL CB C 75 30.600 31.307 -0.707 1
1 869 . 15 1 1 A 75 75 VAL N N 75 119.460 119.017 0.443 1
1 870 . 15 1 1 A 76 76 VAL H H 76 7.100 8.182 -1.082 1
1 871 . 15 1 1 A 76 76 VAL HA H 76 3.330 3.553 -0.223 1
1 879 . 15 1 1 A 76 76 VAL C C 76 178.670 178.035 0.635 1
1 880 . 15 1 1 A 76 76 VAL CA C 76 67.000 66.589 0.411 1
1 881 . 15 1 1 A 76 76 VAL CB C 76 31.280 31.532 -0.252 1
1 884 . 15 1 1 A 76 76 VAL N N 76 121.030 120.535 0.495 1
1 885 . 15 1 1 A 77 77 LEU H H 77 6.900 8.125 -1.225 1
1 886 . 15 1 1 A 77 77 LEU HA H 77 3.800 4.070 -0.270 1
1 896 . 15 1 1 A 77 77 LEU C C 77 177.960 178.690 -0.730 1
1 897 . 15 1 1 A 77 77 LEU CA C 77 57.710 58.542 -0.832 1
1 898 . 15 1 1 A 77 77 LEU CB C 77 40.070 42.126 -2.056 1
1 902 . 15 1 1 A 77 77 LEU N N 77 120.310 121.062 -0.752 1
1 903 . 15 1 1 A 78 78 VAL H H 78 7.240 7.608 -0.368 1
1 904 . 15 1 1 A 78 78 VAL HA H 78 3.030 3.906 -0.876 1
1 912 . 15 1 1 A 78 78 VAL C C 78 179.600 178.030 1.570 1
1 913 . 15 1 1 A 78 78 VAL CA C 78 66.420 65.125 1.295 1
1 914 . 15 1 1 A 78 78 VAL CB C 78 30.700 31.561 -0.861 1
1 917 . 15 1 1 A 78 78 VAL N N 78 117.180 115.483 1.697 1
1 918 . 15 1 1 A 79 79 ALA H H 79 9.000 8.313 0.687 1
1 919 . 15 1 1 A 79 79 ALA HA H 79 3.610 3.930 -0.320 1
1 923 . 15 1 1 A 79 79 ALA C C 79 182.260 180.080 2.180 1
1 924 . 15 1 1 A 79 79 ALA CA C 79 55.580 55.586 -0.006 1
1 925 . 15 1 1 A 79 79 ALA CB C 79 18.400 18.066 0.334 1
1 926 . 15 1 1 A 79 79 ALA N N 79 126.000 124.893 1.107 1
1 927 . 15 1 1 A 80 80 ALA H H 80 8.000 7.713 0.287 1
1 928 . 15 1 1 A 80 80 ALA HA H 80 4.100 4.078 0.022 1
1 932 . 15 1 1 A 80 80 ALA C C 80 175.460 179.614 -4.154 1
1 933 . 15 1 1 A 80 80 ALA CA C 80 56.020 54.585 1.435 1
1 934 . 15 1 1 A 80 80 ALA CB C 80 18.040 18.177 -0.137 1
1 935 . 15 1 1 A 80 80 ALA N N 80 120.730 120.943 -0.213 1
1 936 . 15 1 1 A 81 81 LEU H H 81 8.460 7.527 0.933 1
1 937 . 15 1 1 A 81 81 LEU HA H 81 4.000 4.200 -0.200 1
1 941 . 15 1 1 A 81 81 LEU C C 81 177.030 179.291 -2.261 1
1 942 . 15 1 1 A 81 81 LEU CA C 81 57.640 57.282 0.358 1
1 943 . 15 1 1 A 81 81 LEU CB C 81 40.620 41.870 -1.250 1
1 945 . 15 1 1 A 81 81 LEU N N 81 119.890 119.146 0.744 1
1 946 . 15 1 1 A 82 82 THR H H 82 8.320 7.928 0.392 1
1 947 . 15 1 1 A 82 82 THR HA H 82 3.800 4.099 -0.299 1
1 952 . 15 1 1 A 82 82 THR C C 82 181.010 176.919 4.091 1
1 953 . 15 1 1 A 82 82 THR CA C 82 68.500 66.057 2.443 1
1 954 . 15 1 1 A 82 82 THR CB C 82 67.400 68.775 -1.375 1
1 956 . 15 1 1 A 82 82 THR N N 82 117.120 113.583 3.537 1
1 957 . 15 1 1 A 83 83 VAL H H 83 8.530 7.478 1.052 1
1 958 . 15 1 1 A 83 83 VAL HA H 83 3.890 3.828 0.062 1
1 966 . 15 1 1 A 83 83 VAL C C 83 178.120 178.213 -0.093 1
1 967 . 15 1 1 A 83 83 VAL CA C 83 67.400 65.144 2.256 1
1 968 . 15 1 1 A 83 83 VAL CB C 83 31.590 31.629 -0.039 1
1 971 . 15 1 1 A 83 83 VAL N N 83 119.760 117.913 1.847 1
1 972 . 15 1 1 A 84 84 ALA H H 84 7.910 8.539 -0.629 1
1 973 . 15 1 1 A 84 84 ALA HA H 84 4.060 4.132 -0.072 1
1 977 . 15 1 1 A 84 84 ALA C C 84 180.560 179.995 0.565 1
1 978 . 15 1 1 A 84 84 ALA CA C 84 55.000 54.997 0.003 1
1 979 . 15 1 1 A 84 84 ALA CB C 84 17.230 18.359 -1.129 1
1 980 . 15 1 1 A 84 84 ALA N N 84 122.620 124.465 -1.845 1
1 981 . 15 1 1 A 85 85 CYS H H 85 8.580 8.190 0.390 1
1 982 . 15 1 1 A 85 85 CYS HA H 85 4.080 4.466 -0.386 1
1 985 . 15 1 1 A 85 85 CYS C C 85 179.060 176.693 2.367 1
1 986 . 15 1 1 A 85 85 CYS CA C 85 63.210 62.162 1.048 1
1 987 . 15 1 1 A 85 85 CYS CB C 85 26.310 27.673 -1.363 1
1 988 . 15 1 1 A 85 85 CYS N N 85 118.730 115.781 2.949 1
1 989 . 15 1 1 A 86 86 ASN H H 86 8.430 8.154 0.276 1
1 990 . 15 1 1 A 86 86 ASN CA C 86 55.860 56.856 -0.996 1
1 991 . 15 1 1 A 86 86 ASN CB C 86 37.440 39.998 -2.558 1
1 992 . 15 1 1 A 86 86 ASN N N 86 119.360 119.318 0.042 1
1 993 . 15 1 1 A 87 87 ASN H H 87 7.880 8.036 -0.156 1
1 994 . 15 1 1 A 87 87 ASN HA H 87 4.600 4.506 0.094 1
1 997 . 15 1 1 A 87 87 ASN C C 87 178.510 177.231 1.279 1
1 998 . 15 1 1 A 87 87 ASN CA C 87 56.470 56.525 -0.055 1
1 999 . 15 1 1 A 87 87 ASN CB C 87 37.500 37.922 -0.422 1
1 1000 . 15 1 1 A 87 87 ASN N N 87 119.480 116.787 2.693 1
1 1001 . 15 1 1 A 88 88 PHE H H 88 8.050 7.713 0.337 1
1 1002 . 15 1 1 A 88 88 PHE HA H 88 4.200 4.556 -0.356 1
1 1005 . 15 1 1 A 88 88 PHE C C 88 178.510 177.589 0.921 1
1 1006 . 15 1 1 A 88 88 PHE CA C 88 56.460 59.991 -3.531 1
1 1007 . 15 1 1 A 88 88 PHE CB C 88 38.500 39.851 -1.351 1
1 1008 . 15 1 1 A 88 88 PHE N N 88 120.280 121.817 -1.537 1
1 1009 . 15 1 1 A 89 89 PHE H H 89 8.020 8.323 -0.303 1
1 1010 . 15 1 1 A 89 89 PHE HA H 89 4.000 4.275 -0.275 1
1 1013 . 15 1 1 A 89 89 PHE C C 89 177.340 177.612 -0.272 1
1 1014 . 15 1 1 A 89 89 PHE CA C 89 59.000 59.896 -0.896 1
1 1015 . 15 1 1 A 89 89 PHE CB C 89 37.430 39.903 -2.473 1
1 1016 . 15 1 1 A 89 89 PHE N N 89 120.910 119.623 1.287 1
1 1017 . 15 1 1 A 90 90 TRP H H 90 7.800 8.643 -0.843 1
1 1018 . 15 1 1 A 90 90 TRP HA H 90 4.460 4.552 -0.092 1
1 1021 . 15 1 1 A 90 90 TRP C C 90 177.340 178.086 -0.746 1
1 1022 . 15 1 1 A 90 90 TRP CA C 90 57.930 59.209 -1.279 1
1 1023 . 15 1 1 A 90 90 TRP CB C 90 42.000 27.967 14.033 1
1 1024 . 15 1 1 A 90 90 TRP N N 90 120.050 118.779 1.271 1
1 1025 . 15 1 1 A 91 91 GLU H H 91 7.800 8.266 -0.466 1
1 1026 . 15 1 1 A 91 91 GLU HA H 91 4.050 3.277 0.773 1
1 1031 . 15 1 1 A 91 91 GLU C C 91 177.570 178.412 -0.842 1
1 1032 . 15 1 1 A 91 91 GLU CA C 91 57.350 58.655 -1.305 1
1 1033 . 15 1 1 A 91 91 GLU CB C 91 29.530 28.397 1.133 1
1 1035 . 15 1 1 A 91 91 GLU N N 91 120.730 119.993 0.737 1
1 1036 . 15 1 1 A 92 92 ASN H H 92 7.800 7.261 0.539 1
1 1037 . 15 1 1 A 92 92 ASN HA H 92 4.630 4.395 0.235 1
1 1040 . 15 1 1 A 92 92 ASN C C 92 174.450 174.874 -0.424 1
1 1041 . 15 1 1 A 92 92 ASN CA C 92 52.960 55.011 -2.051 1
1 1042 . 15 1 1 A 92 92 ASN CB C 92 29.530 38.640 -9.110 1
1 1043 . 15 1 1 A 92 92 ASN N N 92 119.410 118.828 0.582 1
1 5 . 16 1 1 A 2 2 SER H H 2 9.000 8.061 0.939 1
1 6 . 16 1 1 A 2 2 SER HA H 2 4.690 4.893 -0.203 1
1 9 . 16 1 1 A 2 2 SER C C 2 176.170 174.640 1.530 1
1 10 . 16 1 1 A 2 2 SER CA C 2 57.340 57.904 -0.564 1
1 11 . 16 1 1 A 2 2 SER CB C 2 65.550 63.385 2.165 1
1 12 . 16 1 1 A 2 2 SER N N 2 119.330 113.984 5.346 1
1 13 . 16 1 1 A 3 3 GLU H H 3 9.350 8.124 1.226 1
1 14 . 16 1 1 A 3 3 GLU HA H 3 4.060 3.953 0.107 1
1 17 . 16 1 1 A 3 3 GLU C C 3 180.150 179.455 0.695 1
1 18 . 16 1 1 A 3 3 GLU CA C 3 60.280 58.920 1.360 1
1 19 . 16 1 1 A 3 3 GLU CB C 3 29.230 29.359 -0.129 1
1 21 . 16 1 1 A 3 3 GLU N N 3 125.350 122.016 3.334 1
1 22 . 16 1 1 A 4 4 LEU H H 4 9.060 8.474 0.586 1
1 23 . 16 1 1 A 4 4 LEU HA H 4 4.080 3.947 0.133 1
1 33 . 16 1 1 A 4 4 LEU C C 4 177.890 179.373 -1.483 1
1 34 . 16 1 1 A 4 4 LEU CA C 4 58.090 58.067 0.023 1
1 35 . 16 1 1 A 4 4 LEU CB C 4 42.120 41.211 0.909 1
1 39 . 16 1 1 A 4 4 LEU N N 4 121.090 120.738 0.352 1
1 40 . 16 1 1 A 5 5 GLU H H 5 8.340 8.269 0.071 1
1 41 . 16 1 1 A 5 5 GLU HA H 5 4.050 3.910 0.140 1
1 46 . 16 1 1 A 5 5 GLU C C 5 177.030 179.400 -2.370 1
1 47 . 16 1 1 A 5 5 GLU CA C 5 59.840 59.300 0.540 1
1 48 . 16 1 1 A 5 5 GLU CB C 5 28.940 29.047 -0.107 1
1 50 . 16 1 1 A 5 5 GLU N N 5 119.780 119.887 -0.107 1
1 51 . 16 1 1 A 6 6 THR H H 6 8.370 7.775 0.595 1
1 52 . 16 1 1 A 6 6 THR HA H 6 4.310 3.878 0.432 1
1 57 . 16 1 1 A 6 6 THR C C 6 177.340 176.885 0.455 1
1 58 . 16 1 1 A 6 6 THR CA C 6 66.630 66.360 0.270 1
1 59 . 16 1 1 A 6 6 THR CB C 6 68.650 68.507 0.143 1
1 61 . 16 1 1 A 6 6 THR N N 6 116.940 117.026 -0.086 1
1 62 . 16 1 1 A 7 7 ALA H H 7 8.270 7.840 0.430 1
1 63 . 16 1 1 A 7 7 ALA HA H 7 4.190 4.004 0.186 1
1 67 . 16 1 1 A 7 7 ALA C C 7 179.760 179.336 0.424 1
1 68 . 16 1 1 A 7 7 ALA CA C 7 55.880 55.053 0.827 1
1 69 . 16 1 1 A 7 7 ALA CB C 7 17.720 18.050 -0.330 1
1 70 . 16 1 1 A 7 7 ALA N N 7 127.400 124.099 3.301 1
1 71 . 16 1 1 A 8 8 MET H H 8 8.110 7.611 0.499 1
1 72 . 16 1 1 A 8 8 MET HA H 8 4.020 4.140 -0.120 1
1 80 . 16 1 1 A 8 8 MET C C 8 178.510 178.030 0.480 1
1 81 . 16 1 1 A 8 8 MET CA C 8 60.580 57.973 2.607 1
1 82 . 16 1 1 A 8 8 MET CB C 8 33.630 32.238 1.392 1
1 85 . 16 1 1 A 8 8 MET N N 8 117.520 118.307 -0.787 1
1 86 . 16 1 1 A 9 9 GLU H H 9 8.210 7.784 0.426 1
1 87 . 16 1 1 A 9 9 GLU HA H 9 3.830 4.069 -0.239 1
1 92 . 16 1 1 A 9 9 GLU C C 9 179.140 178.679 0.461 1
1 93 . 16 1 1 A 9 9 GLU CA C 9 59.690 59.214 0.476 1
1 94 . 16 1 1 A 9 9 GLU CB C 9 29.530 29.145 0.385 1
1 96 . 16 1 1 A 9 9 GLU N N 9 118.560 118.220 0.340 1
1 97 . 16 1 1 A 10 10 THR H H 10 8.490 7.474 1.016 1
1 98 . 16 1 1 A 10 10 THR HA H 10 4.000 4.020 -0.020 1
1 103 . 16 1 1 A 10 10 THR C C 10 176.010 176.132 -0.122 1
1 104 . 16 1 1 A 10 10 THR CA C 10 67.110 65.802 1.308 1
1 105 . 16 1 1 A 10 10 THR CB C 10 67.770 69.024 -1.254 1
1 107 . 16 1 1 A 10 10 THR N N 10 118.310 116.188 2.122 1
1 108 . 16 1 1 A 11 11 LEU H H 11 7.920 7.592 0.328 1
1 109 . 16 1 1 A 11 11 LEU HA H 11 3.930 3.449 0.481 1
1 119 . 16 1 1 A 11 11 LEU C C 11 178.820 178.671 0.149 1
1 120 . 16 1 1 A 11 11 LEU CA C 11 59.690 57.721 1.969 1
1 121 . 16 1 1 A 11 11 LEU CB C 11 41.920 41.326 0.594 1
1 125 . 16 1 1 A 11 11 LEU N N 11 121.150 120.854 0.296 1
1 126 . 16 1 1 A 12 12 ILE H H 12 7.440 7.612 -0.172 1
1 127 . 16 1 1 A 12 12 ILE HA H 12 3.640 3.801 -0.161 1
1 137 . 16 1 1 A 12 12 ILE C C 12 179.530 178.826 0.704 1
1 138 . 16 1 1 A 12 12 ILE CA C 12 63.740 65.337 -1.597 1
1 139 . 16 1 1 A 12 12 ILE CB C 12 38.800 37.588 1.212 1
1 143 . 16 1 1 A 12 12 ILE N N 12 118.010 120.241 -2.231 1
1 144 . 16 1 1 A 13 13 ASN H H 13 8.930 8.156 0.774 1
1 145 . 16 1 1 A 13 13 ASN HA H 13 4.520 5.089 -0.569 1
1 148 . 16 1 1 A 13 13 ASN C C 13 179.450 177.819 1.631 1
1 149 . 16 1 1 A 13 13 ASN CA C 13 56.470 56.272 0.198 1
1 150 . 16 1 1 A 13 13 ASN CB C 13 37.930 38.769 -0.839 1
1 151 . 16 1 1 A 13 13 ASN N N 13 121.820 119.455 2.365 1
1 152 . 16 1 1 A 14 14 VAL H H 14 9.180 8.042 1.138 1
1 153 . 16 1 1 A 14 14 VAL HA H 14 3.830 3.709 0.121 1
1 161 . 16 1 1 A 14 14 VAL CA C 14 65.840 65.019 0.821 1
1 162 . 16 1 1 A 14 14 VAL CB C 14 31.290 31.562 -0.272 1
1 165 . 16 1 1 A 14 14 VAL N N 14 122.040 118.833 3.207 1
1 166 . 16 1 1 A 15 15 PHE H H 15 7.590 8.142 -0.552 1
1 167 . 16 1 1 A 15 15 PHE HA H 15 3.360 4.135 -0.775 1
1 170 . 16 1 1 A 15 15 PHE C C 15 177.890 179.192 -1.302 1
1 171 . 16 1 1 A 15 15 PHE CA C 15 62.030 60.169 1.861 1
1 172 . 16 1 1 A 15 15 PHE CB C 15 38.900 38.129 0.771 1
1 173 . 16 1 1 A 15 15 PHE N N 15 118.290 120.443 -2.153 1
1 174 . 16 1 1 A 16 16 HIS H H 16 7.790 8.131 -0.341 1
1 175 . 16 1 1 A 16 16 HIS HA H 16 4.890 4.453 0.437 1
1 178 . 16 1 1 A 16 16 HIS C C 16 177.810 177.830 -0.020 1
1 179 . 16 1 1 A 16 16 HIS CA C 16 59.100 58.127 0.973 1
1 180 . 16 1 1 A 16 16 HIS CB C 16 28.060 28.476 -0.416 1
1 181 . 16 1 1 A 16 16 HIS N N 16 118.290 118.309 -0.019 1
1 182 . 16 1 1 A 17 17 ALA H H 17 8.040 7.408 0.632 1
1 183 . 16 1 1 A 17 17 ALA HA H 17 4.050 3.935 0.115 1
1 187 . 16 1 1 A 17 17 ALA C C 17 179.600 179.906 -0.306 1
1 188 . 16 1 1 A 17 17 ALA CA C 17 54.000 55.170 -1.170 1
1 189 . 16 1 1 A 17 17 ALA CB C 17 17.520 18.585 -1.065 1
1 190 . 16 1 1 A 17 17 ALA N N 17 124.410 123.567 0.843 1
1 191 . 16 1 1 A 18 18 HIS H H 18 7.000 7.431 -0.431 1
1 192 . 16 1 1 A 18 18 HIS HA H 18 4.330 4.426 -0.096 1
1 195 . 16 1 1 A 18 18 HIS C C 18 176.320 177.834 -1.514 1
1 196 . 16 1 1 A 18 18 HIS CA C 18 57.350 58.994 -1.644 1
1 197 . 16 1 1 A 18 18 HIS CB C 18 32.920 30.498 2.422 1
1 198 . 16 1 1 A 18 18 HIS N N 18 115.160 115.992 -0.832 1
1 199 . 16 1 1 A 19 19 SER H H 19 8.380 8.261 0.119 1
1 200 . 16 1 1 A 19 19 SER HA H 19 3.640 4.044 -0.404 1
1 203 . 16 1 1 A 19 19 SER C C 19 177.340 176.037 1.303 1
1 204 . 16 1 1 A 19 19 SER CA C 19 60.160 61.175 -1.015 1
1 205 . 16 1 1 A 19 19 SER CB C 19 61.000 63.166 -2.166 1
1 206 . 16 1 1 A 19 19 SER N N 19 114.380 115.289 -0.909 1
1 207 . 16 1 1 A 20 20 GLY H H 20 7.600 8.059 -0.459 1
1 208 . 16 1 1 A 20 20 GLY HA2 H 20 3.680 3.927 -0.247 1
1 209 . 16 1 1 A 20 20 GLY HA3 H 20 4.000 3.959 0.041 1
1 210 . 16 1 1 A 20 20 GLY C C 20 174.140 174.301 -0.161 1
1 211 . 16 1 1 A 20 20 GLY CA C 20 47.000 45.386 1.614 1
1 212 . 16 1 1 A 20 20 GLY N N 20 112.550 107.433 5.117 1
1 213 . 16 1 1 A 21 21 LYS H H 21 7.230 7.932 -0.702 1
1 214 . 16 1 1 A 21 21 LYS HA H 21 3.860 4.370 -0.510 1
1 223 . 16 1 1 A 21 21 LYS C C 21 177.730 178.070 -0.340 1
1 224 . 16 1 1 A 21 21 LYS CA C 21 59.110 56.926 2.184 1
1 225 . 16 1 1 A 21 21 LYS CB C 21 32.460 34.892 -2.432 1
1 229 . 16 1 1 A 21 21 LYS N N 21 123.240 118.317 4.923 1
1 230 . 16 1 1 A 22 22 GLU H H 22 9.350 7.891 1.459 1
1 231 . 16 1 1 A 22 22 GLU HA H 22 4.610 4.414 0.196 1
1 236 . 16 1 1 A 22 22 GLU C C 22 177.420 175.820 1.600 1
1 237 . 16 1 1 A 22 22 GLU CA C 22 53.700 56.345 -2.645 1
1 238 . 16 1 1 A 22 22 GLU CB C 22 32.000 30.019 1.981 1
1 240 . 16 1 1 A 22 22 GLU N N 22 116.770 116.005 0.765 1
1 241 . 16 1 1 A 23 23 GLY H H 23 7.570 7.635 -0.065 1
1 242 . 16 1 1 A 23 23 GLY HA2 H 23 3.630 4.010 -0.380 1
1 243 . 16 1 1 A 23 23 GLY HA3 H 23 3.880 4.017 -0.137 1
1 244 . 16 1 1 A 23 23 GLY C C 23 173.980 172.172 1.808 1
1 245 . 16 1 1 A 23 23 GLY CA C 23 45.250 45.474 -0.224 1
1 246 . 16 1 1 A 23 23 GLY N N 23 112.180 107.453 4.727 1
1 247 . 16 1 1 A 24 24 ASP H H 24 8.680 8.220 0.460 1
1 248 . 16 1 1 A 24 24 ASP HA H 24 4.380 4.797 -0.417 1
1 251 . 16 1 1 A 24 24 ASP C C 24 178.590 177.987 0.603 1
1 252 . 16 1 1 A 24 24 ASP CA C 24 60.000 53.461 6.539 1
1 253 . 16 1 1 A 24 24 ASP CB C 24 27.480 41.739 -14.259 1
1 254 . 16 1 1 A 24 24 ASP N N 24 127.470 121.843 5.627 1
1 255 . 16 1 1 A 25 25 LYS H H 25 9.270 8.673 0.597 1
1 256 . 16 1 1 A 25 25 LYS HA H 25 4.250 3.757 0.493 1
1 265 . 16 1 1 A 25 25 LYS C C 25 177.030 176.760 0.270 1
1 266 . 16 1 1 A 25 25 LYS CA C 25 60.000 59.726 0.274 1
1 267 . 16 1 1 A 25 25 LYS CB C 25 31.170 32.206 -1.036 1
1 271 . 16 1 1 A 25 25 LYS N N 25 132.960 121.542 11.418 1
1 272 . 16 1 1 A 26 26 TYR H H 26 9.430 7.816 1.614 1
1 273 . 16 1 1 A 26 26 TYR HA H 26 4.640 4.837 -0.197 1
1 276 . 16 1 1 A 26 26 TYR C C 26 174.290 174.933 -0.643 1
1 277 . 16 1 1 A 26 26 TYR CA C 26 56.010 57.333 -1.323 1
1 278 . 16 1 1 A 26 26 TYR CB C 26 37.730 39.035 -1.305 1
1 279 . 16 1 1 A 26 26 TYR N N 26 120.650 113.814 6.836 1
1 280 . 16 1 1 A 27 27 LYS H H 27 7.110 7.374 -0.264 1
1 281 . 16 1 1 A 27 27 LYS HA H 27 5.110 5.032 0.078 1
1 290 . 16 1 1 A 27 27 LYS C C 27 175.150 173.812 1.338 1
1 291 . 16 1 1 A 27 27 LYS CA C 27 55.070 55.260 -0.190 1
1 292 . 16 1 1 A 27 27 LYS CB C 27 38.900 36.157 2.743 1
1 296 . 16 1 1 A 27 27 LYS N N 27 115.830 120.474 -4.644 1
1 297 . 16 1 1 A 28 28 LEU H H 28 9.820 8.460 1.360 1
1 298 . 16 1 1 A 28 28 LEU HA H 28 5.080 4.990 0.090 1
1 308 . 16 1 1 A 28 28 LEU C C 28 176.640 175.317 1.323 1
1 309 . 16 1 1 A 28 28 LEU CA C 28 52.660 53.774 -1.114 1
1 310 . 16 1 1 A 28 28 LEU CB C 28 42.710 44.151 -1.441 1
1 314 . 16 1 1 A 28 28 LEU N N 28 126.930 128.157 -1.227 1
1 315 . 16 1 1 A 29 29 SER H H 29 9.890 8.226 1.664 1
1 316 . 16 1 1 A 29 29 SER HA H 29 4.530 4.850 -0.320 1
1 319 . 16 1 1 A 29 29 SER C C 29 174.990 174.700 0.290 1
1 320 . 16 1 1 A 29 29 SER CA C 29 56.180 57.130 -0.950 1
1 321 . 16 1 1 A 29 29 SER CB C 29 65.550 66.569 -1.019 1
1 322 . 16 1 1 A 29 29 SER N N 29 121.600 119.581 2.019 1
1 323 . 16 1 1 A 30 30 LYS H H 30 8.850 8.784 0.066 1
1 324 . 16 1 1 A 30 30 LYS HA H 30 3.850 3.872 -0.022 1
1 333 . 16 1 1 A 30 30 LYS C C 30 175.620 178.171 -2.551 1
1 334 . 16 1 1 A 30 30 LYS CA C 30 60.860 60.114 0.746 1
1 335 . 16 1 1 A 30 30 LYS CB C 30 31.290 32.164 -0.874 1
1 339 . 16 1 1 A 30 30 LYS N N 30 121.260 124.597 -3.337 1
1 340 . 16 1 1 A 31 31 LYS H H 31 7.970 7.991 -0.021 1
1 341 . 16 1 1 A 31 31 LYS HA H 31 3.880 4.024 -0.144 1
1 350 . 16 1 1 A 31 31 LYS C C 31 179.290 178.608 0.682 1
1 351 . 16 1 1 A 31 31 LYS CA C 31 59.110 58.754 0.356 1
1 352 . 16 1 1 A 31 31 LYS CB C 31 32.640 31.561 1.079 1
1 356 . 16 1 1 A 31 31 LYS N N 31 121.260 118.172 3.088 1
1 357 . 16 1 1 A 32 32 GLU H H 32 7.510 8.053 -0.543 1
1 358 . 16 1 1 A 32 32 GLU HA H 32 3.830 4.033 -0.203 1
1 363 . 16 1 1 A 32 32 GLU C C 32 179.290 179.229 0.061 1
1 364 . 16 1 1 A 32 32 GLU CA C 32 58.590 58.796 -0.206 1
1 365 . 16 1 1 A 32 32 GLU CB C 32 30.120 29.991 0.129 1
1 367 . 16 1 1 A 32 32 GLU N N 32 120.090 119.153 0.937 1
1 368 . 16 1 1 A 33 33 LEU H H 33 8.970 7.590 1.380 1
1 369 . 16 1 1 A 33 33 LEU HA H 33 3.830 3.263 0.567 1
1 379 . 16 1 1 A 33 33 LEU C C 33 178.200 178.511 -0.311 1
1 380 . 16 1 1 A 33 33 LEU CA C 33 57.930 57.690 0.240 1
1 381 . 16 1 1 A 33 33 LEU CB C 33 40.660 41.032 -0.372 1
1 385 . 16 1 1 A 33 33 LEU N N 33 120.200 119.029 1.171 1
1 386 . 16 1 1 A 34 34 LYS H H 34 8.230 7.617 0.613 1
1 387 . 16 1 1 A 34 34 LYS HA H 34 3.550 3.807 -0.257 1
1 396 . 16 1 1 A 34 34 LYS C C 34 178.040 178.528 -0.488 1
1 397 . 16 1 1 A 34 34 LYS CA C 34 60.720 59.586 1.134 1
1 398 . 16 1 1 A 34 34 LYS CB C 34 31.980 31.839 0.141 1
1 402 . 16 1 1 A 34 34 LYS N N 34 120.780 119.027 1.753 1
1 403 . 16 1 1 A 35 35 ASP H H 35 7.990 7.701 0.289 1
1 404 . 16 1 1 A 35 35 ASP HA H 35 4.250 4.462 -0.212 1
1 407 . 16 1 1 A 35 35 ASP C C 35 179.060 178.865 0.195 1
1 408 . 16 1 1 A 35 35 ASP CA C 35 56.830 57.127 -0.297 1
1 409 . 16 1 1 A 35 35 ASP CB C 35 40.440 40.791 -0.351 1
1 410 . 16 1 1 A 35 35 ASP N N 35 119.550 119.622 -0.072 1
1 411 . 16 1 1 A 36 36 LEU H H 36 8.130 7.466 0.664 1
1 412 . 16 1 1 A 36 36 LEU HA H 36 2.580 3.849 -1.269 1
1 422 . 16 1 1 A 36 36 LEU C C 36 179.450 179.333 0.117 1
1 423 . 16 1 1 A 36 36 LEU CA C 36 59.980 57.766 2.214 1
1 424 . 16 1 1 A 36 36 LEU CB C 36 42.180 41.559 0.621 1
1 428 . 16 1 1 A 36 36 LEU N N 36 125.560 120.165 5.395 1
1 429 . 16 1 1 A 37 37 LEU H H 37 8.740 7.749 0.991 1
1 430 . 16 1 1 A 37 37 LEU HA H 37 3.580 3.879 -0.299 1
1 440 . 16 1 1 A 37 37 LEU C C 37 179.290 179.228 0.062 1
1 441 . 16 1 1 A 37 37 LEU CA C 37 58.230 58.235 -0.005 1
1 442 . 16 1 1 A 37 37 LEU CB C 37 41.590 41.402 0.188 1
1 446 . 16 1 1 A 37 37 LEU N N 37 120.520 119.237 1.283 1
1 447 . 16 1 1 A 38 38 GLN H H 38 8.520 8.169 0.351 1
1 448 . 16 1 1 A 38 38 GLN HA H 38 4.000 4.051 -0.051 1
1 453 . 16 1 1 A 38 38 GLN C C 38 177.960 178.336 -0.376 1
1 454 . 16 1 1 A 38 38 GLN CA C 38 58.210 58.204 0.006 1
1 455 . 16 1 1 A 38 38 GLN CB C 38 28.650 27.870 0.780 1
1 457 . 16 1 1 A 38 38 GLN N N 38 116.740 117.593 -0.853 1
1 458 . 16 1 1 A 39 39 THR H H 39 7.910 7.602 0.308 1
1 459 . 16 1 1 A 39 39 THR HA H 39 4.210 3.857 0.353 1
1 464 . 16 1 1 A 39 39 THR C C 39 177.180 175.747 1.433 1
1 465 . 16 1 1 A 39 39 THR CA C 39 64.730 67.251 -2.521 1
1 466 . 16 1 1 A 39 39 THR CB C 39 69.650 68.824 0.826 1
1 468 . 16 1 1 A 39 39 THR N N 39 111.400 116.800 -5.400 1
1 469 . 16 1 1 A 40 40 GLU H H 40 8.590 7.365 1.225 1
1 470 . 16 1 1 A 40 40 GLU HA H 40 4.680 4.453 0.227 1
1 475 . 16 1 1 A 40 40 GLU C C 40 178.280 177.028 1.252 1
1 476 . 16 1 1 A 40 40 GLU CA C 40 55.880 56.445 -0.565 1
1 477 . 16 1 1 A 40 40 GLU CB C 40 30.990 30.283 0.707 1
1 479 . 16 1 1 A 40 40 GLU N N 40 117.840 116.367 1.473 1
1 480 . 16 1 1 A 41 41 LEU H H 41 7.680 7.457 0.223 1
1 481 . 16 1 1 A 41 41 LEU HA H 41 5.080 4.788 0.292 1
1 491 . 16 1 1 A 41 41 LEU C C 41 179.450 177.199 2.251 1
1 492 . 16 1 1 A 41 41 LEU CA C 41 53.830 53.696 0.134 1
1 493 . 16 1 1 A 41 41 LEU CB C 41 41.360 42.818 -1.458 1
1 497 . 16 1 1 A 41 41 LEU N N 41 121.410 119.825 1.585 1
1 498 . 16 1 1 A 42 42 SER H H 42 8.380 8.251 0.129 1
1 499 . 16 1 1 A 42 42 SER HA H 42 4.130 3.984 0.146 1
1 502 . 16 1 1 A 42 42 SER C C 42 176.640 176.774 -0.134 1
1 503 . 16 1 1 A 42 42 SER CA C 42 61.280 62.074 -0.794 1
1 504 . 16 1 1 A 42 42 SER CB C 42 63.040 62.908 0.132 1
1 505 . 16 1 1 A 42 42 SER N N 42 117.420 117.256 0.164 1
1 506 . 16 1 1 A 43 43 SER H H 43 8.900 8.649 0.251 1
1 507 . 16 1 1 A 43 43 SER HA H 43 4.290 4.294 -0.004 1
1 510 . 16 1 1 A 43 43 SER C C 43 175.620 176.857 -1.237 1
1 511 . 16 1 1 A 43 43 SER CA C 43 60.860 61.202 -0.342 1
1 512 . 16 1 1 A 43 43 SER CB C 43 62.910 62.348 0.562 1
1 513 . 16 1 1 A 43 43 SER N N 43 117.580 116.552 1.028 1
1 514 . 16 1 1 A 44 44 PHE H H 44 7.880 8.043 -0.163 1
1 515 . 16 1 1 A 44 44 PHE HA H 44 4.240 4.221 0.019 1
1 518 . 16 1 1 A 44 44 PHE C C 44 176.950 175.585 1.365 1
1 519 . 16 1 1 A 44 44 PHE CA C 44 62.710 61.318 1.392 1
1 520 . 16 1 1 A 44 44 PHE CB C 44 39.020 39.011 0.009 1
1 521 . 16 1 1 A 44 44 PHE N N 44 119.480 122.395 -2.915 1
1 522 . 16 1 1 A 45 45 LEU H H 45 8.060 8.155 -0.095 1
1 523 . 16 1 1 A 45 45 LEU HA H 45 3.810 3.859 -0.049 1
1 533 . 16 1 1 A 45 45 LEU C C 45 177.500 175.794 1.706 1
1 534 . 16 1 1 A 45 45 LEU CA C 45 59.980 55.932 4.048 1
1 535 . 16 1 1 A 45 45 LEU CB C 45 39.640 42.519 -2.879 1
1 538 . 16 1 1 A 45 45 LEU N N 45 118.010 121.821 -3.811 1
1 539 . 16 1 1 A 46 46 ASP H H 46 8.150 8.514 -0.364 1
1 540 . 16 1 1 A 46 46 ASP HA H 46 4.470 4.611 -0.141 1
1 543 . 16 1 1 A 46 46 ASP C C 46 179.920 176.093 3.827 1
1 544 . 16 1 1 A 46 46 ASP CA C 46 52.950 53.240 -0.290 1
1 545 . 16 1 1 A 46 46 ASP CB C 46 40.000 40.752 -0.752 1
1 546 . 16 1 1 A 46 46 ASP N N 46 119.460 126.117 -6.657 1
1 547 . 16 1 1 A 47 47 VAL H H 47 8.010 8.409 -0.399 1
1 548 . 16 1 1 A 47 47 VAL HA H 47 3.800 4.315 -0.515 1
1 556 . 16 1 1 A 47 47 VAL C C 47 175.460 176.841 -1.381 1
1 557 . 16 1 1 A 47 47 VAL CA C 47 60.000 62.683 -2.683 1
1 558 . 16 1 1 A 47 47 VAL CB C 47 31.580 33.428 -1.848 1
1 561 . 16 1 1 A 47 47 VAL N N 47 117.720 120.016 -2.296 1
1 562 . 16 1 1 A 48 48 GLN H H 48 7.960 8.269 -0.309 1
1 563 . 16 1 1 A 48 48 GLN HA H 48 4.060 4.070 -0.010 1
1 568 . 16 1 1 A 48 48 GLN C C 48 179.370 178.398 0.972 1
1 569 . 16 1 1 A 48 48 GLN CA C 48 57.350 58.712 -1.362 1
1 570 . 16 1 1 A 48 48 GLN CB C 48 28.990 28.408 0.582 1
1 572 . 16 1 1 A 48 48 GLN N N 48 119.900 121.966 -2.066 1
1 573 . 16 1 1 A 49 49 LYS H H 49 7.810 8.018 -0.208 1
1 574 . 16 1 1 A 49 49 LYS HA H 49 3.860 4.080 -0.220 1
1 583 . 16 1 1 A 49 49 LYS C C 49 177.890 176.657 1.233 1
1 584 . 16 1 1 A 49 49 LYS CA C 49 58.230 59.086 -0.856 1
1 585 . 16 1 1 A 49 49 LYS CB C 49 30.990 32.237 -1.247 1
1 587 . 16 1 1 A 49 49 LYS N N 49 120.030 119.923 0.107 1
1 588 . 16 1 1 A 50 50 ASP H H 50 7.570 7.506 0.064 1
1 589 . 16 1 1 A 50 50 ASP HA H 50 4.700 4.912 -0.212 1
1 590 . 16 1 1 A 50 50 ASP CA C 50 52.950 52.680 0.270 1
1 591 . 16 1 1 A 50 50 ASP CB C 50 38.900 39.041 -0.141 1
1 592 . 16 1 1 A 50 50 ASP N N 50 116.730 118.314 -1.584 1
1 593 . 16 1 1 A 51 51 ALA H H 51 7.570 8.624 -1.054 1
1 594 . 16 1 1 A 51 51 ALA HA H 51 4.200 3.949 0.251 1
1 598 . 16 1 1 A 51 51 ALA C C 51 179.760 179.344 0.416 1
1 599 . 16 1 1 A 51 51 ALA CA C 51 54.200 55.313 -1.113 1
1 600 . 16 1 1 A 51 51 ALA CB C 51 18.110 18.468 -0.358 1
1 601 . 16 1 1 A 51 51 ALA N N 51 118.390 127.777 -9.387 1
1 602 . 16 1 1 A 52 52 ASP H H 52 8.430 8.281 0.149 1
1 603 . 16 1 1 A 52 52 ASP HA H 52 4.600 4.347 0.253 1
1 606 . 16 1 1 A 52 52 ASP C C 52 177.570 178.029 -0.459 1
1 607 . 16 1 1 A 52 52 ASP CA C 52 54.420 57.136 -2.716 1
1 608 . 16 1 1 A 52 52 ASP CB C 52 40.360 42.151 -1.791 1
1 609 . 16 1 1 A 52 52 ASP N N 52 117.530 118.547 -1.017 1
1 610 . 16 1 1 A 53 53 ALA H H 53 7.660 7.932 -0.272 1
1 611 . 16 1 1 A 53 53 ALA HA H 53 3.860 4.002 -0.142 1
1 615 . 16 1 1 A 53 53 ALA C C 53 180.070 180.671 -0.601 1
1 616 . 16 1 1 A 53 53 ALA CA C 53 55.590 55.374 0.216 1
1 617 . 16 1 1 A 53 53 ALA CB C 53 18.800 17.994 0.806 1
1 618 . 16 1 1 A 53 53 ALA N N 53 123.450 121.431 2.019 1
1 619 . 16 1 1 A 54 54 VAL H H 54 8.030 7.850 0.180 1
1 620 . 16 1 1 A 54 54 VAL HA H 54 3.240 3.602 -0.362 1
1 628 . 16 1 1 A 54 54 VAL C C 54 177.340 177.766 -0.426 1
1 629 . 16 1 1 A 54 54 VAL CA C 54 66.620 66.134 0.486 1
1 630 . 16 1 1 A 54 54 VAL CB C 54 30.480 30.959 -0.479 1
1 633 . 16 1 1 A 54 54 VAL N N 54 116.150 117.854 -1.704 1
1 634 . 16 1 1 A 55 55 ASP H H 55 7.660 7.860 -0.200 1
1 635 . 16 1 1 A 55 55 ASP HA H 55 4.080 4.368 -0.288 1
1 638 . 16 1 1 A 55 55 ASP C C 55 177.260 179.351 -2.091 1
1 639 . 16 1 1 A 55 55 ASP CA C 55 57.640 57.330 0.310 1
1 640 . 16 1 1 A 55 55 ASP CB C 55 40.360 40.073 0.287 1
1 641 . 16 1 1 A 55 55 ASP N N 55 120.830 121.765 -0.935 1
1 642 . 16 1 1 A 56 56 LYS H H 56 7.780 7.541 0.239 1
1 643 . 16 1 1 A 56 56 LYS HA H 56 3.860 4.019 -0.159 1
1 652 . 16 1 1 A 56 56 LYS C C 56 179.530 179.516 0.014 1
1 653 . 16 1 1 A 56 56 LYS CA C 56 59.690 59.732 -0.042 1
1 654 . 16 1 1 A 56 56 LYS CB C 56 31.870 32.510 -0.640 1
1 658 . 16 1 1 A 56 56 LYS N N 56 120.010 119.629 0.381 1
1 659 . 16 1 1 A 57 57 ILE H H 57 8.090 7.825 0.265 1
1 660 . 16 1 1 A 57 57 ILE HA H 57 3.390 3.636 -0.246 1
1 670 . 16 1 1 A 57 57 ILE C C 57 176.710 177.775 -1.065 1
1 671 . 16 1 1 A 57 57 ILE CA C 57 64.960 65.098 -0.138 1
1 672 . 16 1 1 A 57 57 ILE CB C 57 38.080 38.442 -0.362 1
1 676 . 16 1 1 A 57 57 ILE N N 57 120.960 120.512 0.448 1
1 677 . 16 1 1 A 58 58 MET H H 58 8.480 8.387 0.093 1
1 678 . 16 1 1 A 58 58 MET HA H 58 3.800 4.072 -0.272 1
1 686 . 16 1 1 A 58 58 MET C C 58 177.570 178.016 -0.446 1
1 687 . 16 1 1 A 58 58 MET CA C 58 58.570 58.435 0.135 1
1 688 . 16 1 1 A 58 58 MET CB C 58 32.570 31.627 0.943 1
1 691 . 16 1 1 A 58 58 MET N N 58 119.160 120.606 -1.446 1
1 692 . 16 1 1 A 59 59 LYS H H 59 7.550 7.868 -0.318 1
1 693 . 16 1 1 A 59 59 LYS HA H 59 3.930 3.955 -0.025 1
1 702 . 16 1 1 A 59 59 LYS C C 59 179.530 178.796 0.734 1
1 703 . 16 1 1 A 59 59 LYS CA C 59 58.820 59.706 -0.886 1
1 704 . 16 1 1 A 59 59 LYS CB C 59 32.450 32.535 -0.085 1
1 708 . 16 1 1 A 59 59 LYS N N 59 116.730 119.578 -2.848 1
1 709 . 16 1 1 A 60 60 GLU H H 60 7.470 7.681 -0.211 1
1 710 . 16 1 1 A 60 60 GLU HA H 60 4.050 4.164 -0.114 1
1 715 . 16 1 1 A 60 60 GLU C C 60 178.950 178.781 0.169 1
1 716 . 16 1 1 A 60 60 GLU CA C 60 58.600 58.928 -0.328 1
1 717 . 16 1 1 A 60 60 GLU CB C 60 31.700 29.227 2.473 1
1 719 . 16 1 1 A 60 60 GLU N N 60 116.820 118.683 -1.863 1
1 720 . 16 1 1 A 61 61 LEU H H 61 8.030 8.204 -0.174 1
1 721 . 16 1 1 A 61 61 LEU HA H 61 4.310 4.113 0.197 1
1 731 . 16 1 1 A 61 61 LEU C C 61 179.450 177.257 2.193 1
1 732 . 16 1 1 A 61 61 LEU CA C 61 54.840 57.492 -2.652 1
1 733 . 16 1 1 A 61 61 LEU CB C 61 43.820 41.596 2.224 1
1 737 . 16 1 1 A 61 61 LEU N N 61 116.000 120.973 -4.973 1
1 738 . 16 1 1 A 62 62 ASP H H 62 7.890 9.186 -1.296 1
1 739 . 16 1 1 A 62 62 ASP HA H 62 4.660 4.906 -0.246 1
1 742 . 16 1 1 A 62 62 ASP C C 62 177.030 176.130 0.900 1
1 743 . 16 1 1 A 62 62 ASP CA C 62 53.660 53.286 0.374 1
1 744 . 16 1 1 A 62 62 ASP CB C 62 38.700 38.604 0.096 1
1 745 . 16 1 1 A 62 62 ASP N N 62 117.550 118.491 -0.941 1
1 746 . 16 1 1 A 63 63 GLU H H 63 8.430 9.504 -1.074 1
1 747 . 16 1 1 A 63 63 GLU HA H 63 4.020 4.043 -0.023 1
1 752 . 16 1 1 A 63 63 GLU C C 63 178.120 178.517 -0.397 1
1 753 . 16 1 1 A 63 63 GLU CA C 63 58.470 59.141 -0.671 1
1 754 . 16 1 1 A 63 63 GLU CB C 63 30.120 29.422 0.698 1
1 756 . 16 1 1 A 63 63 GLU N N 63 130.230 121.459 8.771 1
1 757 . 16 1 1 A 64 64 ASN H H 64 8.010 7.746 0.264 1
1 758 . 16 1 1 A 64 64 ASN HA H 64 4.680 4.664 0.016 1
1 761 . 16 1 1 A 64 64 ASN C C 64 177.100 175.973 1.127 1
1 762 . 16 1 1 A 64 64 ASN CA C 64 51.780 53.290 -1.510 1
1 763 . 16 1 1 A 64 64 ASN CB C 64 37.260 38.947 -1.687 1
1 764 . 16 1 1 A 64 64 ASN N N 64 113.640 115.669 -2.029 1
1 765 . 16 1 1 A 65 65 GLY H H 65 7.550 8.005 -0.455 1
1 766 . 16 1 1 A 65 65 GLY HA2 H 65 3.770 3.961 -0.191 1
1 767 . 16 1 1 A 65 65 GLY HA3 H 65 3.770 3.964 -0.194 1
1 768 . 16 1 1 A 65 65 GLY C C 65 178.980 174.998 3.982 1
1 769 . 16 1 1 A 65 65 GLY CA C 65 47.200 46.527 0.673 1
1 770 . 16 1 1 A 65 65 GLY N N 65 113.640 107.608 6.032 1
1 771 . 16 1 1 A 66 66 ASP H H 66 8.110 8.061 0.049 1
1 772 . 16 1 1 A 66 66 ASP HA H 66 4.490 4.583 -0.093 1
1 775 . 16 1 1 A 66 66 ASP C C 66 177.960 177.528 0.432 1
1 776 . 16 1 1 A 66 66 ASP CA C 66 52.960 53.440 -0.480 1
1 777 . 16 1 1 A 66 66 ASP CB C 66 40.540 40.473 0.067 1
1 778 . 16 1 1 A 66 66 ASP N N 66 120.030 120.228 -0.198 1
1 779 . 16 1 1 A 67 67 GLY H H 67 10.260 9.180 1.080 1
1 780 . 16 1 1 A 67 67 GLY HA2 H 67 3.360 3.830 -0.470 1
1 781 . 16 1 1 A 67 67 GLY HA3 H 67 4.000 3.834 0.166 1
1 782 . 16 1 1 A 67 67 GLY C C 67 173.120 173.406 -0.286 1
1 783 . 16 1 1 A 67 67 GLY CA C 67 45.460 45.728 -0.268 1
1 784 . 16 1 1 A 67 67 GLY N N 67 114.100 110.896 3.204 1
1 785 . 16 1 1 A 68 68 GLU H H 68 7.750 7.937 -0.187 1
1 786 . 16 1 1 A 68 68 GLU HA H 68 4.780 4.892 -0.112 1
1 791 . 16 1 1 A 68 68 GLU C C 68 175.930 174.706 1.224 1
1 792 . 16 1 1 A 68 68 GLU CA C 68 54.430 54.389 0.041 1
1 793 . 16 1 1 A 68 68 GLU CB C 68 35.850 33.657 2.193 1
1 795 . 16 1 1 A 68 68 GLU N N 68 118.000 119.338 -1.338 1
1 796 . 16 1 1 A 69 69 VAL H H 69 9.380 8.261 1.119 1
1 797 . 16 1 1 A 69 69 VAL HA H 69 5.260 5.031 0.229 1
1 805 . 16 1 1 A 69 69 VAL C C 69 176.710 174.596 2.114 1
1 806 . 16 1 1 A 69 69 VAL CA C 69 61.280 60.630 0.650 1
1 807 . 16 1 1 A 69 69 VAL CB C 69 33.980 34.823 -0.843 1
1 810 . 16 1 1 A 69 69 VAL N N 69 125.970 120.817 5.153 1
1 811 . 16 1 1 A 70 70 ASP H H 70 9.100 8.825 0.275 1
1 812 . 16 1 1 A 70 70 ASP HA H 70 5.190 4.944 0.246 1
1 815 . 16 1 1 A 70 70 ASP C C 70 175.700 178.030 -2.330 1
1 816 . 16 1 1 A 70 70 ASP CA C 70 52.370 53.455 -1.085 1
1 817 . 16 1 1 A 70 70 ASP CB C 70 40.950 41.776 -0.826 1
1 818 . 16 1 1 A 70 70 ASP N N 70 130.320 126.593 3.727 1
1 819 . 16 1 1 A 71 71 PHE H H 71 9.090 9.286 -0.196 1
1 820 . 16 1 1 A 71 71 PHE HA H 71 4.100 4.384 -0.284 1
1 823 . 16 1 1 A 71 71 PHE C C 71 177.000 177.540 -0.540 1
1 824 . 16 1 1 A 71 71 PHE CA C 71 58.230 62.488 -4.258 1
1 825 . 16 1 1 A 71 71 PHE CB C 71 36.910 39.811 -2.901 1
1 826 . 16 1 1 A 71 71 PHE N N 71 119.760 123.208 -3.448 1
1 827 . 16 1 1 A 72 72 GLN H H 72 8.440 8.578 -0.138 1
1 828 . 16 1 1 A 72 72 GLN HA H 72 3.600 4.101 -0.501 1
1 831 . 16 1 1 A 72 72 GLN C C 72 178.820 178.197 0.623 1
1 832 . 16 1 1 A 72 72 GLN CA C 72 59.500 58.689 0.811 1
1 833 . 16 1 1 A 72 72 GLN CB C 72 29.553 28.069 1.484 1
1 835 . 16 1 1 A 72 72 GLN N N 72 121.820 116.867 4.953 1
1 836 . 16 1 1 A 73 73 GLU H H 73 8.290 8.021 0.269 1
1 837 . 16 1 1 A 73 73 GLU HA H 73 4.070 4.169 -0.099 1
1 842 . 16 1 1 A 73 73 GLU C C 73 179.370 179.055 0.315 1
1 843 . 16 1 1 A 73 73 GLU CA C 73 58.030 58.952 -0.922 1
1 844 . 16 1 1 A 73 73 GLU CB C 73 29.530 30.032 -0.502 1
1 846 . 16 1 1 A 73 73 GLU N N 73 120.550 119.626 0.924 1
1 847 . 16 1 1 A 74 74 PHE H H 74 8.630 9.015 -0.385 1
1 848 . 16 1 1 A 74 74 PHE HA H 74 4.020 4.091 -0.071 1
1 851 . 16 1 1 A 74 74 PHE C C 74 177.890 177.244 0.646 1
1 852 . 16 1 1 A 74 74 PHE CA C 74 60.090 61.384 -1.294 1
1 853 . 16 1 1 A 74 74 PHE CB C 74 38.020 39.181 -1.161 1
1 854 . 16 1 1 A 74 74 PHE N N 74 121.010 121.796 -0.786 1
1 855 . 16 1 1 A 75 75 VAL H H 75 8.080 8.388 -0.308 1
1 856 . 16 1 1 A 75 75 VAL HA H 75 2.860 3.825 -0.965 1
1 864 . 16 1 1 A 75 75 VAL C C 75 177.030 177.813 -0.783 1
1 865 . 16 1 1 A 75 75 VAL CA C 75 66.430 65.252 1.178 1
1 866 . 16 1 1 A 75 75 VAL CB C 75 30.600 31.286 -0.686 1
1 869 . 16 1 1 A 75 75 VAL N N 75 119.460 119.076 0.384 1
1 870 . 16 1 1 A 76 76 VAL H H 76 7.100 8.294 -1.194 1
1 871 . 16 1 1 A 76 76 VAL HA H 76 3.330 3.759 -0.429 1
1 879 . 16 1 1 A 76 76 VAL C C 76 178.670 177.830 0.840 1
1 880 . 16 1 1 A 76 76 VAL CA C 76 67.000 65.704 1.296 1
1 881 . 16 1 1 A 76 76 VAL CB C 76 31.280 31.178 0.102 1
1 884 . 16 1 1 A 76 76 VAL N N 76 121.030 120.004 1.026 1
1 885 . 16 1 1 A 77 77 LEU H H 77 6.900 8.070 -1.170 1
1 886 . 16 1 1 A 77 77 LEU HA H 77 3.800 4.111 -0.311 1
1 896 . 16 1 1 A 77 77 LEU C C 77 177.960 178.722 -0.762 1
1 897 . 16 1 1 A 77 77 LEU CA C 77 57.710 58.403 -0.693 1
1 898 . 16 1 1 A 77 77 LEU CB C 77 40.070 42.216 -2.146 1
1 902 . 16 1 1 A 77 77 LEU N N 77 120.310 122.231 -1.921 1
1 903 . 16 1 1 A 78 78 VAL H H 78 7.240 7.623 -0.383 1
1 904 . 16 1 1 A 78 78 VAL HA H 78 3.030 3.904 -0.874 1
1 912 . 16 1 1 A 78 78 VAL C C 78 179.600 178.140 1.460 1
1 913 . 16 1 1 A 78 78 VAL CA C 78 66.420 64.959 1.461 1
1 914 . 16 1 1 A 78 78 VAL CB C 78 30.700 31.753 -1.053 1
1 917 . 16 1 1 A 78 78 VAL N N 78 117.180 115.601 1.579 1
1 918 . 16 1 1 A 79 79 ALA H H 79 9.000 8.310 0.690 1
1 919 . 16 1 1 A 79 79 ALA HA H 79 3.610 4.009 -0.399 1
1 923 . 16 1 1 A 79 79 ALA C C 79 182.260 180.100 2.160 1
1 924 . 16 1 1 A 79 79 ALA CA C 79 55.580 55.441 0.139 1
1 925 . 16 1 1 A 79 79 ALA CB C 79 18.400 18.087 0.313 1
1 926 . 16 1 1 A 79 79 ALA N N 79 126.000 125.370 0.630 1
1 927 . 16 1 1 A 80 80 ALA H H 80 8.000 7.703 0.297 1
1 928 . 16 1 1 A 80 80 ALA HA H 80 4.100 4.108 -0.008 1
1 932 . 16 1 1 A 80 80 ALA C C 80 175.460 180.016 -4.556 1
1 933 . 16 1 1 A 80 80 ALA CA C 80 56.020 54.694 1.326 1
1 934 . 16 1 1 A 80 80 ALA CB C 80 18.040 18.452 -0.412 1
1 935 . 16 1 1 A 80 80 ALA N N 80 120.730 121.091 -0.361 1
1 936 . 16 1 1 A 81 81 LEU H H 81 8.460 7.731 0.729 1
1 937 . 16 1 1 A 81 81 LEU HA H 81 4.000 4.069 -0.069 1
1 941 . 16 1 1 A 81 81 LEU C C 81 177.030 178.884 -1.854 1
1 942 . 16 1 1 A 81 81 LEU CA C 81 57.640 57.778 -0.138 1
1 943 . 16 1 1 A 81 81 LEU CB C 81 40.620 42.203 -1.583 1
1 945 . 16 1 1 A 81 81 LEU N N 81 119.890 119.832 0.058 1
1 946 . 16 1 1 A 82 82 THR H H 82 8.320 7.798 0.522 1
1 947 . 16 1 1 A 82 82 THR HA H 82 3.800 4.000 -0.200 1
1 952 . 16 1 1 A 82 82 THR C C 82 181.010 176.699 4.311 1
1 953 . 16 1 1 A 82 82 THR CA C 82 68.500 65.963 2.537 1
1 954 . 16 1 1 A 82 82 THR CB C 82 67.400 69.433 -2.033 1
1 956 . 16 1 1 A 82 82 THR N N 82 117.120 112.876 4.244 1
1 957 . 16 1 1 A 83 83 VAL H H 83 8.530 7.597 0.933 1
1 958 . 16 1 1 A 83 83 VAL HA H 83 3.890 3.840 0.050 1
1 966 . 16 1 1 A 83 83 VAL C C 83 178.120 178.312 -0.192 1
1 967 . 16 1 1 A 83 83 VAL CA C 83 67.400 65.271 2.129 1
1 968 . 16 1 1 A 83 83 VAL CB C 83 31.590 31.470 0.120 1
1 971 . 16 1 1 A 83 83 VAL N N 83 119.760 118.198 1.562 1
1 972 . 16 1 1 A 84 84 ALA H H 84 7.910 8.330 -0.420 1
1 973 . 16 1 1 A 84 84 ALA HA H 84 4.060 4.108 -0.048 1
1 977 . 16 1 1 A 84 84 ALA C C 84 180.560 179.726 0.834 1
1 978 . 16 1 1 A 84 84 ALA CA C 84 55.000 55.019 -0.019 1
1 979 . 16 1 1 A 84 84 ALA CB C 84 17.230 18.207 -0.977 1
1 980 . 16 1 1 A 84 84 ALA N N 84 122.620 124.374 -1.754 1
1 981 . 16 1 1 A 85 85 CYS H H 85 8.580 8.353 0.227 1
1 982 . 16 1 1 A 85 85 CYS HA H 85 4.080 4.485 -0.405 1
1 985 . 16 1 1 A 85 85 CYS C C 85 179.060 177.152 1.908 1
1 986 . 16 1 1 A 85 85 CYS CA C 85 63.210 61.525 1.685 1
1 987 . 16 1 1 A 85 85 CYS CB C 85 26.310 27.327 -1.017 1
1 988 . 16 1 1 A 85 85 CYS N N 85 118.730 117.322 1.408 1
1 989 . 16 1 1 A 86 86 ASN H H 86 8.430 8.048 0.382 1
1 990 . 16 1 1 A 86 86 ASN CA C 86 55.860 56.863 -1.003 1
1 991 . 16 1 1 A 86 86 ASN CB C 86 37.440 40.000 -2.560 1
1 992 . 16 1 1 A 86 86 ASN N N 86 119.360 119.288 0.072 1
1 993 . 16 1 1 A 87 87 ASN H H 87 7.880 8.081 -0.201 1
1 994 . 16 1 1 A 87 87 ASN HA H 87 4.600 4.543 0.057 1
1 997 . 16 1 1 A 87 87 ASN C C 87 178.510 177.484 1.026 1
1 998 . 16 1 1 A 87 87 ASN CA C 87 56.470 56.824 -0.354 1
1 999 . 16 1 1 A 87 87 ASN CB C 87 37.500 38.202 -0.702 1
1 1000 . 16 1 1 A 87 87 ASN N N 87 119.480 117.105 2.375 1
1 1001 . 16 1 1 A 88 88 PHE H H 88 8.050 7.610 0.440 1
1 1002 . 16 1 1 A 88 88 PHE HA H 88 4.200 4.522 -0.322 1
1 1005 . 16 1 1 A 88 88 PHE C C 88 178.510 176.773 1.737 1
1 1006 . 16 1 1 A 88 88 PHE CA C 88 56.460 58.698 -2.238 1
1 1007 . 16 1 1 A 88 88 PHE CB C 88 38.500 38.632 -0.132 1
1 1008 . 16 1 1 A 88 88 PHE N N 88 120.280 117.033 3.247 1
1 1009 . 16 1 1 A 89 89 PHE H H 89 8.020 8.227 -0.207 1
1 1010 . 16 1 1 A 89 89 PHE HA H 89 4.000 4.304 -0.304 1
1 1013 . 16 1 1 A 89 89 PHE C C 89 177.340 177.601 -0.261 1
1 1014 . 16 1 1 A 89 89 PHE CA C 89 59.000 59.811 -0.811 1
1 1015 . 16 1 1 A 89 89 PHE CB C 89 37.430 39.838 -2.408 1
1 1016 . 16 1 1 A 89 89 PHE N N 89 120.910 120.471 0.439 1
1 1017 . 16 1 1 A 90 90 TRP H H 90 7.800 8.094 -0.294 1
1 1018 . 16 1 1 A 90 90 TRP HA H 90 4.460 4.511 -0.051 1
1 1021 . 16 1 1 A 90 90 TRP C C 90 177.340 178.248 -0.908 1
1 1022 . 16 1 1 A 90 90 TRP CA C 90 57.930 58.929 -0.999 1
1 1023 . 16 1 1 A 90 90 TRP CB C 90 42.000 29.976 12.024 1
1 1024 . 16 1 1 A 90 90 TRP N N 90 120.050 120.694 -0.644 1
1 1025 . 16 1 1 A 91 91 GLU H H 91 7.800 8.446 -0.646 1
1 1026 . 16 1 1 A 91 91 GLU HA H 91 4.050 3.732 0.318 1
1 1031 . 16 1 1 A 91 91 GLU C C 91 177.570 177.709 -0.139 1
1 1032 . 16 1 1 A 91 91 GLU CA C 91 57.350 59.945 -2.595 1
1 1033 . 16 1 1 A 91 91 GLU CB C 91 29.530 29.115 0.415 1
1 1035 . 16 1 1 A 91 91 GLU N N 91 120.730 119.216 1.514 1
1 1036 . 16 1 1 A 92 92 ASN H H 92 7.800 7.745 0.055 1
1 1037 . 16 1 1 A 92 92 ASN HA H 92 4.630 4.625 0.005 1
1 1040 . 16 1 1 A 92 92 ASN C C 92 174.450 174.815 -0.365 1
1 1041 . 16 1 1 A 92 92 ASN CA C 92 52.960 52.633 0.327 1
1 1042 . 16 1 1 A 92 92 ASN CB C 92 29.530 38.676 -9.146 1
1 1043 . 16 1 1 A 92 92 ASN N N 92 119.410 115.030 4.380 1
1 5 . 17 1 1 A 2 2 SER H H 2 9.000 7.850 1.150 1
1 6 . 17 1 1 A 2 2 SER HA H 2 4.690 4.570 0.120 1
1 9 . 17 1 1 A 2 2 SER C C 2 176.170 175.272 0.898 1
1 10 . 17 1 1 A 2 2 SER CA C 2 57.340 57.916 -0.576 1
1 11 . 17 1 1 A 2 2 SER CB C 2 65.550 64.168 1.382 1
1 12 . 17 1 1 A 2 2 SER N N 2 119.330 116.200 3.130 1
1 13 . 17 1 1 A 3 3 GLU H H 3 9.350 8.983 0.367 1
1 14 . 17 1 1 A 3 3 GLU HA H 3 4.060 3.958 0.102 1
1 17 . 17 1 1 A 3 3 GLU C C 3 180.150 178.276 1.874 1
1 18 . 17 1 1 A 3 3 GLU CA C 3 60.280 59.722 0.558 1
1 19 . 17 1 1 A 3 3 GLU CB C 3 29.230 29.508 -0.278 1
1 21 . 17 1 1 A 3 3 GLU N N 3 125.350 126.376 -1.026 1
1 22 . 17 1 1 A 4 4 LEU H H 4 9.060 8.205 0.855 1
1 23 . 17 1 1 A 4 4 LEU HA H 4 4.080 4.036 0.044 1
1 33 . 17 1 1 A 4 4 LEU C C 4 177.890 179.121 -1.231 1
1 34 . 17 1 1 A 4 4 LEU CA C 4 58.090 58.001 0.089 1
1 35 . 17 1 1 A 4 4 LEU CB C 4 42.120 41.269 0.851 1
1 39 . 17 1 1 A 4 4 LEU N N 4 121.090 119.971 1.119 1
1 40 . 17 1 1 A 5 5 GLU H H 5 8.340 8.554 -0.214 1
1 41 . 17 1 1 A 5 5 GLU HA H 5 4.050 3.901 0.149 1
1 46 . 17 1 1 A 5 5 GLU C C 5 177.030 179.332 -2.302 1
1 47 . 17 1 1 A 5 5 GLU CA C 5 59.840 59.484 0.356 1
1 48 . 17 1 1 A 5 5 GLU CB C 5 28.940 29.169 -0.229 1
1 50 . 17 1 1 A 5 5 GLU N N 5 119.780 119.948 -0.168 1
1 51 . 17 1 1 A 6 6 THR H H 6 8.370 8.658 -0.288 1
1 52 . 17 1 1 A 6 6 THR HA H 6 4.310 3.916 0.394 1
1 57 . 17 1 1 A 6 6 THR C C 6 177.340 177.073 0.267 1
1 58 . 17 1 1 A 6 6 THR CA C 6 66.630 66.482 0.148 1
1 59 . 17 1 1 A 6 6 THR CB C 6 68.650 68.696 -0.046 1
1 61 . 17 1 1 A 6 6 THR N N 6 116.940 117.018 -0.078 1
1 62 . 17 1 1 A 7 7 ALA H H 7 8.270 7.746 0.524 1
1 63 . 17 1 1 A 7 7 ALA HA H 7 4.190 4.325 -0.135 1
1 67 . 17 1 1 A 7 7 ALA C C 7 179.760 179.659 0.101 1
1 68 . 17 1 1 A 7 7 ALA CA C 7 55.880 55.118 0.762 1
1 69 . 17 1 1 A 7 7 ALA CB C 7 17.720 18.145 -0.425 1
1 70 . 17 1 1 A 7 7 ALA N N 7 127.400 124.420 2.980 1
1 71 . 17 1 1 A 8 8 MET H H 8 8.110 7.794 0.316 1
1 72 . 17 1 1 A 8 8 MET HA H 8 4.020 4.184 -0.164 1
1 80 . 17 1 1 A 8 8 MET C C 8 178.510 178.060 0.450 1
1 81 . 17 1 1 A 8 8 MET CA C 8 60.580 58.350 2.230 1
1 82 . 17 1 1 A 8 8 MET CB C 8 33.630 33.310 0.320 1
1 85 . 17 1 1 A 8 8 MET N N 8 117.520 116.515 1.005 1
1 86 . 17 1 1 A 9 9 GLU H H 9 8.210 8.152 0.058 1
1 87 . 17 1 1 A 9 9 GLU HA H 9 3.830 4.131 -0.301 1
1 92 . 17 1 1 A 9 9 GLU C C 9 179.140 179.235 -0.095 1
1 93 . 17 1 1 A 9 9 GLU CA C 9 59.690 58.991 0.699 1
1 94 . 17 1 1 A 9 9 GLU CB C 9 29.530 28.512 1.018 1
1 96 . 17 1 1 A 9 9 GLU N N 9 118.560 117.831 0.729 1
1 97 . 17 1 1 A 10 10 THR H H 10 8.490 7.714 0.776 1
1 98 . 17 1 1 A 10 10 THR HA H 10 4.000 4.011 -0.011 1
1 103 . 17 1 1 A 10 10 THR C C 10 176.010 176.388 -0.378 1
1 104 . 17 1 1 A 10 10 THR CA C 10 67.110 67.151 -0.041 1
1 105 . 17 1 1 A 10 10 THR CB C 10 67.770 68.796 -1.026 1
1 107 . 17 1 1 A 10 10 THR N N 10 118.310 116.980 1.330 1
1 108 . 17 1 1 A 11 11 LEU H H 11 7.920 7.863 0.057 1
1 109 . 17 1 1 A 11 11 LEU HA H 11 3.930 4.147 -0.217 1
1 119 . 17 1 1 A 11 11 LEU C C 11 178.820 179.789 -0.969 1
1 120 . 17 1 1 A 11 11 LEU CA C 11 59.690 58.153 1.537 1
1 121 . 17 1 1 A 11 11 LEU CB C 11 41.920 41.627 0.293 1
1 125 . 17 1 1 A 11 11 LEU N N 11 121.150 119.294 1.856 1
1 126 . 17 1 1 A 12 12 ILE H H 12 7.440 7.662 -0.222 1
1 127 . 17 1 1 A 12 12 ILE HA H 12 3.640 3.793 -0.153 1
1 137 . 17 1 1 A 12 12 ILE C C 12 179.530 178.802 0.728 1
1 138 . 17 1 1 A 12 12 ILE CA C 12 63.740 65.302 -1.562 1
1 139 . 17 1 1 A 12 12 ILE CB C 12 38.800 37.467 1.333 1
1 143 . 17 1 1 A 12 12 ILE N N 12 118.010 121.092 -3.082 1
1 144 . 17 1 1 A 13 13 ASN H H 13 8.930 8.381 0.549 1
1 145 . 17 1 1 A 13 13 ASN HA H 13 4.520 4.579 -0.059 1
1 148 . 17 1 1 A 13 13 ASN C C 13 179.450 177.500 1.950 1
1 149 . 17 1 1 A 13 13 ASN CA C 13 56.470 56.547 -0.077 1
1 150 . 17 1 1 A 13 13 ASN CB C 13 37.930 38.910 -0.980 1
1 151 . 17 1 1 A 13 13 ASN N N 13 121.820 119.665 2.155 1
1 152 . 17 1 1 A 14 14 VAL H H 14 9.180 8.086 1.094 1
1 153 . 17 1 1 A 14 14 VAL HA H 14 3.830 3.873 -0.043 1
1 161 . 17 1 1 A 14 14 VAL CA C 14 65.840 65.292 0.548 1
1 162 . 17 1 1 A 14 14 VAL CB C 14 31.290 31.551 -0.261 1
1 165 . 17 1 1 A 14 14 VAL N N 14 122.040 118.441 3.599 1
1 166 . 17 1 1 A 15 15 PHE H H 15 7.590 8.159 -0.569 1
1 167 . 17 1 1 A 15 15 PHE HA H 15 3.360 3.933 -0.573 1
1 170 . 17 1 1 A 15 15 PHE C C 15 177.890 177.320 0.570 1
1 171 . 17 1 1 A 15 15 PHE CA C 15 62.030 61.885 0.145 1
1 172 . 17 1 1 A 15 15 PHE CB C 15 38.900 38.808 0.092 1
1 173 . 17 1 1 A 15 15 PHE N N 15 118.290 122.392 -4.102 1
1 174 . 17 1 1 A 16 16 HIS H H 16 7.790 7.972 -0.182 1
1 175 . 17 1 1 A 16 16 HIS HA H 16 4.890 4.286 0.604 1
1 178 . 17 1 1 A 16 16 HIS C C 16 177.810 177.039 0.771 1
1 179 . 17 1 1 A 16 16 HIS CA C 16 59.100 60.061 -0.961 1
1 180 . 17 1 1 A 16 16 HIS CB C 16 28.060 29.361 -1.301 1
1 181 . 17 1 1 A 16 16 HIS N N 16 118.290 118.489 -0.199 1
1 182 . 17 1 1 A 17 17 ALA H H 17 8.040 7.864 0.176 1
1 183 . 17 1 1 A 17 17 ALA HA H 17 4.050 3.870 0.180 1
1 187 . 17 1 1 A 17 17 ALA C C 17 179.600 179.577 0.023 1
1 188 . 17 1 1 A 17 17 ALA CA C 17 54.000 55.132 -1.132 1
1 189 . 17 1 1 A 17 17 ALA CB C 17 17.520 18.497 -0.977 1
1 190 . 17 1 1 A 17 17 ALA N N 17 124.410 120.918 3.492 1
1 191 . 17 1 1 A 18 18 HIS H H 18 7.000 7.243 -0.243 1
1 192 . 17 1 1 A 18 18 HIS HA H 18 4.330 4.310 0.020 1
1 195 . 17 1 1 A 18 18 HIS C C 18 176.320 177.773 -1.453 1
1 196 . 17 1 1 A 18 18 HIS CA C 18 57.350 59.398 -2.048 1
1 197 . 17 1 1 A 18 18 HIS CB C 18 32.920 30.056 2.864 1
1 198 . 17 1 1 A 18 18 HIS N N 18 115.160 115.874 -0.714 1
1 199 . 17 1 1 A 19 19 SER H H 19 8.380 7.740 0.640 1
1 200 . 17 1 1 A 19 19 SER HA H 19 3.640 3.761 -0.121 1
1 203 . 17 1 1 A 19 19 SER C C 19 177.340 175.789 1.551 1
1 204 . 17 1 1 A 19 19 SER CA C 19 60.160 60.551 -0.391 1
1 205 . 17 1 1 A 19 19 SER CB C 19 61.000 62.343 -1.343 1
1 206 . 17 1 1 A 19 19 SER N N 19 114.380 115.001 -0.621 1
1 207 . 17 1 1 A 20 20 GLY H H 20 7.600 7.793 -0.193 1
1 208 . 17 1 1 A 20 20 GLY HA2 H 20 3.680 3.598 0.082 1
1 209 . 17 1 1 A 20 20 GLY HA3 H 20 4.000 3.714 0.286 1
1 210 . 17 1 1 A 20 20 GLY C C 20 174.140 174.117 0.023 1
1 211 . 17 1 1 A 20 20 GLY CA C 20 47.000 45.199 1.801 1
1 212 . 17 1 1 A 20 20 GLY N N 20 112.550 106.993 5.557 1
1 213 . 17 1 1 A 21 21 LYS H H 21 7.230 7.601 -0.371 1
1 214 . 17 1 1 A 21 21 LYS HA H 21 3.860 4.314 -0.454 1
1 223 . 17 1 1 A 21 21 LYS C C 21 177.730 177.879 -0.149 1
1 224 . 17 1 1 A 21 21 LYS CA C 21 59.110 56.892 2.218 1
1 225 . 17 1 1 A 21 21 LYS CB C 21 32.460 35.005 -2.545 1
1 229 . 17 1 1 A 21 21 LYS N N 21 123.240 118.283 4.957 1
1 230 . 17 1 1 A 22 22 GLU H H 22 9.350 7.991 1.359 1
1 231 . 17 1 1 A 22 22 GLU HA H 22 4.610 4.283 0.327 1
1 236 . 17 1 1 A 22 22 GLU C C 22 177.420 176.676 0.744 1
1 237 . 17 1 1 A 22 22 GLU CA C 22 53.700 56.742 -3.042 1
1 238 . 17 1 1 A 22 22 GLU CB C 22 32.000 29.634 2.366 1
1 240 . 17 1 1 A 22 22 GLU N N 22 116.770 117.246 -0.476 1
1 241 . 17 1 1 A 23 23 GLY H H 23 7.570 7.593 -0.023 1
1 242 . 17 1 1 A 23 23 GLY HA2 H 23 3.630 3.952 -0.322 1
1 243 . 17 1 1 A 23 23 GLY HA3 H 23 3.880 3.986 -0.106 1
1 244 . 17 1 1 A 23 23 GLY C C 23 173.980 171.860 2.120 1
1 245 . 17 1 1 A 23 23 GLY CA C 23 45.250 45.428 -0.178 1
1 246 . 17 1 1 A 23 23 GLY N N 23 112.180 106.858 5.322 1
1 247 . 17 1 1 A 24 24 ASP H H 24 8.680 7.974 0.706 1
1 248 . 17 1 1 A 24 24 ASP HA H 24 4.380 4.734 -0.354 1
1 251 . 17 1 1 A 24 24 ASP C C 24 178.590 177.121 1.469 1
1 252 . 17 1 1 A 24 24 ASP CA C 24 60.000 53.199 6.801 1
1 253 . 17 1 1 A 24 24 ASP CB C 24 27.480 42.089 -14.609 1
1 254 . 17 1 1 A 24 24 ASP N N 24 127.470 121.553 5.917 1
1 255 . 17 1 1 A 25 25 LYS H H 25 9.270 8.704 0.566 1
1 256 . 17 1 1 A 25 25 LYS HA H 25 4.250 3.693 0.557 1
1 265 . 17 1 1 A 25 25 LYS C C 25 177.030 176.835 0.195 1
1 266 . 17 1 1 A 25 25 LYS CA C 25 60.000 59.669 0.331 1
1 267 . 17 1 1 A 25 25 LYS CB C 25 31.170 32.238 -1.068 1
1 271 . 17 1 1 A 25 25 LYS N N 25 132.960 124.663 8.297 1
1 272 . 17 1 1 A 26 26 TYR H H 26 9.430 7.858 1.572 1
1 273 . 17 1 1 A 26 26 TYR HA H 26 4.640 4.927 -0.287 1
1 276 . 17 1 1 A 26 26 TYR C C 26 174.290 175.017 -0.727 1
1 277 . 17 1 1 A 26 26 TYR CA C 26 56.010 57.514 -1.504 1
1 278 . 17 1 1 A 26 26 TYR CB C 26 37.730 39.103 -1.373 1
1 279 . 17 1 1 A 26 26 TYR N N 26 120.650 113.791 6.859 1
1 280 . 17 1 1 A 27 27 LYS H H 27 7.110 7.369 -0.259 1
1 281 . 17 1 1 A 27 27 LYS HA H 27 5.110 5.105 0.005 1
1 290 . 17 1 1 A 27 27 LYS C C 27 175.150 173.832 1.318 1
1 291 . 17 1 1 A 27 27 LYS CA C 27 55.070 55.218 -0.148 1
1 292 . 17 1 1 A 27 27 LYS CB C 27 38.900 36.272 2.628 1
1 296 . 17 1 1 A 27 27 LYS N N 27 115.830 120.498 -4.668 1
1 297 . 17 1 1 A 28 28 LEU H H 28 9.820 8.634 1.186 1
1 298 . 17 1 1 A 28 28 LEU HA H 28 5.080 5.101 -0.021 1
1 308 . 17 1 1 A 28 28 LEU C C 28 176.640 174.847 1.793 1
1 309 . 17 1 1 A 28 28 LEU CA C 28 52.660 53.610 -0.950 1
1 310 . 17 1 1 A 28 28 LEU CB C 28 42.710 44.422 -1.712 1
1 314 . 17 1 1 A 28 28 LEU N N 28 126.930 127.984 -1.054 1
1 315 . 17 1 1 A 29 29 SER H H 29 9.890 8.415 1.475 1
1 316 . 17 1 1 A 29 29 SER HA H 29 4.530 5.059 -0.529 1
1 319 . 17 1 1 A 29 29 SER C C 29 174.990 174.702 0.288 1
1 320 . 17 1 1 A 29 29 SER CA C 29 56.180 56.014 0.166 1
1 321 . 17 1 1 A 29 29 SER CB C 29 65.550 65.528 0.022 1
1 322 . 17 1 1 A 29 29 SER N N 29 121.600 119.016 2.584 1
1 323 . 17 1 1 A 30 30 LYS H H 30 8.850 8.832 0.018 1
1 324 . 17 1 1 A 30 30 LYS HA H 30 3.850 3.961 -0.111 1
1 333 . 17 1 1 A 30 30 LYS C C 30 175.620 177.590 -1.970 1
1 334 . 17 1 1 A 30 30 LYS CA C 30 60.860 60.186 0.674 1
1 335 . 17 1 1 A 30 30 LYS CB C 30 31.290 32.184 -0.894 1
1 339 . 17 1 1 A 30 30 LYS N N 30 121.260 126.883 -5.623 1
1 340 . 17 1 1 A 31 31 LYS H H 31 7.970 7.934 0.036 1
1 341 . 17 1 1 A 31 31 LYS HA H 31 3.880 3.990 -0.110 1
1 350 . 17 1 1 A 31 31 LYS C C 31 179.290 179.199 0.091 1
1 351 . 17 1 1 A 31 31 LYS CA C 31 59.110 59.100 0.010 1
1 352 . 17 1 1 A 31 31 LYS CB C 31 32.640 31.719 0.921 1
1 356 . 17 1 1 A 31 31 LYS N N 31 121.260 118.580 2.680 1
1 357 . 17 1 1 A 32 32 GLU H H 32 7.510 8.150 -0.640 1
1 358 . 17 1 1 A 32 32 GLU HA H 32 3.830 3.994 -0.164 1
1 363 . 17 1 1 A 32 32 GLU C C 32 179.290 179.360 -0.070 1
1 364 . 17 1 1 A 32 32 GLU CA C 32 58.590 58.831 -0.241 1
1 365 . 17 1 1 A 32 32 GLU CB C 32 30.120 29.977 0.143 1
1 367 . 17 1 1 A 32 32 GLU N N 32 120.090 119.138 0.952 1
1 368 . 17 1 1 A 33 33 LEU H H 33 8.970 7.786 1.184 1
1 369 . 17 1 1 A 33 33 LEU HA H 33 3.830 4.073 -0.243 1
1 379 . 17 1 1 A 33 33 LEU C C 33 178.200 178.926 -0.726 1
1 380 . 17 1 1 A 33 33 LEU CA C 33 57.930 58.222 -0.292 1
1 381 . 17 1 1 A 33 33 LEU CB C 33 40.660 41.885 -1.225 1
1 385 . 17 1 1 A 33 33 LEU N N 33 120.200 119.245 0.955 1
1 386 . 17 1 1 A 34 34 LYS H H 34 8.230 7.720 0.510 1
1 387 . 17 1 1 A 34 34 LYS HA H 34 3.550 3.871 -0.321 1
1 396 . 17 1 1 A 34 34 LYS C C 34 178.040 178.485 -0.445 1
1 397 . 17 1 1 A 34 34 LYS CA C 34 60.720 60.196 0.524 1
1 398 . 17 1 1 A 34 34 LYS CB C 34 31.980 31.934 0.046 1
1 402 . 17 1 1 A 34 34 LYS N N 34 120.780 119.252 1.528 1
1 403 . 17 1 1 A 35 35 ASP H H 35 7.990 7.740 0.250 1
1 404 . 17 1 1 A 35 35 ASP HA H 35 4.250 4.425 -0.175 1
1 407 . 17 1 1 A 35 35 ASP C C 35 179.060 178.912 0.148 1
1 408 . 17 1 1 A 35 35 ASP CA C 35 56.830 57.170 -0.340 1
1 409 . 17 1 1 A 35 35 ASP CB C 35 40.440 40.395 0.045 1
1 410 . 17 1 1 A 35 35 ASP N N 35 119.550 119.880 -0.330 1
1 411 . 17 1 1 A 36 36 LEU H H 36 8.130 7.906 0.224 1
1 412 . 17 1 1 A 36 36 LEU HA H 36 2.580 3.845 -1.265 1
1 422 . 17 1 1 A 36 36 LEU C C 36 179.450 179.338 0.112 1
1 423 . 17 1 1 A 36 36 LEU CA C 36 59.980 57.861 2.119 1
1 424 . 17 1 1 A 36 36 LEU CB C 36 42.180 41.910 0.270 1
1 428 . 17 1 1 A 36 36 LEU N N 36 125.560 121.118 4.442 1
1 429 . 17 1 1 A 37 37 LEU H H 37 8.740 8.033 0.707 1
1 430 . 17 1 1 A 37 37 LEU HA H 37 3.580 3.994 -0.414 1
1 440 . 17 1 1 A 37 37 LEU C C 37 179.290 179.803 -0.513 1
1 441 . 17 1 1 A 37 37 LEU CA C 37 58.230 58.184 0.046 1
1 442 . 17 1 1 A 37 37 LEU CB C 37 41.590 40.831 0.759 1
1 446 . 17 1 1 A 37 37 LEU N N 37 120.520 117.788 2.732 1
1 447 . 17 1 1 A 38 38 GLN H H 38 8.520 8.215 0.305 1
1 448 . 17 1 1 A 38 38 GLN HA H 38 4.000 4.078 -0.078 1
1 453 . 17 1 1 A 38 38 GLN C C 38 177.960 178.473 -0.513 1
1 454 . 17 1 1 A 38 38 GLN CA C 38 58.210 58.430 -0.220 1
1 455 . 17 1 1 A 38 38 GLN CB C 38 28.650 27.921 0.729 1
1 457 . 17 1 1 A 38 38 GLN N N 38 116.740 117.975 -1.235 1
1 458 . 17 1 1 A 39 39 THR H H 39 7.910 7.661 0.249 1
1 459 . 17 1 1 A 39 39 THR HA H 39 4.210 3.777 0.433 1
1 464 . 17 1 1 A 39 39 THR C C 39 177.180 175.776 1.404 1
1 465 . 17 1 1 A 39 39 THR CA C 39 64.730 67.248 -2.518 1
1 466 . 17 1 1 A 39 39 THR CB C 39 69.650 68.624 1.026 1
1 468 . 17 1 1 A 39 39 THR N N 39 111.400 116.896 -5.496 1
1 469 . 17 1 1 A 40 40 GLU H H 40 8.590 7.886 0.704 1
1 470 . 17 1 1 A 40 40 GLU HA H 40 4.680 4.473 0.207 1
1 475 . 17 1 1 A 40 40 GLU C C 40 178.280 177.082 1.198 1
1 476 . 17 1 1 A 40 40 GLU CA C 40 55.880 56.583 -0.703 1
1 477 . 17 1 1 A 40 40 GLU CB C 40 30.990 30.476 0.514 1
1 479 . 17 1 1 A 40 40 GLU N N 40 117.840 116.460 1.380 1
1 480 . 17 1 1 A 41 41 LEU H H 41 7.680 7.578 0.102 1
1 481 . 17 1 1 A 41 41 LEU HA H 41 5.080 4.807 0.273 1
1 491 . 17 1 1 A 41 41 LEU C C 41 179.450 177.352 2.098 1
1 492 . 17 1 1 A 41 41 LEU CA C 41 53.830 53.652 0.178 1
1 493 . 17 1 1 A 41 41 LEU CB C 41 41.360 42.664 -1.304 1
1 497 . 17 1 1 A 41 41 LEU N N 41 121.410 119.676 1.734 1
1 498 . 17 1 1 A 42 42 SER H H 42 8.380 7.967 0.413 1
1 499 . 17 1 1 A 42 42 SER HA H 42 4.130 4.096 0.034 1
1 502 . 17 1 1 A 42 42 SER C C 42 176.640 177.443 -0.803 1
1 503 . 17 1 1 A 42 42 SER CA C 42 61.280 61.685 -0.405 1
1 504 . 17 1 1 A 42 42 SER CB C 42 63.040 62.982 0.058 1
1 505 . 17 1 1 A 42 42 SER N N 42 117.420 117.661 -0.241 1
1 506 . 17 1 1 A 43 43 SER H H 43 8.900 8.100 0.800 1
1 507 . 17 1 1 A 43 43 SER HA H 43 4.290 4.177 0.113 1
1 510 . 17 1 1 A 43 43 SER C C 43 175.620 176.686 -1.066 1
1 511 . 17 1 1 A 43 43 SER CA C 43 60.860 62.297 -1.437 1
1 512 . 17 1 1 A 43 43 SER CB C 43 62.910 63.533 -0.623 1
1 513 . 17 1 1 A 43 43 SER N N 43 117.580 116.930 0.650 1
1 514 . 17 1 1 A 44 44 PHE H H 44 7.880 7.998 -0.118 1
1 515 . 17 1 1 A 44 44 PHE HA H 44 4.240 4.242 -0.002 1
1 518 . 17 1 1 A 44 44 PHE C C 44 176.950 175.934 1.016 1
1 519 . 17 1 1 A 44 44 PHE CA C 44 62.710 60.885 1.825 1
1 520 . 17 1 1 A 44 44 PHE CB C 44 39.020 39.240 -0.220 1
1 521 . 17 1 1 A 44 44 PHE N N 44 119.480 121.629 -2.149 1
1 522 . 17 1 1 A 45 45 LEU H H 45 8.060 7.975 0.085 1
1 523 . 17 1 1 A 45 45 LEU HA H 45 3.810 3.969 -0.159 1
1 533 . 17 1 1 A 45 45 LEU C C 45 177.500 176.256 1.244 1
1 534 . 17 1 1 A 45 45 LEU CA C 45 59.980 55.791 4.189 1
1 535 . 17 1 1 A 45 45 LEU CB C 45 39.640 42.284 -2.644 1
1 538 . 17 1 1 A 45 45 LEU N N 45 118.010 120.923 -2.913 1
1 539 . 17 1 1 A 46 46 ASP H H 46 8.150 8.668 -0.518 1
1 540 . 17 1 1 A 46 46 ASP HA H 46 4.470 4.816 -0.346 1
1 543 . 17 1 1 A 46 46 ASP C C 46 179.920 175.422 4.498 1
1 544 . 17 1 1 A 46 46 ASP CA C 46 52.950 54.015 -1.065 1
1 545 . 17 1 1 A 46 46 ASP CB C 46 40.000 41.483 -1.483 1
1 546 . 17 1 1 A 46 46 ASP N N 46 119.460 124.521 -5.061 1
1 547 . 17 1 1 A 47 47 VAL H H 47 8.010 8.518 -0.508 1
1 548 . 17 1 1 A 47 47 VAL HA H 47 3.800 4.316 -0.516 1
1 556 . 17 1 1 A 47 47 VAL C C 47 175.460 177.026 -1.566 1
1 557 . 17 1 1 A 47 47 VAL CA C 47 60.000 62.921 -2.921 1
1 558 . 17 1 1 A 47 47 VAL CB C 47 31.580 33.260 -1.680 1
1 561 . 17 1 1 A 47 47 VAL N N 47 117.720 122.182 -4.462 1
1 562 . 17 1 1 A 48 48 GLN H H 48 7.960 8.986 -1.026 1
1 563 . 17 1 1 A 48 48 GLN HA H 48 4.060 4.017 0.043 1
1 568 . 17 1 1 A 48 48 GLN C C 48 179.370 178.779 0.591 1
1 569 . 17 1 1 A 48 48 GLN CA C 48 57.350 58.946 -1.596 1
1 570 . 17 1 1 A 48 48 GLN CB C 48 28.990 28.388 0.602 1
1 572 . 17 1 1 A 48 48 GLN N N 48 119.900 121.844 -1.944 1
1 573 . 17 1 1 A 49 49 LYS H H 49 7.810 7.658 0.152 1
1 574 . 17 1 1 A 49 49 LYS HA H 49 3.860 4.118 -0.258 1
1 583 . 17 1 1 A 49 49 LYS C C 49 177.890 176.642 1.248 1
1 584 . 17 1 1 A 49 49 LYS CA C 49 58.230 58.751 -0.521 1
1 585 . 17 1 1 A 49 49 LYS CB C 49 30.990 32.605 -1.615 1
1 587 . 17 1 1 A 49 49 LYS N N 49 120.030 119.855 0.175 1
1 588 . 17 1 1 A 50 50 ASP H H 50 7.570 7.816 -0.246 1
1 589 . 17 1 1 A 50 50 ASP HA H 50 4.700 4.795 -0.095 1
1 590 . 17 1 1 A 50 50 ASP CA C 50 52.950 53.060 -0.110 1
1 591 . 17 1 1 A 50 50 ASP CB C 50 38.900 41.226 -2.326 1
1 592 . 17 1 1 A 50 50 ASP N N 50 116.730 119.464 -2.734 1
1 593 . 17 1 1 A 51 51 ALA H H 51 7.570 8.776 -1.206 1
1 594 . 17 1 1 A 51 51 ALA HA H 51 4.200 3.939 0.261 1
1 598 . 17 1 1 A 51 51 ALA C C 51 179.760 179.323 0.437 1
1 599 . 17 1 1 A 51 51 ALA CA C 51 54.200 55.237 -1.037 1
1 600 . 17 1 1 A 51 51 ALA CB C 51 18.110 18.472 -0.362 1
1 601 . 17 1 1 A 51 51 ALA N N 51 118.390 127.436 -9.046 1
1 602 . 17 1 1 A 52 52 ASP H H 52 8.430 8.347 0.083 1
1 603 . 17 1 1 A 52 52 ASP HA H 52 4.600 4.349 0.251 1
1 606 . 17 1 1 A 52 52 ASP C C 52 177.570 178.465 -0.895 1
1 607 . 17 1 1 A 52 52 ASP CA C 52 54.420 56.734 -2.314 1
1 608 . 17 1 1 A 52 52 ASP CB C 52 40.360 40.076 0.284 1
1 609 . 17 1 1 A 52 52 ASP N N 52 117.530 119.133 -1.603 1
1 610 . 17 1 1 A 53 53 ALA H H 53 7.660 7.813 -0.153 1
1 611 . 17 1 1 A 53 53 ALA HA H 53 3.860 3.972 -0.112 1
1 615 . 17 1 1 A 53 53 ALA C C 53 180.070 180.775 -0.705 1
1 616 . 17 1 1 A 53 53 ALA CA C 53 55.590 55.365 0.225 1
1 617 . 17 1 1 A 53 53 ALA CB C 53 18.800 17.980 0.820 1
1 618 . 17 1 1 A 53 53 ALA N N 53 123.450 122.661 0.789 1
1 619 . 17 1 1 A 54 54 VAL H H 54 8.030 7.667 0.363 1
1 620 . 17 1 1 A 54 54 VAL HA H 54 3.240 3.690 -0.450 1
1 628 . 17 1 1 A 54 54 VAL C C 54 177.340 177.854 -0.514 1
1 629 . 17 1 1 A 54 54 VAL CA C 54 66.620 65.790 0.830 1
1 630 . 17 1 1 A 54 54 VAL CB C 54 30.480 31.046 -0.566 1
1 633 . 17 1 1 A 54 54 VAL N N 54 116.150 117.006 -0.856 1
1 634 . 17 1 1 A 55 55 ASP H H 55 7.660 7.670 -0.010 1
1 635 . 17 1 1 A 55 55 ASP HA H 55 4.080 4.367 -0.287 1
1 638 . 17 1 1 A 55 55 ASP C C 55 177.260 179.265 -2.005 1
1 639 . 17 1 1 A 55 55 ASP CA C 55 57.640 57.287 0.353 1
1 640 . 17 1 1 A 55 55 ASP CB C 55 40.360 40.232 0.128 1
1 641 . 17 1 1 A 55 55 ASP N N 55 120.830 122.360 -1.530 1
1 642 . 17 1 1 A 56 56 LYS H H 56 7.780 7.516 0.264 1
1 643 . 17 1 1 A 56 56 LYS HA H 56 3.860 4.035 -0.175 1
1 652 . 17 1 1 A 56 56 LYS C C 56 179.530 179.375 0.155 1
1 653 . 17 1 1 A 56 56 LYS CA C 56 59.690 59.743 -0.053 1
1 654 . 17 1 1 A 56 56 LYS CB C 56 31.870 32.457 -0.587 1
1 658 . 17 1 1 A 56 56 LYS N N 56 120.010 119.413 0.597 1
1 659 . 17 1 1 A 57 57 ILE H H 57 8.090 7.781 0.309 1
1 660 . 17 1 1 A 57 57 ILE HA H 57 3.390 3.521 -0.131 1
1 670 . 17 1 1 A 57 57 ILE C C 57 176.710 177.509 -0.799 1
1 671 . 17 1 1 A 57 57 ILE CA C 57 64.960 65.311 -0.351 1
1 672 . 17 1 1 A 57 57 ILE CB C 57 38.080 38.420 -0.340 1
1 676 . 17 1 1 A 57 57 ILE N N 57 120.960 120.324 0.636 1
1 677 . 17 1 1 A 58 58 MET H H 58 8.480 8.285 0.195 1
1 678 . 17 1 1 A 58 58 MET HA H 58 3.800 4.124 -0.324 1
1 686 . 17 1 1 A 58 58 MET C C 58 177.570 178.084 -0.514 1
1 687 . 17 1 1 A 58 58 MET CA C 58 58.570 58.409 0.161 1
1 688 . 17 1 1 A 58 58 MET CB C 58 32.570 31.901 0.669 1
1 691 . 17 1 1 A 58 58 MET N N 58 119.160 120.619 -1.459 1
1 692 . 17 1 1 A 59 59 LYS H H 59 7.550 7.989 -0.439 1
1 693 . 17 1 1 A 59 59 LYS HA H 59 3.930 3.964 -0.034 1
1 702 . 17 1 1 A 59 59 LYS C C 59 179.530 179.276 0.254 1
1 703 . 17 1 1 A 59 59 LYS CA C 59 58.820 59.628 -0.808 1
1 704 . 17 1 1 A 59 59 LYS CB C 59 32.450 32.499 -0.049 1
1 708 . 17 1 1 A 59 59 LYS N N 59 116.730 119.722 -2.992 1
1 709 . 17 1 1 A 60 60 GLU H H 60 7.470 7.726 -0.256 1
1 710 . 17 1 1 A 60 60 GLU HA H 60 4.050 4.071 -0.021 1
1 715 . 17 1 1 A 60 60 GLU C C 60 178.950 177.797 1.153 1
1 716 . 17 1 1 A 60 60 GLU CA C 60 58.600 58.991 -0.391 1
1 717 . 17 1 1 A 60 60 GLU CB C 60 31.700 29.418 2.282 1
1 719 . 17 1 1 A 60 60 GLU N N 60 116.820 119.383 -2.563 1
1 720 . 17 1 1 A 61 61 LEU H H 61 8.030 7.642 0.388 1
1 721 . 17 1 1 A 61 61 LEU HA H 61 4.310 4.341 -0.031 1
1 731 . 17 1 1 A 61 61 LEU C C 61 179.450 177.119 2.331 1
1 732 . 17 1 1 A 61 61 LEU CA C 61 54.840 55.395 -0.555 1
1 733 . 17 1 1 A 61 61 LEU CB C 61 43.820 42.520 1.300 1
1 737 . 17 1 1 A 61 61 LEU N N 61 116.000 117.943 -1.943 1
1 738 . 17 1 1 A 62 62 ASP H H 62 7.890 8.495 -0.605 1
1 739 . 17 1 1 A 62 62 ASP HA H 62 4.660 4.907 -0.247 1
1 742 . 17 1 1 A 62 62 ASP C C 62 177.030 176.160 0.870 1
1 743 . 17 1 1 A 62 62 ASP CA C 62 53.660 53.743 -0.083 1
1 744 . 17 1 1 A 62 62 ASP CB C 62 38.700 39.706 -1.006 1
1 745 . 17 1 1 A 62 62 ASP N N 62 117.550 119.022 -1.472 1
1 746 . 17 1 1 A 63 63 GLU H H 63 8.430 8.905 -0.475 1
1 747 . 17 1 1 A 63 63 GLU HA H 63 4.020 4.046 -0.026 1
1 752 . 17 1 1 A 63 63 GLU C C 63 178.120 178.832 -0.712 1
1 753 . 17 1 1 A 63 63 GLU CA C 63 58.470 59.218 -0.748 1
1 754 . 17 1 1 A 63 63 GLU CB C 63 30.120 29.396 0.724 1
1 756 . 17 1 1 A 63 63 GLU N N 63 130.230 120.542 9.688 1
1 757 . 17 1 1 A 64 64 ASN H H 64 8.010 7.916 0.094 1
1 758 . 17 1 1 A 64 64 ASN HA H 64 4.680 4.661 0.019 1
1 761 . 17 1 1 A 64 64 ASN C C 64 177.100 176.130 0.970 1
1 762 . 17 1 1 A 64 64 ASN CA C 64 51.780 52.550 -0.770 1
1 763 . 17 1 1 A 64 64 ASN CB C 64 37.260 38.841 -1.581 1
1 764 . 17 1 1 A 64 64 ASN N N 64 113.640 114.456 -0.816 1
1 765 . 17 1 1 A 65 65 GLY H H 65 7.550 7.905 -0.355 1
1 766 . 17 1 1 A 65 65 GLY HA2 H 65 3.770 3.971 -0.201 1
1 767 . 17 1 1 A 65 65 GLY HA3 H 65 3.770 3.972 -0.202 1
1 768 . 17 1 1 A 65 65 GLY C C 65 178.980 174.986 3.994 1
1 769 . 17 1 1 A 65 65 GLY CA C 65 47.200 46.499 0.701 1
1 770 . 17 1 1 A 65 65 GLY N N 65 113.640 107.930 5.710 1
1 771 . 17 1 1 A 66 66 ASP H H 66 8.110 8.377 -0.267 1
1 772 . 17 1 1 A 66 66 ASP HA H 66 4.490 4.588 -0.098 1
1 775 . 17 1 1 A 66 66 ASP C C 66 177.960 177.560 0.400 1
1 776 . 17 1 1 A 66 66 ASP CA C 66 52.960 53.466 -0.506 1
1 777 . 17 1 1 A 66 66 ASP CB C 66 40.540 40.490 0.050 1
1 778 . 17 1 1 A 66 66 ASP N N 66 120.030 120.295 -0.265 1
1 779 . 17 1 1 A 67 67 GLY H H 67 10.260 9.441 0.819 1
1 780 . 17 1 1 A 67 67 GLY HA2 H 67 3.360 3.868 -0.508 1
1 781 . 17 1 1 A 67 67 GLY HA3 H 67 4.000 3.869 0.131 1
1 782 . 17 1 1 A 67 67 GLY C C 67 173.120 173.406 -0.286 1
1 783 . 17 1 1 A 67 67 GLY CA C 67 45.460 45.831 -0.371 1
1 784 . 17 1 1 A 67 67 GLY N N 67 114.100 111.130 2.970 1
1 785 . 17 1 1 A 68 68 GLU H H 68 7.750 8.169 -0.419 1
1 786 . 17 1 1 A 68 68 GLU HA H 68 4.780 4.953 -0.173 1
1 791 . 17 1 1 A 68 68 GLU C C 68 175.930 174.801 1.129 1
1 792 . 17 1 1 A 68 68 GLU CA C 68 54.430 54.391 0.039 1
1 793 . 17 1 1 A 68 68 GLU CB C 68 35.850 33.704 2.146 1
1 795 . 17 1 1 A 68 68 GLU N N 68 118.000 119.296 -1.296 1
1 796 . 17 1 1 A 69 69 VAL H H 69 9.380 8.332 1.048 1
1 797 . 17 1 1 A 69 69 VAL HA H 69 5.260 5.126 0.134 1
1 805 . 17 1 1 A 69 69 VAL C C 69 176.710 174.699 2.011 1
1 806 . 17 1 1 A 69 69 VAL CA C 69 61.280 60.747 0.533 1
1 807 . 17 1 1 A 69 69 VAL CB C 69 33.980 35.009 -1.029 1
1 810 . 17 1 1 A 69 69 VAL N N 69 125.970 120.957 5.013 1
1 811 . 17 1 1 A 70 70 ASP H H 70 9.100 9.184 -0.084 1
1 812 . 17 1 1 A 70 70 ASP HA H 70 5.190 4.949 0.241 1
1 815 . 17 1 1 A 70 70 ASP C C 70 175.700 178.040 -2.340 1
1 816 . 17 1 1 A 70 70 ASP CA C 70 52.370 53.420 -1.050 1
1 817 . 17 1 1 A 70 70 ASP CB C 70 40.950 41.743 -0.793 1
1 818 . 17 1 1 A 70 70 ASP N N 70 130.320 126.881 3.439 1
1 819 . 17 1 1 A 71 71 PHE H H 71 9.090 9.197 -0.107 1
1 820 . 17 1 1 A 71 71 PHE HA H 71 4.100 4.005 0.095 1
1 823 . 17 1 1 A 71 71 PHE C C 71 177.000 177.524 -0.524 1
1 824 . 17 1 1 A 71 71 PHE CA C 71 58.230 62.129 -3.899 1
1 825 . 17 1 1 A 71 71 PHE CB C 71 36.910 39.161 -2.251 1
1 826 . 17 1 1 A 71 71 PHE N N 71 119.760 122.934 -3.174 1
1 827 . 17 1 1 A 72 72 GLN H H 72 8.440 8.120 0.320 1
1 828 . 17 1 1 A 72 72 GLN HA H 72 3.600 4.139 -0.539 1
1 831 . 17 1 1 A 72 72 GLN C C 72 178.820 178.461 0.359 1
1 832 . 17 1 1 A 72 72 GLN CA C 72 59.500 59.011 0.489 1
1 833 . 17 1 1 A 72 72 GLN CB C 72 29.553 28.234 1.319 1
1 835 . 17 1 1 A 72 72 GLN N N 72 121.820 118.556 3.264 1
1 836 . 17 1 1 A 73 73 GLU H H 73 8.290 8.046 0.244 1
1 837 . 17 1 1 A 73 73 GLU HA H 73 4.070 4.135 -0.065 1
1 842 . 17 1 1 A 73 73 GLU C C 73 179.370 178.981 0.389 1
1 843 . 17 1 1 A 73 73 GLU CA C 73 58.030 58.957 -0.927 1
1 844 . 17 1 1 A 73 73 GLU CB C 73 29.530 30.001 -0.471 1
1 846 . 17 1 1 A 73 73 GLU N N 73 120.550 120.266 0.284 1
1 847 . 17 1 1 A 74 74 PHE H H 74 8.630 8.595 0.035 1
1 848 . 17 1 1 A 74 74 PHE HA H 74 4.020 4.105 -0.085 1
1 851 . 17 1 1 A 74 74 PHE C C 74 177.890 177.593 0.297 1
1 852 . 17 1 1 A 74 74 PHE CA C 74 60.090 61.279 -1.189 1
1 853 . 17 1 1 A 74 74 PHE CB C 74 38.020 39.293 -1.273 1
1 854 . 17 1 1 A 74 74 PHE N N 74 121.010 121.635 -0.625 1
1 855 . 17 1 1 A 75 75 VAL H H 75 8.080 8.289 -0.209 1
1 856 . 17 1 1 A 75 75 VAL HA H 75 2.860 3.924 -1.064 1
1 864 . 17 1 1 A 75 75 VAL C C 75 177.030 177.790 -0.760 1
1 865 . 17 1 1 A 75 75 VAL CA C 75 66.430 65.152 1.278 1
1 866 . 17 1 1 A 75 75 VAL CB C 75 30.600 31.422 -0.822 1
1 869 . 17 1 1 A 75 75 VAL N N 75 119.460 119.040 0.420 1
1 870 . 17 1 1 A 76 76 VAL H H 76 7.100 8.175 -1.075 1
1 871 . 17 1 1 A 76 76 VAL HA H 76 3.330 3.688 -0.358 1
1 879 . 17 1 1 A 76 76 VAL C C 76 178.670 177.917 0.753 1
1 880 . 17 1 1 A 76 76 VAL CA C 76 67.000 65.984 1.016 1
1 881 . 17 1 1 A 76 76 VAL CB C 76 31.280 31.083 0.197 1
1 884 . 17 1 1 A 76 76 VAL N N 76 121.030 120.027 1.003 1
1 885 . 17 1 1 A 77 77 LEU H H 77 6.900 7.594 -0.694 1
1 886 . 17 1 1 A 77 77 LEU HA H 77 3.800 3.992 -0.192 1
1 896 . 17 1 1 A 77 77 LEU C C 77 177.960 178.329 -0.369 1
1 897 . 17 1 1 A 77 77 LEU CA C 77 57.710 57.878 -0.168 1
1 898 . 17 1 1 A 77 77 LEU CB C 77 40.070 41.733 -1.663 1
1 902 . 17 1 1 A 77 77 LEU N N 77 120.310 122.410 -2.100 1
1 903 . 17 1 1 A 78 78 VAL H H 78 7.240 7.356 -0.116 1
1 904 . 17 1 1 A 78 78 VAL HA H 78 3.030 3.785 -0.755 1
1 912 . 17 1 1 A 78 78 VAL C C 78 179.600 178.052 1.548 1
1 913 . 17 1 1 A 78 78 VAL CA C 78 66.420 64.761 1.659 1
1 914 . 17 1 1 A 78 78 VAL CB C 78 30.700 31.573 -0.873 1
1 917 . 17 1 1 A 78 78 VAL N N 78 117.180 116.163 1.017 1
1 918 . 17 1 1 A 79 79 ALA H H 79 9.000 8.225 0.775 1
1 919 . 17 1 1 A 79 79 ALA HA H 79 3.610 3.984 -0.374 1
1 923 . 17 1 1 A 79 79 ALA C C 79 182.260 180.008 2.252 1
1 924 . 17 1 1 A 79 79 ALA CA C 79 55.580 55.406 0.174 1
1 925 . 17 1 1 A 79 79 ALA CB C 79 18.400 18.028 0.372 1
1 926 . 17 1 1 A 79 79 ALA N N 79 126.000 125.328 0.672 1
1 927 . 17 1 1 A 80 80 ALA H H 80 8.000 7.676 0.324 1
1 928 . 17 1 1 A 80 80 ALA HA H 80 4.100 4.103 -0.003 1
1 932 . 17 1 1 A 80 80 ALA C C 80 175.460 180.011 -4.551 1
1 933 . 17 1 1 A 80 80 ALA CA C 80 56.020 54.692 1.328 1
1 934 . 17 1 1 A 80 80 ALA CB C 80 18.040 18.397 -0.357 1
1 935 . 17 1 1 A 80 80 ALA N N 80 120.730 121.029 -0.299 1
1 936 . 17 1 1 A 81 81 LEU H H 81 8.460 7.840 0.620 1
1 937 . 17 1 1 A 81 81 LEU HA H 81 4.000 4.065 -0.065 1
1 941 . 17 1 1 A 81 81 LEU C C 81 177.030 179.146 -2.116 1
1 942 . 17 1 1 A 81 81 LEU CA C 81 57.640 57.780 -0.140 1
1 943 . 17 1 1 A 81 81 LEU CB C 81 40.620 41.778 -1.158 1
1 945 . 17 1 1 A 81 81 LEU N N 81 119.890 120.242 -0.352 1
1 946 . 17 1 1 A 82 82 THR H H 82 8.320 7.824 0.496 1
1 947 . 17 1 1 A 82 82 THR HA H 82 3.800 3.941 -0.141 1
1 952 . 17 1 1 A 82 82 THR C C 82 181.010 176.900 4.110 1
1 953 . 17 1 1 A 82 82 THR CA C 82 68.500 66.197 2.303 1
1 954 . 17 1 1 A 82 82 THR CB C 82 67.400 69.298 -1.898 1
1 956 . 17 1 1 A 82 82 THR N N 82 117.120 113.121 3.999 1
1 957 . 17 1 1 A 83 83 VAL H H 83 8.530 7.566 0.964 1
1 958 . 17 1 1 A 83 83 VAL HA H 83 3.890 3.832 0.058 1
1 966 . 17 1 1 A 83 83 VAL C C 83 178.120 178.233 -0.113 1
1 967 . 17 1 1 A 83 83 VAL CA C 83 67.400 65.150 2.250 1
1 968 . 17 1 1 A 83 83 VAL CB C 83 31.590 31.534 0.056 1
1 971 . 17 1 1 A 83 83 VAL N N 83 119.760 117.970 1.790 1
1 972 . 17 1 1 A 84 84 ALA H H 84 7.910 8.247 -0.337 1
1 973 . 17 1 1 A 84 84 ALA HA H 84 4.060 4.150 -0.090 1
1 977 . 17 1 1 A 84 84 ALA C C 84 180.560 179.677 0.883 1
1 978 . 17 1 1 A 84 84 ALA CA C 84 55.000 54.887 0.113 1
1 979 . 17 1 1 A 84 84 ALA CB C 84 17.230 18.193 -0.963 1
1 980 . 17 1 1 A 84 84 ALA N N 84 122.620 124.495 -1.875 1
1 981 . 17 1 1 A 85 85 CYS H H 85 8.580 7.909 0.671 1
1 982 . 17 1 1 A 85 85 CYS HA H 85 4.080 4.596 -0.516 1
1 985 . 17 1 1 A 85 85 CYS C C 85 179.060 177.037 2.023 1
1 986 . 17 1 1 A 85 85 CYS CA C 85 63.210 61.677 1.533 1
1 987 . 17 1 1 A 85 85 CYS CB C 85 26.310 27.522 -1.212 1
1 988 . 17 1 1 A 85 85 CYS N N 85 118.730 117.201 1.529 1
1 989 . 17 1 1 A 86 86 ASN H H 86 8.430 8.100 0.330 1
1 990 . 17 1 1 A 86 86 ASN CA C 86 55.860 56.806 -0.946 1
1 991 . 17 1 1 A 86 86 ASN CB C 86 37.440 39.731 -2.291 1
1 992 . 17 1 1 A 86 86 ASN N N 86 119.360 119.112 0.248 1
1 993 . 17 1 1 A 87 87 ASN H H 87 7.880 8.042 -0.162 1
1 994 . 17 1 1 A 87 87 ASN HA H 87 4.600 4.576 0.024 1
1 997 . 17 1 1 A 87 87 ASN C C 87 178.510 177.091 1.419 1
1 998 . 17 1 1 A 87 87 ASN CA C 87 56.470 56.608 -0.138 1
1 999 . 17 1 1 A 87 87 ASN CB C 87 37.500 38.153 -0.653 1
1 1000 . 17 1 1 A 87 87 ASN N N 87 119.480 117.005 2.475 1
1 1001 . 17 1 1 A 88 88 PHE H H 88 8.050 7.814 0.236 1
1 1002 . 17 1 1 A 88 88 PHE HA H 88 4.200 4.339 -0.139 1
1 1005 . 17 1 1 A 88 88 PHE C C 88 178.510 177.548 0.962 1
1 1006 . 17 1 1 A 88 88 PHE CA C 88 56.460 59.805 -3.345 1
1 1007 . 17 1 1 A 88 88 PHE CB C 88 38.500 39.724 -1.224 1
1 1008 . 17 1 1 A 88 88 PHE N N 88 120.280 121.784 -1.504 1
1 1009 . 17 1 1 A 89 89 PHE H H 89 8.020 8.002 0.018 1
1 1010 . 17 1 1 A 89 89 PHE HA H 89 4.000 4.062 -0.062 1
1 1013 . 17 1 1 A 89 89 PHE C C 89 177.340 177.773 -0.433 1
1 1014 . 17 1 1 A 89 89 PHE CA C 89 59.000 60.105 -1.105 1
1 1015 . 17 1 1 A 89 89 PHE CB C 89 37.430 39.662 -2.232 1
1 1016 . 17 1 1 A 89 89 PHE N N 89 120.910 119.175 1.735 1
1 1017 . 17 1 1 A 90 90 TRP H H 90 7.800 7.761 0.039 1
1 1018 . 17 1 1 A 90 90 TRP HA H 90 4.460 4.333 0.127 1
1 1021 . 17 1 1 A 90 90 TRP C C 90 177.340 178.266 -0.926 1
1 1022 . 17 1 1 A 90 90 TRP CA C 90 57.930 59.353 -1.423 1
1 1023 . 17 1 1 A 90 90 TRP CB C 90 42.000 30.273 11.727 1
1 1024 . 17 1 1 A 90 90 TRP N N 90 120.050 120.476 -0.426 1
1 1025 . 17 1 1 A 91 91 GLU H H 91 7.800 8.362 -0.562 1
1 1026 . 17 1 1 A 91 91 GLU HA H 91 4.050 4.011 0.039 1
1 1031 . 17 1 1 A 91 91 GLU C C 91 177.570 177.873 -0.303 1
1 1032 . 17 1 1 A 91 91 GLU CA C 91 57.350 59.336 -1.986 1
1 1033 . 17 1 1 A 91 91 GLU CB C 91 29.530 29.340 0.190 1
1 1035 . 17 1 1 A 91 91 GLU N N 91 120.730 118.865 1.865 1
1 1036 . 17 1 1 A 92 92 ASN H H 92 7.800 7.419 0.381 1
1 1037 . 17 1 1 A 92 92 ASN HA H 92 4.630 4.602 0.028 1
1 1040 . 17 1 1 A 92 92 ASN C C 92 174.450 174.879 -0.429 1
1 1041 . 17 1 1 A 92 92 ASN CA C 92 52.960 52.636 0.324 1
1 1042 . 17 1 1 A 92 92 ASN CB C 92 29.530 38.734 -9.204 1
1 1043 . 17 1 1 A 92 92 ASN N N 92 119.410 116.462 2.948 1
1 5 . 18 1 1 A 2 2 SER H H 2 9.000 8.151 0.849 1
1 6 . 18 1 1 A 2 2 SER HA H 2 4.690 4.602 0.088 1
1 9 . 18 1 1 A 2 2 SER C C 2 176.170 175.680 0.490 1
1 10 . 18 1 1 A 2 2 SER CA C 2 57.340 57.401 -0.061 1
1 11 . 18 1 1 A 2 2 SER CB C 2 65.550 64.004 1.546 1
1 12 . 18 1 1 A 2 2 SER N N 2 119.330 114.381 4.949 1
1 13 . 18 1 1 A 3 3 GLU H H 3 9.350 9.040 0.310 1
1 14 . 18 1 1 A 3 3 GLU HA H 3 4.060 4.005 0.055 1
1 17 . 18 1 1 A 3 3 GLU C C 3 180.150 178.305 1.845 1
1 18 . 18 1 1 A 3 3 GLU CA C 3 60.280 59.455 0.825 1
1 19 . 18 1 1 A 3 3 GLU CB C 3 29.230 29.417 -0.187 1
1 21 . 18 1 1 A 3 3 GLU N N 3 125.350 126.451 -1.101 1
1 22 . 18 1 1 A 4 4 LEU H H 4 9.060 8.164 0.896 1
1 23 . 18 1 1 A 4 4 LEU HA H 4 4.080 4.015 0.065 1
1 33 . 18 1 1 A 4 4 LEU C C 4 177.890 179.352 -1.462 1
1 34 . 18 1 1 A 4 4 LEU CA C 4 58.090 57.998 0.092 1
1 35 . 18 1 1 A 4 4 LEU CB C 4 42.120 41.210 0.910 1
1 39 . 18 1 1 A 4 4 LEU N N 4 121.090 120.031 1.059 1
1 40 . 18 1 1 A 5 5 GLU H H 5 8.340 8.222 0.118 1
1 41 . 18 1 1 A 5 5 GLU HA H 5 4.050 4.002 0.048 1
1 46 . 18 1 1 A 5 5 GLU C C 5 177.030 179.043 -2.013 1
1 47 . 18 1 1 A 5 5 GLU CA C 5 59.840 59.367 0.473 1
1 48 . 18 1 1 A 5 5 GLU CB C 5 28.940 29.131 -0.191 1
1 50 . 18 1 1 A 5 5 GLU N N 5 119.780 119.176 0.604 1
1 51 . 18 1 1 A 6 6 THR H H 6 8.370 8.378 -0.008 1
1 52 . 18 1 1 A 6 6 THR HA H 6 4.310 3.918 0.392 1
1 57 . 18 1 1 A 6 6 THR C C 6 177.340 176.698 0.642 1
1 58 . 18 1 1 A 6 6 THR CA C 6 66.630 66.360 0.270 1
1 59 . 18 1 1 A 6 6 THR CB C 6 68.650 68.557 0.093 1
1 61 . 18 1 1 A 6 6 THR N N 6 116.940 117.970 -1.030 1
1 62 . 18 1 1 A 7 7 ALA H H 7 8.270 7.648 0.622 1
1 63 . 18 1 1 A 7 7 ALA HA H 7 4.190 4.008 0.182 1
1 67 . 18 1 1 A 7 7 ALA C C 7 179.760 179.315 0.445 1
1 68 . 18 1 1 A 7 7 ALA CA C 7 55.880 55.291 0.589 1
1 69 . 18 1 1 A 7 7 ALA CB C 7 17.720 18.024 -0.304 1
1 70 . 18 1 1 A 7 7 ALA N N 7 127.400 123.992 3.408 1
1 71 . 18 1 1 A 8 8 MET H H 8 8.110 7.587 0.523 1
1 72 . 18 1 1 A 8 8 MET HA H 8 4.020 4.164 -0.144 1
1 80 . 18 1 1 A 8 8 MET C C 8 178.510 178.059 0.451 1
1 81 . 18 1 1 A 8 8 MET CA C 8 60.580 58.170 2.410 1
1 82 . 18 1 1 A 8 8 MET CB C 8 33.630 32.195 1.435 1
1 85 . 18 1 1 A 8 8 MET N N 8 117.520 118.450 -0.930 1
1 86 . 18 1 1 A 9 9 GLU H H 9 8.210 7.793 0.417 1
1 87 . 18 1 1 A 9 9 GLU HA H 9 3.830 4.106 -0.276 1
1 92 . 18 1 1 A 9 9 GLU C C 9 179.140 178.640 0.500 1
1 93 . 18 1 1 A 9 9 GLU CA C 9 59.690 59.253 0.437 1
1 94 . 18 1 1 A 9 9 GLU CB C 9 29.530 29.204 0.326 1
1 96 . 18 1 1 A 9 9 GLU N N 9 118.560 118.188 0.372 1
1 97 . 18 1 1 A 10 10 THR H H 10 8.490 7.542 0.948 1
1 98 . 18 1 1 A 10 10 THR HA H 10 4.000 4.040 -0.040 1
1 103 . 18 1 1 A 10 10 THR C C 10 176.010 176.335 -0.325 1
1 104 . 18 1 1 A 10 10 THR CA C 10 67.110 65.704 1.406 1
1 105 . 18 1 1 A 10 10 THR CB C 10 67.770 68.865 -1.095 1
1 107 . 18 1 1 A 10 10 THR N N 10 118.310 116.462 1.848 1
1 108 . 18 1 1 A 11 11 LEU H H 11 7.920 7.738 0.182 1
1 109 . 18 1 1 A 11 11 LEU HA H 11 3.930 3.848 0.082 1
1 119 . 18 1 1 A 11 11 LEU C C 11 178.820 178.869 -0.049 1
1 120 . 18 1 1 A 11 11 LEU CA C 11 59.690 58.083 1.607 1
1 121 . 18 1 1 A 11 11 LEU CB C 11 41.920 41.465 0.455 1
1 125 . 18 1 1 A 11 11 LEU N N 11 121.150 120.859 0.291 1
1 126 . 18 1 1 A 12 12 ILE H H 12 7.440 7.628 -0.188 1
1 127 . 18 1 1 A 12 12 ILE HA H 12 3.640 3.578 0.062 1
1 137 . 18 1 1 A 12 12 ILE C C 12 179.530 178.414 1.116 1
1 138 . 18 1 1 A 12 12 ILE CA C 12 63.740 64.983 -1.243 1
1 139 . 18 1 1 A 12 12 ILE CB C 12 38.800 37.438 1.362 1
1 143 . 18 1 1 A 12 12 ILE N N 12 118.010 119.966 -1.956 1
1 144 . 18 1 1 A 13 13 ASN H H 13 8.930 8.033 0.897 1
1 145 . 18 1 1 A 13 13 ASN HA H 13 4.520 4.573 -0.053 1
1 148 . 18 1 1 A 13 13 ASN C C 13 179.450 177.457 1.993 1
1 149 . 18 1 1 A 13 13 ASN CA C 13 56.470 56.373 0.097 1
1 150 . 18 1 1 A 13 13 ASN CB C 13 37.930 38.729 -0.799 1
1 151 . 18 1 1 A 13 13 ASN N N 13 121.820 119.888 1.932 1
1 152 . 18 1 1 A 14 14 VAL H H 14 9.180 8.191 0.989 1
1 153 . 18 1 1 A 14 14 VAL HA H 14 3.830 3.809 0.021 1
1 161 . 18 1 1 A 14 14 VAL CA C 14 65.840 65.211 0.629 1
1 162 . 18 1 1 A 14 14 VAL CB C 14 31.290 31.256 0.034 1
1 165 . 18 1 1 A 14 14 VAL N N 14 122.040 118.636 3.404 1
1 166 . 18 1 1 A 15 15 PHE H H 15 7.590 7.987 -0.397 1
1 167 . 18 1 1 A 15 15 PHE HA H 15 3.360 3.904 -0.544 1
1 170 . 18 1 1 A 15 15 PHE C C 15 177.890 177.827 0.063 1
1 171 . 18 1 1 A 15 15 PHE CA C 15 62.030 59.996 2.034 1
1 172 . 18 1 1 A 15 15 PHE CB C 15 38.900 38.147 0.753 1
1 173 . 18 1 1 A 15 15 PHE N N 15 118.290 121.116 -2.826 1
1 174 . 18 1 1 A 16 16 HIS H H 16 7.790 7.438 0.352 1
1 175 . 18 1 1 A 16 16 HIS HA H 16 4.890 4.357 0.533 1
1 178 . 18 1 1 A 16 16 HIS C C 16 177.810 177.539 0.271 1
1 179 . 18 1 1 A 16 16 HIS CA C 16 59.100 59.807 -0.707 1
1 180 . 18 1 1 A 16 16 HIS CB C 16 28.060 29.147 -1.087 1
1 181 . 18 1 1 A 16 16 HIS N N 16 118.290 117.060 1.230 1
1 182 . 18 1 1 A 17 17 ALA H H 17 8.040 7.901 0.139 1
1 183 . 18 1 1 A 17 17 ALA HA H 17 4.050 3.991 0.059 1
1 187 . 18 1 1 A 17 17 ALA C C 17 179.600 179.947 -0.347 1
1 188 . 18 1 1 A 17 17 ALA CA C 17 54.000 55.333 -1.333 1
1 189 . 18 1 1 A 17 17 ALA CB C 17 17.520 18.677 -1.157 1
1 190 . 18 1 1 A 17 17 ALA N N 17 124.410 121.868 2.542 1
1 191 . 18 1 1 A 18 18 HIS H H 18 7.000 7.472 -0.472 1
1 192 . 18 1 1 A 18 18 HIS HA H 18 4.330 4.415 -0.085 1
1 195 . 18 1 1 A 18 18 HIS C C 18 176.320 178.030 -1.710 1
1 196 . 18 1 1 A 18 18 HIS CA C 18 57.350 58.827 -1.477 1
1 197 . 18 1 1 A 18 18 HIS CB C 18 32.920 30.433 2.487 1
1 198 . 18 1 1 A 18 18 HIS N N 18 115.160 115.941 -0.781 1
1 199 . 18 1 1 A 19 19 SER H H 19 8.380 8.306 0.074 1
1 200 . 18 1 1 A 19 19 SER HA H 19 3.640 4.309 -0.669 1
1 203 . 18 1 1 A 19 19 SER C C 19 177.340 176.063 1.277 1
1 204 . 18 1 1 A 19 19 SER CA C 19 60.160 61.173 -1.013 1
1 205 . 18 1 1 A 19 19 SER CB C 19 61.000 62.343 -1.343 1
1 206 . 18 1 1 A 19 19 SER N N 19 114.380 116.003 -1.623 1
1 207 . 18 1 1 A 20 20 GLY H H 20 7.600 7.812 -0.212 1
1 208 . 18 1 1 A 20 20 GLY HA2 H 20 3.680 3.994 -0.314 1
1 209 . 18 1 1 A 20 20 GLY HA3 H 20 4.000 4.004 -0.004 1
1 210 . 18 1 1 A 20 20 GLY C C 20 174.140 174.049 0.091 1
1 211 . 18 1 1 A 20 20 GLY CA C 20 47.000 45.352 1.648 1
1 212 . 18 1 1 A 20 20 GLY N N 20 112.550 109.259 3.291 1
1 213 . 18 1 1 A 21 21 LYS H H 21 7.230 7.716 -0.486 1
1 214 . 18 1 1 A 21 21 LYS HA H 21 3.860 4.399 -0.539 1
1 223 . 18 1 1 A 21 21 LYS C C 21 177.730 177.887 -0.157 1
1 224 . 18 1 1 A 21 21 LYS CA C 21 59.110 56.943 2.167 1
1 225 . 18 1 1 A 21 21 LYS CB C 21 32.460 35.013 -2.553 1
1 229 . 18 1 1 A 21 21 LYS N N 21 123.240 117.808 5.432 1
1 230 . 18 1 1 A 22 22 GLU H H 22 9.350 7.942 1.408 1
1 231 . 18 1 1 A 22 22 GLU HA H 22 4.610 4.425 0.185 1
1 236 . 18 1 1 A 22 22 GLU C C 22 177.420 175.740 1.680 1
1 237 . 18 1 1 A 22 22 GLU CA C 22 53.700 56.342 -2.642 1
1 238 . 18 1 1 A 22 22 GLU CB C 22 32.000 30.078 1.922 1
1 240 . 18 1 1 A 22 22 GLU N N 22 116.770 115.652 1.118 1
1 241 . 18 1 1 A 23 23 GLY H H 23 7.570 7.644 -0.074 1
1 242 . 18 1 1 A 23 23 GLY HA2 H 23 3.630 4.003 -0.373 1
1 243 . 18 1 1 A 23 23 GLY HA3 H 23 3.880 4.023 -0.143 1
1 244 . 18 1 1 A 23 23 GLY C C 23 173.980 171.831 2.149 1
1 245 . 18 1 1 A 23 23 GLY CA C 23 45.250 45.530 -0.280 1
1 246 . 18 1 1 A 23 23 GLY N N 23 112.180 107.357 4.823 1
1 247 . 18 1 1 A 24 24 ASP H H 24 8.680 8.497 0.183 1
1 248 . 18 1 1 A 24 24 ASP HA H 24 4.380 4.660 -0.280 1
1 251 . 18 1 1 A 24 24 ASP C C 24 178.590 177.529 1.061 1
1 252 . 18 1 1 A 24 24 ASP CA C 24 60.000 53.867 6.133 1
1 253 . 18 1 1 A 24 24 ASP CB C 24 27.480 42.146 -14.666 1
1 254 . 18 1 1 A 24 24 ASP N N 24 127.470 120.406 7.064 1
1 255 . 18 1 1 A 25 25 LYS H H 25 9.270 8.837 0.433 1
1 256 . 18 1 1 A 25 25 LYS HA H 25 4.250 3.931 0.319 1
1 265 . 18 1 1 A 25 25 LYS C C 25 177.030 177.320 -0.290 1
1 266 . 18 1 1 A 25 25 LYS CA C 25 60.000 60.237 -0.237 1
1 267 . 18 1 1 A 25 25 LYS CB C 25 31.170 32.435 -1.265 1
1 271 . 18 1 1 A 25 25 LYS N N 25 132.960 124.952 8.008 1
1 272 . 18 1 1 A 26 26 TYR H H 26 9.430 7.968 1.462 1
1 273 . 18 1 1 A 26 26 TYR HA H 26 4.640 4.688 -0.048 1
1 276 . 18 1 1 A 26 26 TYR C C 26 174.290 174.811 -0.521 1
1 277 . 18 1 1 A 26 26 TYR CA C 26 56.010 58.107 -2.097 1
1 278 . 18 1 1 A 26 26 TYR CB C 26 37.730 38.770 -1.040 1
1 279 . 18 1 1 A 26 26 TYR N N 26 120.650 120.054 0.596 1
1 280 . 18 1 1 A 27 27 LYS H H 27 7.110 7.460 -0.350 1
1 281 . 18 1 1 A 27 27 LYS HA H 27 5.110 4.821 0.289 1
1 290 . 18 1 1 A 27 27 LYS C C 27 175.150 173.725 1.425 1
1 291 . 18 1 1 A 27 27 LYS CA C 27 55.070 55.351 -0.281 1
1 292 . 18 1 1 A 27 27 LYS CB C 27 38.900 36.029 2.871 1
1 296 . 18 1 1 A 27 27 LYS N N 27 115.830 120.595 -4.765 1
1 297 . 18 1 1 A 28 28 LEU H H 28 9.820 8.370 1.450 1
1 298 . 18 1 1 A 28 28 LEU HA H 28 5.080 4.768 0.312 1
1 308 . 18 1 1 A 28 28 LEU C C 28 176.640 174.858 1.782 1
1 309 . 18 1 1 A 28 28 LEU CA C 28 52.660 53.736 -1.076 1
1 310 . 18 1 1 A 28 28 LEU CB C 28 42.710 43.738 -1.028 1
1 314 . 18 1 1 A 28 28 LEU N N 28 126.930 128.386 -1.456 1
1 315 . 18 1 1 A 29 29 SER H H 29 9.890 8.369 1.521 1
1 316 . 18 1 1 A 29 29 SER HA H 29 4.530 5.035 -0.505 1
1 319 . 18 1 1 A 29 29 SER C C 29 174.990 174.669 0.321 1
1 320 . 18 1 1 A 29 29 SER CA C 29 56.180 56.008 0.172 1
1 321 . 18 1 1 A 29 29 SER CB C 29 65.550 65.667 -0.117 1
1 322 . 18 1 1 A 29 29 SER N N 29 121.600 118.446 3.154 1
1 323 . 18 1 1 A 30 30 LYS H H 30 8.850 8.842 0.008 1
1 324 . 18 1 1 A 30 30 LYS HA H 30 3.850 3.972 -0.122 1
1 333 . 18 1 1 A 30 30 LYS C C 30 175.620 177.463 -1.843 1
1 334 . 18 1 1 A 30 30 LYS CA C 30 60.860 60.190 0.670 1
1 335 . 18 1 1 A 30 30 LYS CB C 30 31.290 32.082 -0.792 1
1 339 . 18 1 1 A 30 30 LYS N N 30 121.260 126.677 -5.417 1
1 340 . 18 1 1 A 31 31 LYS H H 31 7.970 7.978 -0.008 1
1 341 . 18 1 1 A 31 31 LYS HA H 31 3.880 3.997 -0.117 1
1 350 . 18 1 1 A 31 31 LYS C C 31 179.290 179.319 -0.029 1
1 351 . 18 1 1 A 31 31 LYS CA C 31 59.110 59.245 -0.135 1
1 352 . 18 1 1 A 31 31 LYS CB C 31 32.640 31.694 0.946 1
1 356 . 18 1 1 A 31 31 LYS N N 31 121.260 118.639 2.621 1
1 357 . 18 1 1 A 32 32 GLU H H 32 7.510 7.767 -0.257 1
1 358 . 18 1 1 A 32 32 GLU HA H 32 3.830 4.064 -0.234 1
1 363 . 18 1 1 A 32 32 GLU C C 32 179.290 179.636 -0.346 1
1 364 . 18 1 1 A 32 32 GLU CA C 32 58.590 58.857 -0.267 1
1 365 . 18 1 1 A 32 32 GLU CB C 32 30.120 29.852 0.268 1
1 367 . 18 1 1 A 32 32 GLU N N 32 120.090 119.450 0.640 1
1 368 . 18 1 1 A 33 33 LEU H H 33 8.970 7.751 1.219 1
1 369 . 18 1 1 A 33 33 LEU HA H 33 3.830 3.967 -0.137 1
1 379 . 18 1 1 A 33 33 LEU C C 33 178.200 178.841 -0.641 1
1 380 . 18 1 1 A 33 33 LEU CA C 33 57.930 58.091 -0.161 1
1 381 . 18 1 1 A 33 33 LEU CB C 33 40.660 41.658 -0.998 1
1 385 . 18 1 1 A 33 33 LEU N N 33 120.200 119.414 0.786 1
1 386 . 18 1 1 A 34 34 LYS H H 34 8.230 7.548 0.682 1
1 387 . 18 1 1 A 34 34 LYS HA H 34 3.550 3.907 -0.357 1
1 396 . 18 1 1 A 34 34 LYS C C 34 178.040 177.884 0.156 1
1 397 . 18 1 1 A 34 34 LYS CA C 34 60.720 59.691 1.029 1
1 398 . 18 1 1 A 34 34 LYS CB C 34 31.980 31.958 0.022 1
1 402 . 18 1 1 A 34 34 LYS N N 34 120.780 119.441 1.339 1
1 403 . 18 1 1 A 35 35 ASP H H 35 7.990 7.844 0.146 1
1 404 . 18 1 1 A 35 35 ASP HA H 35 4.250 4.400 -0.150 1
1 407 . 18 1 1 A 35 35 ASP C C 35 179.060 178.604 0.456 1
1 408 . 18 1 1 A 35 35 ASP CA C 35 56.830 57.494 -0.664 1
1 409 . 18 1 1 A 35 35 ASP CB C 35 40.440 41.039 -0.599 1
1 410 . 18 1 1 A 35 35 ASP N N 35 119.550 119.451 0.099 1
1 411 . 18 1 1 A 36 36 LEU H H 36 8.130 7.908 0.222 1
1 412 . 18 1 1 A 36 36 LEU HA H 36 2.580 3.731 -1.151 1
1 422 . 18 1 1 A 36 36 LEU C C 36 179.450 179.453 -0.003 1
1 423 . 18 1 1 A 36 36 LEU CA C 36 59.980 58.062 1.918 1
1 424 . 18 1 1 A 36 36 LEU CB C 36 42.180 41.519 0.661 1
1 428 . 18 1 1 A 36 36 LEU N N 36 125.560 120.016 5.544 1
1 429 . 18 1 1 A 37 37 LEU H H 37 8.740 7.990 0.750 1
1 430 . 18 1 1 A 37 37 LEU HA H 37 3.580 4.019 -0.439 1
1 440 . 18 1 1 A 37 37 LEU C C 37 179.290 179.131 0.159 1
1 441 . 18 1 1 A 37 37 LEU CA C 37 58.230 58.086 0.144 1
1 442 . 18 1 1 A 37 37 LEU CB C 37 41.590 40.868 0.722 1
1 446 . 18 1 1 A 37 37 LEU N N 37 120.520 118.811 1.709 1
1 447 . 18 1 1 A 38 38 GLN H H 38 8.520 7.959 0.561 1
1 448 . 18 1 1 A 38 38 GLN HA H 38 4.000 4.039 -0.039 1
1 453 . 18 1 1 A 38 38 GLN C C 38 177.960 178.602 -0.642 1
1 454 . 18 1 1 A 38 38 GLN CA C 38 58.210 58.863 -0.653 1
1 455 . 18 1 1 A 38 38 GLN CB C 38 28.650 28.414 0.236 1
1 457 . 18 1 1 A 38 38 GLN N N 38 116.740 119.184 -2.444 1
1 458 . 18 1 1 A 39 39 THR H H 39 7.910 8.593 -0.683 1
1 459 . 18 1 1 A 39 39 THR HA H 39 4.210 3.802 0.408 1
1 464 . 18 1 1 A 39 39 THR C C 39 177.180 175.625 1.555 1
1 465 . 18 1 1 A 39 39 THR CA C 39 64.730 67.200 -2.470 1
1 466 . 18 1 1 A 39 39 THR CB C 39 69.650 68.712 0.938 1
1 468 . 18 1 1 A 39 39 THR N N 39 111.400 117.242 -5.842 1
1 469 . 18 1 1 A 40 40 GLU H H 40 8.590 7.503 1.087 1
1 470 . 18 1 1 A 40 40 GLU HA H 40 4.680 4.527 0.153 1
1 475 . 18 1 1 A 40 40 GLU C C 40 178.280 177.747 0.533 1
1 476 . 18 1 1 A 40 40 GLU CA C 40 55.880 56.764 -0.884 1
1 477 . 18 1 1 A 40 40 GLU CB C 40 30.990 30.672 0.318 1
1 479 . 18 1 1 A 40 40 GLU N N 40 117.840 116.799 1.041 1
1 480 . 18 1 1 A 41 41 LEU H H 41 7.680 7.405 0.275 1
1 481 . 18 1 1 A 41 41 LEU HA H 41 5.080 4.888 0.192 1
1 491 . 18 1 1 A 41 41 LEU C C 41 179.450 177.130 2.320 1
1 492 . 18 1 1 A 41 41 LEU CA C 41 53.830 54.258 -0.428 1
1 493 . 18 1 1 A 41 41 LEU CB C 41 41.360 42.710 -1.350 1
1 497 . 18 1 1 A 41 41 LEU N N 41 121.410 117.377 4.033 1
1 498 . 18 1 1 A 42 42 SER H H 42 8.380 8.318 0.062 1
1 499 . 18 1 1 A 42 42 SER HA H 42 4.130 4.142 -0.012 1
1 502 . 18 1 1 A 42 42 SER C C 42 176.640 177.260 -0.620 1
1 503 . 18 1 1 A 42 42 SER CA C 42 61.280 61.644 -0.364 1
1 504 . 18 1 1 A 42 42 SER CB C 42 63.040 62.411 0.629 1
1 505 . 18 1 1 A 42 42 SER N N 42 117.420 116.219 1.201 1
1 506 . 18 1 1 A 43 43 SER H H 43 8.900 8.146 0.754 1
1 507 . 18 1 1 A 43 43 SER HA H 43 4.290 4.310 -0.020 1
1 510 . 18 1 1 A 43 43 SER C C 43 175.620 176.816 -1.196 1
1 511 . 18 1 1 A 43 43 SER CA C 43 60.860 61.485 -0.625 1
1 512 . 18 1 1 A 43 43 SER CB C 43 62.910 63.194 -0.284 1
1 513 . 18 1 1 A 43 43 SER N N 43 117.580 116.701 0.879 1
1 514 . 18 1 1 A 44 44 PHE H H 44 7.880 8.156 -0.276 1
1 515 . 18 1 1 A 44 44 PHE HA H 44 4.240 4.163 0.077 1
1 518 . 18 1 1 A 44 44 PHE C C 44 176.950 175.834 1.116 1
1 519 . 18 1 1 A 44 44 PHE CA C 44 62.710 61.345 1.365 1
1 520 . 18 1 1 A 44 44 PHE CB C 44 39.020 39.038 -0.018 1
1 521 . 18 1 1 A 44 44 PHE N N 44 119.480 122.500 -3.020 1
1 522 . 18 1 1 A 45 45 LEU H H 45 8.060 7.598 0.462 1
1 523 . 18 1 1 A 45 45 LEU HA H 45 3.810 3.544 0.266 1
1 533 . 18 1 1 A 45 45 LEU C C 45 177.500 176.043 1.457 1
1 534 . 18 1 1 A 45 45 LEU CA C 45 59.980 55.177 4.803 1
1 535 . 18 1 1 A 45 45 LEU CB C 45 39.640 41.975 -2.335 1
1 538 . 18 1 1 A 45 45 LEU N N 45 118.010 120.964 -2.954 1
1 539 . 18 1 1 A 46 46 ASP H H 46 8.150 8.551 -0.401 1
1 540 . 18 1 1 A 46 46 ASP HA H 46 4.470 4.764 -0.294 1
1 543 . 18 1 1 A 46 46 ASP C C 46 179.920 175.478 4.442 1
1 544 . 18 1 1 A 46 46 ASP CA C 46 52.950 53.985 -1.035 1
1 545 . 18 1 1 A 46 46 ASP CB C 46 40.000 40.210 -0.210 1
1 546 . 18 1 1 A 46 46 ASP N N 46 119.460 123.552 -4.092 1
1 547 . 18 1 1 A 47 47 VAL H H 47 8.010 7.950 0.060 1
1 548 . 18 1 1 A 47 47 VAL HA H 47 3.800 4.215 -0.415 1
1 556 . 18 1 1 A 47 47 VAL C C 47 175.460 177.327 -1.867 1
1 557 . 18 1 1 A 47 47 VAL CA C 47 60.000 63.562 -3.562 1
1 558 . 18 1 1 A 47 47 VAL CB C 47 31.580 32.839 -1.259 1
1 561 . 18 1 1 A 47 47 VAL N N 47 117.720 124.345 -6.625 1
1 562 . 18 1 1 A 48 48 GLN H H 48 7.960 8.722 -0.762 1
1 563 . 18 1 1 A 48 48 GLN HA H 48 4.060 4.033 0.027 1
1 568 . 18 1 1 A 48 48 GLN C C 48 179.370 178.519 0.851 1
1 569 . 18 1 1 A 48 48 GLN CA C 48 57.350 58.839 -1.489 1
1 570 . 18 1 1 A 48 48 GLN CB C 48 28.990 28.617 0.373 1
1 572 . 18 1 1 A 48 48 GLN N N 48 119.900 119.519 0.381 1
1 573 . 18 1 1 A 49 49 LYS H H 49 7.810 7.860 -0.050 1
1 574 . 18 1 1 A 49 49 LYS HA H 49 3.860 4.150 -0.290 1
1 583 . 18 1 1 A 49 49 LYS C C 49 177.890 176.314 1.576 1
1 584 . 18 1 1 A 49 49 LYS CA C 49 58.230 58.944 -0.714 1
1 585 . 18 1 1 A 49 49 LYS CB C 49 30.990 32.021 -1.031 1
1 587 . 18 1 1 A 49 49 LYS N N 49 120.030 119.132 0.898 1
1 588 . 18 1 1 A 50 50 ASP H H 50 7.570 8.013 -0.443 1
1 589 . 18 1 1 A 50 50 ASP HA H 50 4.700 4.873 -0.173 1
1 590 . 18 1 1 A 50 50 ASP CA C 50 52.950 52.639 0.311 1
1 591 . 18 1 1 A 50 50 ASP CB C 50 38.900 39.714 -0.814 1
1 592 . 18 1 1 A 50 50 ASP N N 50 116.730 118.671 -1.941 1
1 593 . 18 1 1 A 51 51 ALA H H 51 7.570 8.756 -1.186 1
1 594 . 18 1 1 A 51 51 ALA HA H 51 4.200 3.956 0.244 1
1 598 . 18 1 1 A 51 51 ALA C C 51 179.760 179.310 0.450 1
1 599 . 18 1 1 A 51 51 ALA CA C 51 54.200 55.459 -1.259 1
1 600 . 18 1 1 A 51 51 ALA CB C 51 18.110 18.328 -0.218 1
1 601 . 18 1 1 A 51 51 ALA N N 51 118.390 128.409 -10.019 1
1 602 . 18 1 1 A 52 52 ASP H H 52 8.430 8.452 -0.022 1
1 603 . 18 1 1 A 52 52 ASP HA H 52 4.600 4.348 0.252 1
1 606 . 18 1 1 A 52 52 ASP C C 52 177.570 178.463 -0.893 1
1 607 . 18 1 1 A 52 52 ASP CA C 52 54.420 56.809 -2.389 1
1 608 . 18 1 1 A 52 52 ASP CB C 52 40.360 40.113 0.247 1
1 609 . 18 1 1 A 52 52 ASP N N 52 117.530 119.733 -2.203 1
1 610 . 18 1 1 A 53 53 ALA H H 53 7.660 7.928 -0.268 1
1 611 . 18 1 1 A 53 53 ALA HA H 53 3.860 4.004 -0.144 1
1 615 . 18 1 1 A 53 53 ALA C C 53 180.070 180.546 -0.476 1
1 616 . 18 1 1 A 53 53 ALA CA C 53 55.590 55.339 0.251 1
1 617 . 18 1 1 A 53 53 ALA CB C 53 18.800 18.172 0.628 1
1 618 . 18 1 1 A 53 53 ALA N N 53 123.450 122.428 1.022 1
1 619 . 18 1 1 A 54 54 VAL H H 54 8.030 7.961 0.069 1
1 620 . 18 1 1 A 54 54 VAL HA H 54 3.240 3.639 -0.399 1
1 628 . 18 1 1 A 54 54 VAL C C 54 177.340 177.850 -0.510 1
1 629 . 18 1 1 A 54 54 VAL CA C 54 66.620 65.832 0.788 1
1 630 . 18 1 1 A 54 54 VAL CB C 54 30.480 31.202 -0.722 1
1 633 . 18 1 1 A 54 54 VAL N N 54 116.150 117.590 -1.440 1
1 634 . 18 1 1 A 55 55 ASP H H 55 7.660 8.025 -0.365 1
1 635 . 18 1 1 A 55 55 ASP HA H 55 4.080 4.379 -0.299 1
1 638 . 18 1 1 A 55 55 ASP C C 55 177.260 179.330 -2.070 1
1 639 . 18 1 1 A 55 55 ASP CA C 55 57.640 57.313 0.327 1
1 640 . 18 1 1 A 55 55 ASP CB C 55 40.360 40.205 0.155 1
1 641 . 18 1 1 A 55 55 ASP N N 55 120.830 122.202 -1.372 1
1 642 . 18 1 1 A 56 56 LYS H H 56 7.780 7.655 0.125 1
1 643 . 18 1 1 A 56 56 LYS HA H 56 3.860 4.018 -0.158 1
1 652 . 18 1 1 A 56 56 LYS C C 56 179.530 179.504 0.026 1
1 653 . 18 1 1 A 56 56 LYS CA C 56 59.690 59.714 -0.024 1
1 654 . 18 1 1 A 56 56 LYS CB C 56 31.870 32.533 -0.663 1
1 658 . 18 1 1 A 56 56 LYS N N 56 120.010 119.654 0.356 1
1 659 . 18 1 1 A 57 57 ILE H H 57 8.090 7.813 0.277 1
1 660 . 18 1 1 A 57 57 ILE HA H 57 3.390 3.631 -0.241 1
1 670 . 18 1 1 A 57 57 ILE C C 57 176.710 177.529 -0.819 1
1 671 . 18 1 1 A 57 57 ILE CA C 57 64.960 65.242 -0.282 1
1 672 . 18 1 1 A 57 57 ILE CB C 57 38.080 38.310 -0.230 1
1 676 . 18 1 1 A 57 57 ILE N N 57 120.960 120.299 0.661 1
1 677 . 18 1 1 A 58 58 MET H H 58 8.480 8.350 0.130 1
1 678 . 18 1 1 A 58 58 MET HA H 58 3.800 4.073 -0.273 1
1 686 . 18 1 1 A 58 58 MET C C 58 177.570 177.984 -0.414 1
1 687 . 18 1 1 A 58 58 MET CA C 58 58.570 58.563 0.007 1
1 688 . 18 1 1 A 58 58 MET CB C 58 32.570 31.649 0.921 1
1 691 . 18 1 1 A 58 58 MET N N 58 119.160 120.684 -1.524 1
1 692 . 18 1 1 A 59 59 LYS H H 59 7.550 7.915 -0.365 1
1 693 . 18 1 1 A 59 59 LYS HA H 59 3.930 3.977 -0.047 1
1 702 . 18 1 1 A 59 59 LYS C C 59 179.530 179.255 0.275 1
1 703 . 18 1 1 A 59 59 LYS CA C 59 58.820 59.705 -0.885 1
1 704 . 18 1 1 A 59 59 LYS CB C 59 32.450 32.488 -0.038 1
1 708 . 18 1 1 A 59 59 LYS N N 59 116.730 119.870 -3.140 1
1 709 . 18 1 1 A 60 60 GLU H H 60 7.470 7.706 -0.236 1
1 710 . 18 1 1 A 60 60 GLU HA H 60 4.050 4.100 -0.050 1
1 715 . 18 1 1 A 60 60 GLU C C 60 178.950 178.205 0.745 1
1 716 . 18 1 1 A 60 60 GLU CA C 60 58.600 58.760 -0.160 1
1 717 . 18 1 1 A 60 60 GLU CB C 60 31.700 29.569 2.131 1
1 719 . 18 1 1 A 60 60 GLU N N 60 116.820 118.953 -2.133 1
1 720 . 18 1 1 A 61 61 LEU H H 61 8.030 7.496 0.534 1
1 721 . 18 1 1 A 61 61 LEU HA H 61 4.310 4.362 -0.052 1
1 731 . 18 1 1 A 61 61 LEU C C 61 179.450 176.914 2.536 1
1 732 . 18 1 1 A 61 61 LEU CA C 61 54.840 55.032 -0.192 1
1 733 . 18 1 1 A 61 61 LEU CB C 61 43.820 42.304 1.516 1
1 737 . 18 1 1 A 61 61 LEU N N 61 116.000 118.431 -2.431 1
1 738 . 18 1 1 A 62 62 ASP H H 62 7.890 8.446 -0.556 1
1 739 . 18 1 1 A 62 62 ASP HA H 62 4.660 4.907 -0.247 1
1 742 . 18 1 1 A 62 62 ASP C C 62 177.030 176.170 0.860 1
1 743 . 18 1 1 A 62 62 ASP CA C 62 53.660 53.879 -0.219 1
1 744 . 18 1 1 A 62 62 ASP CB C 62 38.700 39.761 -1.061 1
1 745 . 18 1 1 A 62 62 ASP N N 62 117.550 119.554 -2.004 1
1 746 . 18 1 1 A 63 63 GLU H H 63 8.430 8.904 -0.474 1
1 747 . 18 1 1 A 63 63 GLU HA H 63 4.020 4.044 -0.024 1
1 752 . 18 1 1 A 63 63 GLU C C 63 178.120 178.636 -0.516 1
1 753 . 18 1 1 A 63 63 GLU CA C 63 58.470 59.209 -0.739 1
1 754 . 18 1 1 A 63 63 GLU CB C 63 30.120 29.390 0.730 1
1 756 . 18 1 1 A 63 63 GLU N N 63 130.230 120.355 9.875 1
1 757 . 18 1 1 A 64 64 ASN H H 64 8.010 7.247 0.763 1
1 758 . 18 1 1 A 64 64 ASN HA H 64 4.680 4.829 -0.149 1
1 761 . 18 1 1 A 64 64 ASN C C 64 177.100 175.659 1.441 1
1 762 . 18 1 1 A 64 64 ASN CA C 64 51.780 53.186 -1.406 1
1 763 . 18 1 1 A 64 64 ASN CB C 64 37.260 39.143 -1.883 1
1 764 . 18 1 1 A 64 64 ASN N N 64 113.640 115.135 -1.495 1
1 765 . 18 1 1 A 65 65 GLY H H 65 7.550 7.975 -0.425 1
1 766 . 18 1 1 A 65 65 GLY HA2 H 65 3.770 3.938 -0.168 1
1 767 . 18 1 1 A 65 65 GLY HA3 H 65 3.770 3.938 -0.168 1
1 768 . 18 1 1 A 65 65 GLY C C 65 178.980 175.012 3.968 1
1 769 . 18 1 1 A 65 65 GLY CA C 65 47.200 46.701 0.499 1
1 770 . 18 1 1 A 65 65 GLY N N 65 113.640 107.464 6.176 1
1 771 . 18 1 1 A 66 66 ASP H H 66 8.110 8.179 -0.069 1
1 772 . 18 1 1 A 66 66 ASP HA H 66 4.490 4.583 -0.093 1
1 775 . 18 1 1 A 66 66 ASP C C 66 177.960 177.649 0.311 1
1 776 . 18 1 1 A 66 66 ASP CA C 66 52.960 53.529 -0.569 1
1 777 . 18 1 1 A 66 66 ASP CB C 66 40.540 40.539 0.001 1
1 778 . 18 1 1 A 66 66 ASP N N 66 120.030 120.134 -0.104 1
1 779 . 18 1 1 A 67 67 GLY H H 67 10.260 9.131 1.129 1
1 780 . 18 1 1 A 67 67 GLY HA2 H 67 3.360 3.886 -0.526 1
1 781 . 18 1 1 A 67 67 GLY HA3 H 67 4.000 3.887 0.113 1
1 782 . 18 1 1 A 67 67 GLY C C 67 173.120 173.483 -0.363 1
1 783 . 18 1 1 A 67 67 GLY CA C 67 45.460 45.884 -0.424 1
1 784 . 18 1 1 A 67 67 GLY N N 67 114.100 110.845 3.255 1
1 785 . 18 1 1 A 68 68 GLU H H 68 7.750 7.810 -0.060 1
1 786 . 18 1 1 A 68 68 GLU HA H 68 4.780 4.955 -0.175 1
1 791 . 18 1 1 A 68 68 GLU C C 68 175.930 174.789 1.141 1
1 792 . 18 1 1 A 68 68 GLU CA C 68 54.430 54.481 -0.051 1
1 793 . 18 1 1 A 68 68 GLU CB C 68 35.850 33.668 2.182 1
1 795 . 18 1 1 A 68 68 GLU N N 68 118.000 119.483 -1.483 1
1 796 . 18 1 1 A 69 69 VAL H H 69 9.380 8.534 0.846 1
1 797 . 18 1 1 A 69 69 VAL HA H 69 5.260 5.085 0.175 1
1 805 . 18 1 1 A 69 69 VAL C C 69 176.710 175.033 1.677 1
1 806 . 18 1 1 A 69 69 VAL CA C 69 61.280 60.921 0.359 1
1 807 . 18 1 1 A 69 69 VAL CB C 69 33.980 35.054 -1.074 1
1 810 . 18 1 1 A 69 69 VAL N N 69 125.970 120.312 5.658 1
1 811 . 18 1 1 A 70 70 ASP H H 70 9.100 8.746 0.354 1
1 812 . 18 1 1 A 70 70 ASP HA H 70 5.190 4.894 0.296 1
1 815 . 18 1 1 A 70 70 ASP C C 70 175.700 175.664 0.036 1
1 816 . 18 1 1 A 70 70 ASP CA C 70 52.370 53.699 -1.329 1
1 817 . 18 1 1 A 70 70 ASP CB C 70 40.950 42.065 -1.115 1
1 818 . 18 1 1 A 70 70 ASP N N 70 130.320 122.624 7.696 1
1 819 . 18 1 1 A 71 71 PHE H H 71 9.090 7.631 1.459 1
1 820 . 18 1 1 A 71 71 PHE HA H 71 4.100 4.669 -0.569 1
1 823 . 18 1 1 A 71 71 PHE C C 71 177.000 175.671 1.329 1
1 824 . 18 1 1 A 71 71 PHE CA C 71 58.230 59.517 -1.287 1
1 825 . 18 1 1 A 71 71 PHE CB C 71 36.910 40.615 -3.705 1
1 826 . 18 1 1 A 71 71 PHE N N 71 119.760 116.741 3.019 1
1 827 . 18 1 1 A 72 72 GLN H H 72 8.440 8.424 0.016 1
1 828 . 18 1 1 A 72 72 GLN HA H 72 3.600 4.149 -0.549 1
1 831 . 18 1 1 A 72 72 GLN C C 72 178.820 177.485 1.335 1
1 832 . 18 1 1 A 72 72 GLN CA C 72 59.500 58.681 0.819 1
1 833 . 18 1 1 A 72 72 GLN CB C 72 29.553 28.611 0.942 1
1 835 . 18 1 1 A 72 72 GLN N N 72 121.820 118.873 2.947 1
1 836 . 18 1 1 A 73 73 GLU H H 73 8.290 8.017 0.273 1
1 837 . 18 1 1 A 73 73 GLU HA H 73 4.070 4.115 -0.045 1
1 842 . 18 1 1 A 73 73 GLU C C 73 179.370 178.843 0.527 1
1 843 . 18 1 1 A 73 73 GLU CA C 73 58.030 58.939 -0.909 1
1 844 . 18 1 1 A 73 73 GLU CB C 73 29.530 29.974 -0.444 1
1 846 . 18 1 1 A 73 73 GLU N N 73 120.550 119.033 1.517 1
1 847 . 18 1 1 A 74 74 PHE H H 74 8.630 8.310 0.320 1
1 848 . 18 1 1 A 74 74 PHE HA H 74 4.020 4.231 -0.211 1
1 851 . 18 1 1 A 74 74 PHE C C 74 177.890 176.996 0.894 1
1 852 . 18 1 1 A 74 74 PHE CA C 74 60.090 61.255 -1.165 1
1 853 . 18 1 1 A 74 74 PHE CB C 74 38.020 39.152 -1.132 1
1 854 . 18 1 1 A 74 74 PHE N N 74 121.010 121.559 -0.549 1
1 855 . 18 1 1 A 75 75 VAL H H 75 8.080 8.655 -0.575 1
1 856 . 18 1 1 A 75 75 VAL HA H 75 2.860 3.635 -0.775 1
1 864 . 18 1 1 A 75 75 VAL C C 75 177.030 178.355 -1.325 1
1 865 . 18 1 1 A 75 75 VAL CA C 75 66.430 66.497 -0.067 1
1 866 . 18 1 1 A 75 75 VAL CB C 75 30.600 31.803 -1.203 1
1 869 . 18 1 1 A 75 75 VAL N N 75 119.460 119.158 0.302 1
1 870 . 18 1 1 A 76 76 VAL H H 76 7.100 8.264 -1.164 1
1 871 . 18 1 1 A 76 76 VAL HA H 76 3.330 3.574 -0.244 1
1 879 . 18 1 1 A 76 76 VAL C C 76 178.670 178.421 0.249 1
1 880 . 18 1 1 A 76 76 VAL CA C 76 67.000 66.609 0.391 1
1 881 . 18 1 1 A 76 76 VAL CB C 76 31.280 31.628 -0.348 1
1 884 . 18 1 1 A 76 76 VAL N N 76 121.030 120.626 0.404 1
1 885 . 18 1 1 A 77 77 LEU H H 77 6.900 7.850 -0.950 1
1 886 . 18 1 1 A 77 77 LEU HA H 77 3.800 3.983 -0.183 1
1 896 . 18 1 1 A 77 77 LEU C C 77 177.960 178.411 -0.451 1
1 897 . 18 1 1 A 77 77 LEU CA C 77 57.710 58.057 -0.347 1
1 898 . 18 1 1 A 77 77 LEU CB C 77 40.070 41.754 -1.684 1
1 902 . 18 1 1 A 77 77 LEU N N 77 120.310 120.999 -0.689 1
1 903 . 18 1 1 A 78 78 VAL H H 78 7.240 7.349 -0.109 1
1 904 . 18 1 1 A 78 78 VAL HA H 78 3.030 3.727 -0.697 1
1 912 . 18 1 1 A 78 78 VAL C C 78 179.600 177.955 1.645 1
1 913 . 18 1 1 A 78 78 VAL CA C 78 66.420 64.958 1.462 1
1 914 . 18 1 1 A 78 78 VAL CB C 78 30.700 31.397 -0.697 1
1 917 . 18 1 1 A 78 78 VAL N N 78 117.180 116.520 0.660 1
1 918 . 18 1 1 A 79 79 ALA H H 79 9.000 8.309 0.691 1
1 919 . 18 1 1 A 79 79 ALA HA H 79 3.610 3.903 -0.293 1
1 923 . 18 1 1 A 79 79 ALA C C 79 182.260 179.997 2.263 1
1 924 . 18 1 1 A 79 79 ALA CA C 79 55.580 55.533 0.047 1
1 925 . 18 1 1 A 79 79 ALA CB C 79 18.400 17.761 0.639 1
1 926 . 18 1 1 A 79 79 ALA N N 79 126.000 124.437 1.563 1
1 927 . 18 1 1 A 80 80 ALA H H 80 8.000 7.635 0.365 1
1 928 . 18 1 1 A 80 80 ALA HA H 80 4.100 4.072 0.028 1
1 932 . 18 1 1 A 80 80 ALA C C 80 175.460 179.947 -4.487 1
1 933 . 18 1 1 A 80 80 ALA CA C 80 56.020 54.559 1.461 1
1 934 . 18 1 1 A 80 80 ALA CB C 80 18.040 18.332 -0.292 1
1 935 . 18 1 1 A 80 80 ALA N N 80 120.730 120.884 -0.154 1
1 936 . 18 1 1 A 81 81 LEU H H 81 8.460 7.683 0.777 1
1 937 . 18 1 1 A 81 81 LEU HA H 81 4.000 4.128 -0.128 1
1 941 . 18 1 1 A 81 81 LEU C C 81 177.030 179.101 -2.071 1
1 942 . 18 1 1 A 81 81 LEU CA C 81 57.640 57.671 -0.031 1
1 943 . 18 1 1 A 81 81 LEU CB C 81 40.620 42.024 -1.404 1
1 945 . 18 1 1 A 81 81 LEU N N 81 119.890 119.479 0.411 1
1 946 . 18 1 1 A 82 82 THR H H 82 8.320 7.927 0.393 1
1 947 . 18 1 1 A 82 82 THR HA H 82 3.800 4.018 -0.218 1
1 952 . 18 1 1 A 82 82 THR C C 82 181.010 176.883 4.127 1
1 953 . 18 1 1 A 82 82 THR CA C 82 68.500 66.223 2.277 1
1 954 . 18 1 1 A 82 82 THR CB C 82 67.400 68.781 -1.381 1
1 956 . 18 1 1 A 82 82 THR N N 82 117.120 113.154 3.966 1
1 957 . 18 1 1 A 83 83 VAL H H 83 8.530 7.468 1.062 1
1 958 . 18 1 1 A 83 83 VAL HA H 83 3.890 3.803 0.087 1
1 966 . 18 1 1 A 83 83 VAL C C 83 178.120 178.167 -0.047 1
1 967 . 18 1 1 A 83 83 VAL CA C 83 67.400 65.132 2.268 1
1 968 . 18 1 1 A 83 83 VAL CB C 83 31.590 31.516 0.074 1
1 971 . 18 1 1 A 83 83 VAL N N 83 119.760 117.891 1.869 1
1 972 . 18 1 1 A 84 84 ALA H H 84 7.910 8.598 -0.688 1
1 973 . 18 1 1 A 84 84 ALA HA H 84 4.060 4.131 -0.071 1
1 977 . 18 1 1 A 84 84 ALA C C 84 180.560 180.065 0.495 1
1 978 . 18 1 1 A 84 84 ALA CA C 84 55.000 55.167 -0.167 1
1 979 . 18 1 1 A 84 84 ALA CB C 84 17.230 18.210 -0.980 1
1 980 . 18 1 1 A 84 84 ALA N N 84 122.620 124.457 -1.837 1
1 981 . 18 1 1 A 85 85 CYS H H 85 8.580 8.100 0.480 1
1 982 . 18 1 1 A 85 85 CYS HA H 85 4.080 4.486 -0.406 1
1 985 . 18 1 1 A 85 85 CYS C C 85 179.060 176.879 2.181 1
1 986 . 18 1 1 A 85 85 CYS CA C 85 63.210 61.947 1.263 1
1 987 . 18 1 1 A 85 85 CYS CB C 85 26.310 27.656 -1.346 1
1 988 . 18 1 1 A 85 85 CYS N N 85 118.730 115.949 2.781 1
1 989 . 18 1 1 A 86 86 ASN H H 86 8.430 8.220 0.210 1
1 990 . 18 1 1 A 86 86 ASN CA C 86 55.860 56.818 -0.958 1
1 991 . 18 1 1 A 86 86 ASN CB C 86 37.440 39.949 -2.509 1
1 992 . 18 1 1 A 86 86 ASN N N 86 119.360 119.527 -0.167 1
1 993 . 18 1 1 A 87 87 ASN H H 87 7.880 7.972 -0.092 1
1 994 . 18 1 1 A 87 87 ASN HA H 87 4.600 4.242 0.358 1
1 997 . 18 1 1 A 87 87 ASN C C 87 178.510 177.010 1.500 1
1 998 . 18 1 1 A 87 87 ASN CA C 87 56.470 56.484 -0.014 1
1 999 . 18 1 1 A 87 87 ASN CB C 87 37.500 37.763 -0.263 1
1 1000 . 18 1 1 A 87 87 ASN N N 87 119.480 116.932 2.548 1
1 1001 . 18 1 1 A 88 88 PHE H H 88 8.050 7.381 0.669 1
1 1002 . 18 1 1 A 88 88 PHE HA H 88 4.200 4.737 -0.537 1
1 1005 . 18 1 1 A 88 88 PHE C C 88 178.510 176.958 1.552 1
1 1006 . 18 1 1 A 88 88 PHE CA C 88 56.460 58.687 -2.227 1
1 1007 . 18 1 1 A 88 88 PHE CB C 88 38.500 38.760 -0.260 1
1 1008 . 18 1 1 A 88 88 PHE N N 88 120.280 116.833 3.447 1
1 1009 . 18 1 1 A 89 89 PHE H H 89 8.020 8.306 -0.286 1
1 1010 . 18 1 1 A 89 89 PHE HA H 89 4.000 4.329 -0.329 1
1 1013 . 18 1 1 A 89 89 PHE C C 89 177.340 177.704 -0.364 1
1 1014 . 18 1 1 A 89 89 PHE CA C 89 59.000 59.920 -0.920 1
1 1015 . 18 1 1 A 89 89 PHE CB C 89 37.430 39.914 -2.484 1
1 1016 . 18 1 1 A 89 89 PHE N N 89 120.910 120.379 0.531 1
1 1017 . 18 1 1 A 90 90 TRP H H 90 7.800 8.760 -0.960 1
1 1018 . 18 1 1 A 90 90 TRP HA H 90 4.460 4.560 -0.100 1
1 1021 . 18 1 1 A 90 90 TRP C C 90 177.340 178.735 -1.395 1
1 1022 . 18 1 1 A 90 90 TRP CA C 90 57.930 59.655 -1.725 1
1 1023 . 18 1 1 A 90 90 TRP CB C 90 42.000 27.540 14.460 1
1 1024 . 18 1 1 A 90 90 TRP N N 90 120.050 119.083 0.967 1
1 1025 . 18 1 1 A 91 91 GLU H H 91 7.800 8.635 -0.835 1
1 1026 . 18 1 1 A 91 91 GLU HA H 91 4.050 3.217 0.833 1
1 1031 . 18 1 1 A 91 91 GLU C C 91 177.570 177.814 -0.244 1
1 1032 . 18 1 1 A 91 91 GLU CA C 91 57.350 59.630 -2.280 1
1 1033 . 18 1 1 A 91 91 GLU CB C 91 29.530 28.834 0.696 1
1 1035 . 18 1 1 A 91 91 GLU N N 91 120.730 121.371 -0.641 1
1 1036 . 18 1 1 A 92 92 ASN H H 92 7.800 7.032 0.768 1
1 1037 . 18 1 1 A 92 92 ASN HA H 92 4.630 4.639 -0.009 1
1 1040 . 18 1 1 A 92 92 ASN C C 92 174.450 174.894 -0.444 1
1 1041 . 18 1 1 A 92 92 ASN CA C 92 52.960 52.554 0.406 1
1 1042 . 18 1 1 A 92 92 ASN CB C 92 29.530 38.671 -9.141 1
1 1043 . 18 1 1 A 92 92 ASN N N 92 119.410 116.059 3.351 1
1 5 . 19 1 1 A 2 2 SER H H 2 9.000 8.774 0.226 1
1 6 . 19 1 1 A 2 2 SER HA H 2 4.690 4.751 -0.061 1
1 9 . 19 1 1 A 2 2 SER C C 2 176.170 174.705 1.465 1
1 10 . 19 1 1 A 2 2 SER CA C 2 57.340 58.197 -0.857 1
1 11 . 19 1 1 A 2 2 SER CB C 2 65.550 63.035 2.515 1
1 12 . 19 1 1 A 2 2 SER N N 2 119.330 115.980 3.350 1
1 13 . 19 1 1 A 3 3 GLU H H 3 9.350 8.125 1.225 1
1 14 . 19 1 1 A 3 3 GLU HA H 3 4.060 4.062 -0.002 1
1 17 . 19 1 1 A 3 3 GLU C C 3 180.150 179.019 1.131 1
1 18 . 19 1 1 A 3 3 GLU CA C 3 60.280 59.026 1.254 1
1 19 . 19 1 1 A 3 3 GLU CB C 3 29.230 29.255 -0.025 1
1 21 . 19 1 1 A 3 3 GLU N N 3 125.350 122.168 3.182 1
1 22 . 19 1 1 A 4 4 LEU H H 4 9.060 8.086 0.974 1
1 23 . 19 1 1 A 4 4 LEU HA H 4 4.080 4.083 -0.003 1
1 33 . 19 1 1 A 4 4 LEU C C 4 177.890 178.453 -0.563 1
1 34 . 19 1 1 A 4 4 LEU CA C 4 58.090 57.797 0.293 1
1 35 . 19 1 1 A 4 4 LEU CB C 4 42.120 41.750 0.370 1
1 39 . 19 1 1 A 4 4 LEU N N 4 121.090 121.128 -0.038 1
1 40 . 19 1 1 A 5 5 GLU H H 5 8.340 8.318 0.022 1
1 41 . 19 1 1 A 5 5 GLU HA H 5 4.050 3.914 0.136 1
1 46 . 19 1 1 A 5 5 GLU C C 5 177.030 179.101 -2.071 1
1 47 . 19 1 1 A 5 5 GLU CA C 5 59.840 59.559 0.281 1
1 48 . 19 1 1 A 5 5 GLU CB C 5 28.940 29.275 -0.335 1
1 50 . 19 1 1 A 5 5 GLU N N 5 119.780 118.572 1.208 1
1 51 . 19 1 1 A 6 6 THR H H 6 8.370 7.749 0.621 1
1 52 . 19 1 1 A 6 6 THR HA H 6 4.310 3.886 0.424 1
1 57 . 19 1 1 A 6 6 THR C C 6 177.340 176.963 0.377 1
1 58 . 19 1 1 A 6 6 THR CA C 6 66.630 66.122 0.508 1
1 59 . 19 1 1 A 6 6 THR CB C 6 68.650 68.747 -0.097 1
1 61 . 19 1 1 A 6 6 THR N N 6 116.940 116.868 0.072 1
1 62 . 19 1 1 A 7 7 ALA H H 7 8.270 7.752 0.518 1
1 63 . 19 1 1 A 7 7 ALA HA H 7 4.190 4.215 -0.025 1
1 67 . 19 1 1 A 7 7 ALA C C 7 179.760 179.617 0.143 1
1 68 . 19 1 1 A 7 7 ALA CA C 7 55.880 55.170 0.710 1
1 69 . 19 1 1 A 7 7 ALA CB C 7 17.720 18.140 -0.420 1
1 70 . 19 1 1 A 7 7 ALA N N 7 127.400 124.051 3.349 1
1 71 . 19 1 1 A 8 8 MET H H 8 8.110 7.734 0.376 1
1 72 . 19 1 1 A 8 8 MET HA H 8 4.020 4.196 -0.176 1
1 80 . 19 1 1 A 8 8 MET C C 8 178.510 178.012 0.498 1
1 81 . 19 1 1 A 8 8 MET CA C 8 60.580 58.217 2.363 1
1 82 . 19 1 1 A 8 8 MET CB C 8 33.630 32.147 1.483 1
1 85 . 19 1 1 A 8 8 MET N N 8 117.520 118.474 -0.954 1
1 86 . 19 1 1 A 9 9 GLU H H 9 8.210 7.886 0.324 1
1 87 . 19 1 1 A 9 9 GLU HA H 9 3.830 4.084 -0.254 1
1 92 . 19 1 1 A 9 9 GLU C C 9 179.140 178.065 1.075 1
1 93 . 19 1 1 A 9 9 GLU CA C 9 59.690 59.026 0.664 1
1 94 . 19 1 1 A 9 9 GLU CB C 9 29.530 28.541 0.989 1
1 96 . 19 1 1 A 9 9 GLU N N 9 118.560 117.666 0.894 1
1 97 . 19 1 1 A 10 10 THR H H 10 8.490 7.748 0.742 1
1 98 . 19 1 1 A 10 10 THR HA H 10 4.000 4.003 -0.003 1
1 103 . 19 1 1 A 10 10 THR C C 10 176.010 176.785 -0.775 1
1 104 . 19 1 1 A 10 10 THR CA C 10 67.110 66.632 0.478 1
1 105 . 19 1 1 A 10 10 THR CB C 10 67.770 68.394 -0.624 1
1 107 . 19 1 1 A 10 10 THR N N 10 118.310 116.370 1.940 1
1 108 . 19 1 1 A 11 11 LEU H H 11 7.920 7.852 0.068 1
1 109 . 19 1 1 A 11 11 LEU HA H 11 3.930 4.047 -0.117 1
1 119 . 19 1 1 A 11 11 LEU C C 11 178.820 178.898 -0.078 1
1 120 . 19 1 1 A 11 11 LEU CA C 11 59.690 58.254 1.436 1
1 121 . 19 1 1 A 11 11 LEU CB C 11 41.920 41.751 0.169 1
1 125 . 19 1 1 A 11 11 LEU N N 11 121.150 120.917 0.233 1
1 126 . 19 1 1 A 12 12 ILE H H 12 7.440 7.756 -0.316 1
1 127 . 19 1 1 A 12 12 ILE HA H 12 3.640 4.021 -0.381 1
1 137 . 19 1 1 A 12 12 ILE C C 12 179.530 178.940 0.590 1
1 138 . 19 1 1 A 12 12 ILE CA C 12 63.740 64.698 -0.958 1
1 139 . 19 1 1 A 12 12 ILE CB C 12 38.800 37.125 1.675 1
1 143 . 19 1 1 A 12 12 ILE N N 12 118.010 120.277 -2.267 1
1 144 . 19 1 1 A 13 13 ASN H H 13 8.930 8.640 0.290 1
1 145 . 19 1 1 A 13 13 ASN HA H 13 4.520 4.586 -0.066 1
1 148 . 19 1 1 A 13 13 ASN C C 13 179.450 177.436 2.014 1
1 149 . 19 1 1 A 13 13 ASN CA C 13 56.470 56.474 -0.004 1
1 150 . 19 1 1 A 13 13 ASN CB C 13 37.930 38.704 -0.774 1
1 151 . 19 1 1 A 13 13 ASN N N 13 121.820 120.937 0.883 1
1 152 . 19 1 1 A 14 14 VAL H H 14 9.180 7.934 1.246 1
1 153 . 19 1 1 A 14 14 VAL HA H 14 3.830 3.873 -0.043 1
1 161 . 19 1 1 A 14 14 VAL CA C 14 65.840 65.516 0.324 1
1 162 . 19 1 1 A 14 14 VAL CB C 14 31.290 31.685 -0.395 1
1 165 . 19 1 1 A 14 14 VAL N N 14 122.040 117.850 4.190 1
1 166 . 19 1 1 A 15 15 PHE H H 15 7.590 8.205 -0.615 1
1 167 . 19 1 1 A 15 15 PHE HA H 15 3.360 3.946 -0.586 1
1 170 . 19 1 1 A 15 15 PHE C C 15 177.890 177.291 0.599 1
1 171 . 19 1 1 A 15 15 PHE CA C 15 62.030 62.167 -0.137 1
1 172 . 19 1 1 A 15 15 PHE CB C 15 38.900 38.827 0.073 1
1 173 . 19 1 1 A 15 15 PHE N N 15 118.290 123.660 -5.370 1
1 174 . 19 1 1 A 16 16 HIS H H 16 7.790 7.894 -0.104 1
1 175 . 19 1 1 A 16 16 HIS HA H 16 4.890 4.342 0.548 1
1 178 . 19 1 1 A 16 16 HIS C C 16 177.810 177.117 0.693 1
1 179 . 19 1 1 A 16 16 HIS CA C 16 59.100 60.105 -1.005 1
1 180 . 19 1 1 A 16 16 HIS CB C 16 28.060 29.303 -1.243 1
1 181 . 19 1 1 A 16 16 HIS N N 16 118.290 118.409 -0.119 1
1 182 . 19 1 1 A 17 17 ALA H H 17 8.040 7.900 0.140 1
1 183 . 19 1 1 A 17 17 ALA HA H 17 4.050 3.905 0.145 1
1 187 . 19 1 1 A 17 17 ALA C C 17 179.600 179.642 -0.042 1
1 188 . 19 1 1 A 17 17 ALA CA C 17 54.000 55.177 -1.177 1
1 189 . 19 1 1 A 17 17 ALA CB C 17 17.520 18.434 -0.914 1
1 190 . 19 1 1 A 17 17 ALA N N 17 124.410 120.883 3.527 1
1 191 . 19 1 1 A 18 18 HIS H H 18 7.000 7.412 -0.412 1
1 192 . 19 1 1 A 18 18 HIS HA H 18 4.330 4.326 0.004 1
1 195 . 19 1 1 A 18 18 HIS C C 18 176.320 177.409 -1.089 1
1 196 . 19 1 1 A 18 18 HIS CA C 18 57.350 59.078 -1.728 1
1 197 . 19 1 1 A 18 18 HIS CB C 18 32.920 30.238 2.682 1
1 198 . 19 1 1 A 18 18 HIS N N 18 115.160 115.897 -0.737 1
1 199 . 19 1 1 A 19 19 SER H H 19 8.380 7.818 0.562 1
1 200 . 19 1 1 A 19 19 SER HA H 19 3.640 3.844 -0.204 1
1 203 . 19 1 1 A 19 19 SER C C 19 177.340 175.632 1.708 1
1 204 . 19 1 1 A 19 19 SER CA C 19 60.160 62.566 -2.406 1
1 205 . 19 1 1 A 19 19 SER CB C 19 61.000 61.886 -0.886 1
1 206 . 19 1 1 A 19 19 SER N N 19 114.380 115.205 -0.825 1
1 207 . 19 1 1 A 20 20 GLY H H 20 7.600 7.385 0.215 1
1 208 . 19 1 1 A 20 20 GLY HA2 H 20 3.680 3.666 0.014 1
1 209 . 19 1 1 A 20 20 GLY HA3 H 20 4.000 3.711 0.289 1
1 210 . 19 1 1 A 20 20 GLY C C 20 174.140 173.871 0.269 1
1 211 . 19 1 1 A 20 20 GLY CA C 20 47.000 44.971 2.029 1
1 212 . 19 1 1 A 20 20 GLY N N 20 112.550 107.845 4.705 1
1 213 . 19 1 1 A 21 21 LYS H H 21 7.230 7.870 -0.640 1
1 214 . 19 1 1 A 21 21 LYS HA H 21 3.860 4.389 -0.529 1
1 223 . 19 1 1 A 21 21 LYS C C 21 177.730 177.354 0.376 1
1 224 . 19 1 1 A 21 21 LYS CA C 21 59.110 56.944 2.166 1
1 225 . 19 1 1 A 21 21 LYS CB C 21 32.460 34.535 -2.075 1
1 229 . 19 1 1 A 21 21 LYS N N 21 123.240 118.031 5.209 1
1 230 . 19 1 1 A 22 22 GLU H H 22 9.350 8.344 1.006 1
1 231 . 19 1 1 A 22 22 GLU HA H 22 4.610 4.279 0.331 1
1 236 . 19 1 1 A 22 22 GLU C C 22 177.420 175.899 1.521 1
1 237 . 19 1 1 A 22 22 GLU CA C 22 53.700 56.856 -3.156 1
1 238 . 19 1 1 A 22 22 GLU CB C 22 32.000 29.637 2.363 1
1 240 . 19 1 1 A 22 22 GLU N N 22 116.770 117.417 -0.647 1
1 241 . 19 1 1 A 23 23 GLY H H 23 7.570 7.366 0.204 1
1 242 . 19 1 1 A 23 23 GLY HA2 H 23 3.630 3.918 -0.288 1
1 243 . 19 1 1 A 23 23 GLY HA3 H 23 3.880 3.943 -0.063 1
1 244 . 19 1 1 A 23 23 GLY C C 23 173.980 171.652 2.328 1
1 245 . 19 1 1 A 23 23 GLY CA C 23 45.250 45.438 -0.188 1
1 246 . 19 1 1 A 23 23 GLY N N 23 112.180 107.025 5.155 1
1 247 . 19 1 1 A 24 24 ASP H H 24 8.680 8.520 0.160 1
1 248 . 19 1 1 A 24 24 ASP HA H 24 4.380 4.512 -0.132 1
1 251 . 19 1 1 A 24 24 ASP C C 24 178.590 177.447 1.143 1
1 252 . 19 1 1 A 24 24 ASP CA C 24 60.000 54.694 5.306 1
1 253 . 19 1 1 A 24 24 ASP CB C 24 27.480 41.681 -14.201 1
1 254 . 19 1 1 A 24 24 ASP N N 24 127.470 120.735 6.735 1
1 255 . 19 1 1 A 25 25 LYS H H 25 9.270 8.659 0.611 1
1 256 . 19 1 1 A 25 25 LYS HA H 25 4.250 3.604 0.646 1
1 265 . 19 1 1 A 25 25 LYS C C 25 177.030 176.427 0.603 1
1 266 . 19 1 1 A 25 25 LYS CA C 25 60.000 59.264 0.736 1
1 267 . 19 1 1 A 25 25 LYS CB C 25 31.170 32.219 -1.049 1
1 271 . 19 1 1 A 25 25 LYS N N 25 132.960 122.027 10.933 1
1 272 . 19 1 1 A 26 26 TYR H H 26 9.430 7.750 1.680 1
1 273 . 19 1 1 A 26 26 TYR HA H 26 4.640 4.745 -0.105 1
1 276 . 19 1 1 A 26 26 TYR C C 26 174.290 174.420 -0.130 1
1 277 . 19 1 1 A 26 26 TYR CA C 26 56.010 57.412 -1.402 1
1 278 . 19 1 1 A 26 26 TYR CB C 26 37.730 38.325 -0.595 1
1 279 . 19 1 1 A 26 26 TYR N N 26 120.650 114.029 6.621 1
1 280 . 19 1 1 A 27 27 LYS H H 27 7.110 7.285 -0.175 1
1 281 . 19 1 1 A 27 27 LYS HA H 27 5.110 5.132 -0.022 1
1 290 . 19 1 1 A 27 27 LYS C C 27 175.150 173.966 1.184 1
1 291 . 19 1 1 A 27 27 LYS CA C 27 55.070 55.047 0.023 1
1 292 . 19 1 1 A 27 27 LYS CB C 27 38.900 36.373 2.527 1
1 296 . 19 1 1 A 27 27 LYS N N 27 115.830 121.200 -5.370 1
1 297 . 19 1 1 A 28 28 LEU H H 28 9.820 8.541 1.279 1
1 298 . 19 1 1 A 28 28 LEU HA H 28 5.080 4.754 0.326 1
1 308 . 19 1 1 A 28 28 LEU C C 28 176.640 176.003 0.637 1
1 309 . 19 1 1 A 28 28 LEU CA C 28 52.660 53.723 -1.063 1
1 310 . 19 1 1 A 28 28 LEU CB C 28 42.710 43.648 -0.938 1
1 314 . 19 1 1 A 28 28 LEU N N 28 126.930 128.727 -1.797 1
1 315 . 19 1 1 A 29 29 SER H H 29 9.890 8.776 1.114 1
1 316 . 19 1 1 A 29 29 SER HA H 29 4.530 4.646 -0.116 1
1 319 . 19 1 1 A 29 29 SER C C 29 174.990 175.327 -0.337 1
1 320 . 19 1 1 A 29 29 SER CA C 29 56.180 57.437 -1.257 1
1 321 . 19 1 1 A 29 29 SER CB C 29 65.550 65.225 0.325 1
1 322 . 19 1 1 A 29 29 SER N N 29 121.600 118.947 2.653 1
1 323 . 19 1 1 A 30 30 LYS H H 30 8.850 8.897 -0.047 1
1 324 . 19 1 1 A 30 30 LYS HA H 30 3.850 4.005 -0.155 1
1 333 . 19 1 1 A 30 30 LYS C C 30 175.620 177.615 -1.995 1
1 334 . 19 1 1 A 30 30 LYS CA C 30 60.860 59.965 0.895 1
1 335 . 19 1 1 A 30 30 LYS CB C 30 31.290 32.165 -0.875 1
1 339 . 19 1 1 A 30 30 LYS N N 30 121.260 122.251 -0.991 1
1 340 . 19 1 1 A 31 31 LYS H H 31 7.970 7.965 0.005 1
1 341 . 19 1 1 A 31 31 LYS HA H 31 3.880 3.975 -0.095 1
1 350 . 19 1 1 A 31 31 LYS C C 31 179.290 179.014 0.276 1
1 351 . 19 1 1 A 31 31 LYS CA C 31 59.110 59.291 -0.181 1
1 352 . 19 1 1 A 31 31 LYS CB C 31 32.640 31.895 0.745 1
1 356 . 19 1 1 A 31 31 LYS N N 31 121.260 118.611 2.649 1
1 357 . 19 1 1 A 32 32 GLU H H 32 7.510 8.343 -0.833 1
1 358 . 19 1 1 A 32 32 GLU HA H 32 3.830 3.944 -0.114 1
1 363 . 19 1 1 A 32 32 GLU C C 32 179.290 179.221 0.069 1
1 364 . 19 1 1 A 32 32 GLU CA C 32 58.590 58.933 -0.343 1
1 365 . 19 1 1 A 32 32 GLU CB C 32 30.120 29.303 0.817 1
1 367 . 19 1 1 A 32 32 GLU N N 32 120.090 119.754 0.336 1
1 368 . 19 1 1 A 33 33 LEU H H 33 8.970 8.440 0.530 1
1 369 . 19 1 1 A 33 33 LEU HA H 33 3.830 4.008 -0.178 1
1 379 . 19 1 1 A 33 33 LEU C C 33 178.200 179.303 -1.103 1
1 380 . 19 1 1 A 33 33 LEU CA C 33 57.930 57.870 0.060 1
1 381 . 19 1 1 A 33 33 LEU CB C 33 40.660 41.482 -0.822 1
1 385 . 19 1 1 A 33 33 LEU N N 33 120.200 120.580 -0.380 1
1 386 . 19 1 1 A 34 34 LYS H H 34 8.230 8.011 0.219 1
1 387 . 19 1 1 A 34 34 LYS HA H 34 3.550 3.833 -0.283 1
1 396 . 19 1 1 A 34 34 LYS C C 34 178.040 179.286 -1.246 1
1 397 . 19 1 1 A 34 34 LYS CA C 34 60.720 60.411 0.309 1
1 398 . 19 1 1 A 34 34 LYS CB C 34 31.980 32.480 -0.500 1
1 402 . 19 1 1 A 34 34 LYS N N 34 120.780 116.974 3.806 1
1 403 . 19 1 1 A 35 35 ASP H H 35 7.990 7.754 0.236 1
1 404 . 19 1 1 A 35 35 ASP HA H 35 4.250 4.335 -0.085 1
1 407 . 19 1 1 A 35 35 ASP C C 35 179.060 178.703 0.357 1
1 408 . 19 1 1 A 35 35 ASP CA C 35 56.830 56.769 0.061 1
1 409 . 19 1 1 A 35 35 ASP CB C 35 40.440 40.207 0.233 1
1 410 . 19 1 1 A 35 35 ASP N N 35 119.550 119.917 -0.367 1
1 411 . 19 1 1 A 36 36 LEU H H 36 8.130 7.738 0.392 1
1 412 . 19 1 1 A 36 36 LEU HA H 36 2.580 3.940 -1.360 1
1 422 . 19 1 1 A 36 36 LEU C C 36 179.450 179.519 -0.069 1
1 423 . 19 1 1 A 36 36 LEU CA C 36 59.980 57.926 2.054 1
1 424 . 19 1 1 A 36 36 LEU CB C 36 42.180 41.839 0.341 1
1 428 . 19 1 1 A 36 36 LEU N N 36 125.560 120.663 4.897 1
1 429 . 19 1 1 A 37 37 LEU H H 37 8.740 8.216 0.524 1
1 430 . 19 1 1 A 37 37 LEU HA H 37 3.580 4.002 -0.422 1
1 440 . 19 1 1 A 37 37 LEU C C 37 179.290 179.166 0.124 1
1 441 . 19 1 1 A 37 37 LEU CA C 37 58.230 58.185 0.045 1
1 442 . 19 1 1 A 37 37 LEU CB C 37 41.590 40.867 0.723 1
1 446 . 19 1 1 A 37 37 LEU N N 37 120.520 117.527 2.993 1
1 447 . 19 1 1 A 38 38 GLN H H 38 8.520 8.003 0.517 1
1 448 . 19 1 1 A 38 38 GLN HA H 38 4.000 3.993 0.007 1
1 453 . 19 1 1 A 38 38 GLN C C 38 177.960 178.512 -0.552 1
1 454 . 19 1 1 A 38 38 GLN CA C 38 58.210 58.990 -0.780 1
1 455 . 19 1 1 A 38 38 GLN CB C 38 28.650 28.227 0.423 1
1 457 . 19 1 1 A 38 38 GLN N N 38 116.740 118.513 -1.773 1
1 458 . 19 1 1 A 39 39 THR H H 39 7.910 7.847 0.063 1
1 459 . 19 1 1 A 39 39 THR HA H 39 4.210 3.778 0.432 1
1 464 . 19 1 1 A 39 39 THR C C 39 177.180 175.777 1.403 1
1 465 . 19 1 1 A 39 39 THR CA C 39 64.730 67.186 -2.456 1
1 466 . 19 1 1 A 39 39 THR CB C 39 69.650 68.692 0.958 1
1 468 . 19 1 1 A 39 39 THR N N 39 111.400 117.511 -6.111 1
1 469 . 19 1 1 A 40 40 GLU H H 40 8.590 7.923 0.667 1
1 470 . 19 1 1 A 40 40 GLU HA H 40 4.680 4.463 0.217 1
1 475 . 19 1 1 A 40 40 GLU C C 40 178.280 177.119 1.161 1
1 476 . 19 1 1 A 40 40 GLU CA C 40 55.880 56.697 -0.817 1
1 477 . 19 1 1 A 40 40 GLU CB C 40 30.990 30.579 0.411 1
1 479 . 19 1 1 A 40 40 GLU N N 40 117.840 116.722 1.118 1
1 480 . 19 1 1 A 41 41 LEU H H 41 7.680 7.600 0.080 1
1 481 . 19 1 1 A 41 41 LEU HA H 41 5.080 4.789 0.291 1
1 491 . 19 1 1 A 41 41 LEU C C 41 179.450 177.372 2.078 1
1 492 . 19 1 1 A 41 41 LEU CA C 41 53.830 53.525 0.305 1
1 493 . 19 1 1 A 41 41 LEU CB C 41 41.360 42.614 -1.254 1
1 497 . 19 1 1 A 41 41 LEU N N 41 121.410 119.708 1.702 1
1 498 . 19 1 1 A 42 42 SER H H 42 8.380 8.000 0.380 1
1 499 . 19 1 1 A 42 42 SER HA H 42 4.130 4.101 0.029 1
1 502 . 19 1 1 A 42 42 SER C C 42 176.640 177.515 -0.875 1
1 503 . 19 1 1 A 42 42 SER CA C 42 61.280 61.642 -0.362 1
1 504 . 19 1 1 A 42 42 SER CB C 42 63.040 62.994 0.046 1
1 505 . 19 1 1 A 42 42 SER N N 42 117.420 117.756 -0.336 1
1 506 . 19 1 1 A 43 43 SER H H 43 8.900 8.141 0.759 1
1 507 . 19 1 1 A 43 43 SER HA H 43 4.290 4.200 0.090 1
1 510 . 19 1 1 A 43 43 SER C C 43 175.620 176.840 -1.220 1
1 511 . 19 1 1 A 43 43 SER CA C 43 60.860 62.285 -1.425 1
1 512 . 19 1 1 A 43 43 SER CB C 43 62.910 63.515 -0.605 1
1 513 . 19 1 1 A 43 43 SER N N 43 117.580 117.015 0.565 1
1 514 . 19 1 1 A 44 44 PHE H H 44 7.880 8.006 -0.126 1
1 515 . 19 1 1 A 44 44 PHE HA H 44 4.240 4.198 0.042 1
1 518 . 19 1 1 A 44 44 PHE C C 44 176.950 175.708 1.242 1
1 519 . 19 1 1 A 44 44 PHE CA C 44 62.710 61.174 1.536 1
1 520 . 19 1 1 A 44 44 PHE CB C 44 39.020 39.127 -0.107 1
1 521 . 19 1 1 A 44 44 PHE N N 44 119.480 121.739 -2.259 1
1 522 . 19 1 1 A 45 45 LEU H H 45 8.060 8.039 0.021 1
1 523 . 19 1 1 A 45 45 LEU HA H 45 3.810 3.853 -0.043 1
1 533 . 19 1 1 A 45 45 LEU C C 45 177.500 176.324 1.176 1
1 534 . 19 1 1 A 45 45 LEU CA C 45 59.980 55.703 4.277 1
1 535 . 19 1 1 A 45 45 LEU CB C 45 39.640 42.310 -2.670 1
1 538 . 19 1 1 A 45 45 LEU N N 45 118.010 121.816 -3.806 1
1 539 . 19 1 1 A 46 46 ASP H H 46 8.150 8.523 -0.373 1
1 540 . 19 1 1 A 46 46 ASP HA H 46 4.470 4.603 -0.133 1
1 543 . 19 1 1 A 46 46 ASP C C 46 179.920 176.139 3.781 1
1 544 . 19 1 1 A 46 46 ASP CA C 46 52.950 53.347 -0.397 1
1 545 . 19 1 1 A 46 46 ASP CB C 46 40.000 40.653 -0.653 1
1 546 . 19 1 1 A 46 46 ASP N N 46 119.460 125.720 -6.260 1
1 547 . 19 1 1 A 47 47 VAL H H 47 8.010 8.456 -0.446 1
1 548 . 19 1 1 A 47 47 VAL HA H 47 3.800 4.386 -0.586 1
1 556 . 19 1 1 A 47 47 VAL C C 47 175.460 176.992 -1.532 1
1 557 . 19 1 1 A 47 47 VAL CA C 47 60.000 62.396 -2.396 1
1 558 . 19 1 1 A 47 47 VAL CB C 47 31.580 33.809 -2.229 1
1 561 . 19 1 1 A 47 47 VAL N N 47 117.720 120.175 -2.455 1
1 562 . 19 1 1 A 48 48 GLN H H 48 7.960 7.953 0.007 1
1 563 . 19 1 1 A 48 48 GLN HA H 48 4.060 4.144 -0.084 1
1 568 . 19 1 1 A 48 48 GLN C C 48 179.370 178.400 0.970 1
1 569 . 19 1 1 A 48 48 GLN CA C 48 57.350 58.321 -0.971 1
1 570 . 19 1 1 A 48 48 GLN CB C 48 28.990 28.687 0.303 1
1 572 . 19 1 1 A 48 48 GLN N N 48 119.900 121.673 -1.773 1
1 573 . 19 1 1 A 49 49 LYS H H 49 7.810 7.934 -0.124 1
1 574 . 19 1 1 A 49 49 LYS HA H 49 3.860 4.156 -0.296 1
1 583 . 19 1 1 A 49 49 LYS C C 49 177.890 176.894 0.996 1
1 584 . 19 1 1 A 49 49 LYS CA C 49 58.230 58.566 -0.336 1
1 585 . 19 1 1 A 49 49 LYS CB C 49 30.990 32.391 -1.401 1
1 587 . 19 1 1 A 49 49 LYS N N 49 120.030 119.097 0.933 1
1 588 . 19 1 1 A 50 50 ASP H H 50 7.570 7.769 -0.199 1
1 589 . 19 1 1 A 50 50 ASP HA H 50 4.700 4.884 -0.184 1
1 590 . 19 1 1 A 50 50 ASP CA C 50 52.950 52.762 0.188 1
1 591 . 19 1 1 A 50 50 ASP CB C 50 38.900 40.882 -1.982 1
1 592 . 19 1 1 A 50 50 ASP N N 50 116.730 115.754 0.976 1
1 593 . 19 1 1 A 51 51 ALA H H 51 7.570 8.779 -1.209 1
1 594 . 19 1 1 A 51 51 ALA HA H 51 4.200 3.936 0.264 1
1 598 . 19 1 1 A 51 51 ALA C C 51 179.760 179.344 0.416 1
1 599 . 19 1 1 A 51 51 ALA CA C 51 54.200 55.187 -0.987 1
1 600 . 19 1 1 A 51 51 ALA CB C 51 18.110 18.480 -0.370 1
1 601 . 19 1 1 A 51 51 ALA N N 51 118.390 127.009 -8.619 1
1 602 . 19 1 1 A 52 52 ASP H H 52 8.430 8.279 0.151 1
1 603 . 19 1 1 A 52 52 ASP HA H 52 4.600 4.357 0.243 1
1 606 . 19 1 1 A 52 52 ASP C C 52 177.570 178.378 -0.808 1
1 607 . 19 1 1 A 52 52 ASP CA C 52 54.420 56.759 -2.339 1
1 608 . 19 1 1 A 52 52 ASP CB C 52 40.360 40.139 0.221 1
1 609 . 19 1 1 A 52 52 ASP N N 52 117.530 118.839 -1.309 1
1 610 . 19 1 1 A 53 53 ALA H H 53 7.660 8.361 -0.701 1
1 611 . 19 1 1 A 53 53 ALA HA H 53 3.860 3.995 -0.135 1
1 615 . 19 1 1 A 53 53 ALA C C 53 180.070 179.875 0.195 1
1 616 . 19 1 1 A 53 53 ALA CA C 53 55.590 55.371 0.219 1
1 617 . 19 1 1 A 53 53 ALA CB C 53 18.800 18.020 0.780 1
1 618 . 19 1 1 A 53 53 ALA N N 53 123.450 122.652 0.798 1
1 619 . 19 1 1 A 54 54 VAL H H 54 8.030 7.820 0.210 1
1 620 . 19 1 1 A 54 54 VAL HA H 54 3.240 3.575 -0.335 1
1 628 . 19 1 1 A 54 54 VAL C C 54 177.340 177.752 -0.412 1
1 629 . 19 1 1 A 54 54 VAL CA C 54 66.620 66.547 0.073 1
1 630 . 19 1 1 A 54 54 VAL CB C 54 30.480 31.259 -0.779 1
1 633 . 19 1 1 A 54 54 VAL N N 54 116.150 118.785 -2.635 1
1 634 . 19 1 1 A 55 55 ASP H H 55 7.660 8.001 -0.341 1
1 635 . 19 1 1 A 55 55 ASP HA H 55 4.080 4.309 -0.229 1
1 638 . 19 1 1 A 55 55 ASP C C 55 177.260 178.714 -1.454 1
1 639 . 19 1 1 A 55 55 ASP CA C 55 57.640 57.755 -0.115 1
1 640 . 19 1 1 A 55 55 ASP CB C 55 40.360 41.055 -0.695 1
1 641 . 19 1 1 A 55 55 ASP N N 55 120.830 121.184 -0.354 1
1 642 . 19 1 1 A 56 56 LYS H H 56 7.780 7.593 0.187 1
1 643 . 19 1 1 A 56 56 LYS HA H 56 3.860 4.016 -0.156 1
1 652 . 19 1 1 A 56 56 LYS C C 56 179.530 179.525 0.005 1
1 653 . 19 1 1 A 56 56 LYS CA C 56 59.690 59.658 0.032 1
1 654 . 19 1 1 A 56 56 LYS CB C 56 31.870 32.493 -0.623 1
1 658 . 19 1 1 A 56 56 LYS N N 56 120.010 118.429 1.581 1
1 659 . 19 1 1 A 57 57 ILE H H 57 8.090 7.982 0.108 1
1 660 . 19 1 1 A 57 57 ILE HA H 57 3.390 3.565 -0.175 1
1 670 . 19 1 1 A 57 57 ILE C C 57 176.710 177.477 -0.767 1
1 671 . 19 1 1 A 57 57 ILE CA C 57 64.960 65.281 -0.321 1
1 672 . 19 1 1 A 57 57 ILE CB C 57 38.080 38.252 -0.172 1
1 676 . 19 1 1 A 57 57 ILE N N 57 120.960 120.503 0.457 1
1 677 . 19 1 1 A 58 58 MET H H 58 8.480 8.324 0.156 1
1 678 . 19 1 1 A 58 58 MET HA H 58 3.800 4.134 -0.334 1
1 686 . 19 1 1 A 58 58 MET C C 58 177.570 178.190 -0.620 1
1 687 . 19 1 1 A 58 58 MET CA C 58 58.570 58.416 0.154 1
1 688 . 19 1 1 A 58 58 MET CB C 58 32.570 31.868 0.702 1
1 691 . 19 1 1 A 58 58 MET N N 58 119.160 120.746 -1.586 1
1 692 . 19 1 1 A 59 59 LYS H H 59 7.550 7.936 -0.386 1
1 693 . 19 1 1 A 59 59 LYS HA H 59 3.930 3.935 -0.005 1
1 702 . 19 1 1 A 59 59 LYS C C 59 179.530 179.125 0.405 1
1 703 . 19 1 1 A 59 59 LYS CA C 59 58.820 59.569 -0.749 1
1 704 . 19 1 1 A 59 59 LYS CB C 59 32.450 32.454 -0.004 1
1 708 . 19 1 1 A 59 59 LYS N N 59 116.730 119.772 -3.042 1
1 709 . 19 1 1 A 60 60 GLU H H 60 7.470 7.765 -0.295 1
1 710 . 19 1 1 A 60 60 GLU HA H 60 4.050 4.068 -0.018 1
1 715 . 19 1 1 A 60 60 GLU C C 60 178.950 178.336 0.614 1
1 716 . 19 1 1 A 60 60 GLU CA C 60 58.600 59.096 -0.496 1
1 717 . 19 1 1 A 60 60 GLU CB C 60 31.700 29.346 2.354 1
1 719 . 19 1 1 A 60 60 GLU N N 60 116.820 119.720 -2.900 1
1 720 . 19 1 1 A 61 61 LEU H H 61 8.030 7.568 0.462 1
1 721 . 19 1 1 A 61 61 LEU HA H 61 4.310 4.264 0.046 1
1 731 . 19 1 1 A 61 61 LEU C C 61 179.450 177.371 2.079 1
1 732 . 19 1 1 A 61 61 LEU CA C 61 54.840 56.563 -1.723 1
1 733 . 19 1 1 A 61 61 LEU CB C 61 43.820 42.174 1.646 1
1 737 . 19 1 1 A 61 61 LEU N N 61 116.000 119.085 -3.085 1
1 738 . 19 1 1 A 62 62 ASP H H 62 7.890 9.090 -1.200 1
1 739 . 19 1 1 A 62 62 ASP HA H 62 4.660 4.884 -0.224 1
1 742 . 19 1 1 A 62 62 ASP C C 62 177.030 176.089 0.941 1
1 743 . 19 1 1 A 62 62 ASP CA C 62 53.660 53.726 -0.066 1
1 744 . 19 1 1 A 62 62 ASP CB C 62 38.700 39.284 -0.584 1
1 745 . 19 1 1 A 62 62 ASP N N 62 117.550 118.192 -0.642 1
1 746 . 19 1 1 A 63 63 GLU H H 63 8.430 9.315 -0.885 1
1 747 . 19 1 1 A 63 63 GLU HA H 63 4.020 4.052 -0.032 1
1 752 . 19 1 1 A 63 63 GLU C C 63 178.120 178.996 -0.876 1
1 753 . 19 1 1 A 63 63 GLU CA C 63 58.470 59.255 -0.785 1
1 754 . 19 1 1 A 63 63 GLU CB C 63 30.120 29.422 0.698 1
1 756 . 19 1 1 A 63 63 GLU N N 63 130.230 120.409 9.821 1
1 757 . 19 1 1 A 64 64 ASN H H 64 8.010 7.748 0.262 1
1 758 . 19 1 1 A 64 64 ASN HA H 64 4.680 4.789 -0.109 1
1 761 . 19 1 1 A 64 64 ASN C C 64 177.100 175.617 1.483 1
1 762 . 19 1 1 A 64 64 ASN CA C 64 51.780 53.491 -1.711 1
1 763 . 19 1 1 A 64 64 ASN CB C 64 37.260 39.129 -1.869 1
1 764 . 19 1 1 A 64 64 ASN N N 64 113.640 115.224 -1.584 1
1 765 . 19 1 1 A 65 65 GLY H H 65 7.550 7.905 -0.355 1
1 766 . 19 1 1 A 65 65 GLY HA2 H 65 3.770 3.992 -0.222 1
1 767 . 19 1 1 A 65 65 GLY HA3 H 65 3.770 3.993 -0.223 1
1 768 . 19 1 1 A 65 65 GLY C C 65 178.980 174.980 4.000 1
1 769 . 19 1 1 A 65 65 GLY CA C 65 47.200 46.401 0.799 1
1 770 . 19 1 1 A 65 65 GLY N N 65 113.640 107.272 6.368 1
1 771 . 19 1 1 A 66 66 ASP H H 66 8.110 8.147 -0.037 1
1 772 . 19 1 1 A 66 66 ASP HA H 66 4.490 4.585 -0.095 1
1 775 . 19 1 1 A 66 66 ASP C C 66 177.960 177.497 0.463 1
1 776 . 19 1 1 A 66 66 ASP CA C 66 52.960 53.539 -0.579 1
1 777 . 19 1 1 A 66 66 ASP CB C 66 40.540 40.544 -0.004 1
1 778 . 19 1 1 A 66 66 ASP N N 66 120.030 120.304 -0.274 1
1 779 . 19 1 1 A 67 67 GLY H H 67 10.260 9.746 0.514 1
1 780 . 19 1 1 A 67 67 GLY HA2 H 67 3.360 3.886 -0.526 1
1 781 . 19 1 1 A 67 67 GLY HA3 H 67 4.000 3.888 0.112 1
1 782 . 19 1 1 A 67 67 GLY C C 67 173.120 173.437 -0.317 1
1 783 . 19 1 1 A 67 67 GLY CA C 67 45.460 45.616 -0.156 1
1 784 . 19 1 1 A 67 67 GLY N N 67 114.100 111.320 2.780 1
1 785 . 19 1 1 A 68 68 GLU H H 68 7.750 7.840 -0.090 1
1 786 . 19 1 1 A 68 68 GLU HA H 68 4.780 4.972 -0.192 1
1 791 . 19 1 1 A 68 68 GLU C C 68 175.930 174.633 1.297 1
1 792 . 19 1 1 A 68 68 GLU CA C 68 54.430 54.487 -0.057 1
1 793 . 19 1 1 A 68 68 GLU CB C 68 35.850 33.709 2.141 1
1 795 . 19 1 1 A 68 68 GLU N N 68 118.000 119.074 -1.074 1
1 796 . 19 1 1 A 69 69 VAL H H 69 9.380 8.752 0.628 1
1 797 . 19 1 1 A 69 69 VAL HA H 69 5.260 5.021 0.239 1
1 805 . 19 1 1 A 69 69 VAL C C 69 176.710 175.460 1.250 1
1 806 . 19 1 1 A 69 69 VAL CA C 69 61.280 60.817 0.463 1
1 807 . 19 1 1 A 69 69 VAL CB C 69 33.980 34.798 -0.818 1
1 810 . 19 1 1 A 69 69 VAL N N 69 125.970 120.686 5.284 1
1 811 . 19 1 1 A 70 70 ASP H H 70 9.100 8.801 0.299 1
1 812 . 19 1 1 A 70 70 ASP HA H 70 5.190 5.111 0.079 1
1 815 . 19 1 1 A 70 70 ASP C C 70 175.700 175.658 0.042 1
1 816 . 19 1 1 A 70 70 ASP CA C 70 52.370 53.455 -1.085 1
1 817 . 19 1 1 A 70 70 ASP CB C 70 40.950 42.135 -1.185 1
1 818 . 19 1 1 A 70 70 ASP N N 70 130.320 121.773 8.547 1
1 819 . 19 1 1 A 71 71 PHE H H 71 9.090 7.660 1.430 1
1 820 . 19 1 1 A 71 71 PHE HA H 71 4.100 4.539 -0.439 1
1 823 . 19 1 1 A 71 71 PHE C C 71 177.000 175.536 1.464 1
1 824 . 19 1 1 A 71 71 PHE CA C 71 58.230 59.180 -0.950 1
1 825 . 19 1 1 A 71 71 PHE CB C 71 36.910 40.305 -3.395 1
1 826 . 19 1 1 A 71 71 PHE N N 71 119.760 116.119 3.641 1
1 827 . 19 1 1 A 72 72 GLN H H 72 8.440 8.402 0.038 1
1 828 . 19 1 1 A 72 72 GLN HA H 72 3.600 4.122 -0.522 1
1 831 . 19 1 1 A 72 72 GLN C C 72 178.820 177.531 1.289 1
1 832 . 19 1 1 A 72 72 GLN CA C 72 59.500 58.812 0.688 1
1 833 . 19 1 1 A 72 72 GLN CB C 72 29.553 28.574 0.979 1
1 835 . 19 1 1 A 72 72 GLN N N 72 121.820 119.253 2.567 1
1 836 . 19 1 1 A 73 73 GLU H H 73 8.290 8.031 0.259 1
1 837 . 19 1 1 A 73 73 GLU HA H 73 4.070 4.128 -0.058 1
1 842 . 19 1 1 A 73 73 GLU C C 73 179.370 178.943 0.427 1
1 843 . 19 1 1 A 73 73 GLU CA C 73 58.030 58.899 -0.869 1
1 844 . 19 1 1 A 73 73 GLU CB C 73 29.530 29.996 -0.466 1
1 846 . 19 1 1 A 73 73 GLU N N 73 120.550 119.049 1.501 1
1 847 . 19 1 1 A 74 74 PHE H H 74 8.630 8.264 0.366 1
1 848 . 19 1 1 A 74 74 PHE HA H 74 4.020 4.151 -0.131 1
1 851 . 19 1 1 A 74 74 PHE C C 74 177.890 177.405 0.485 1
1 852 . 19 1 1 A 74 74 PHE CA C 74 60.090 61.440 -1.350 1
1 853 . 19 1 1 A 74 74 PHE CB C 74 38.020 39.204 -1.184 1
1 854 . 19 1 1 A 74 74 PHE N N 74 121.010 121.737 -0.727 1
1 855 . 19 1 1 A 75 75 VAL H H 75 8.080 8.357 -0.277 1
1 856 . 19 1 1 A 75 75 VAL HA H 75 2.860 3.996 -1.136 1
1 864 . 19 1 1 A 75 75 VAL C C 75 177.030 178.075 -1.045 1
1 865 . 19 1 1 A 75 75 VAL CA C 75 66.430 65.687 0.743 1
1 866 . 19 1 1 A 75 75 VAL CB C 75 30.600 31.529 -0.929 1
1 869 . 19 1 1 A 75 75 VAL N N 75 119.460 118.831 0.629 1
1 870 . 19 1 1 A 76 76 VAL H H 76 7.100 8.230 -1.130 1
1 871 . 19 1 1 A 76 76 VAL HA H 76 3.330 3.556 -0.226 1
1 879 . 19 1 1 A 76 76 VAL C C 76 178.670 178.154 0.516 1
1 880 . 19 1 1 A 76 76 VAL CA C 76 67.000 66.785 0.215 1
1 881 . 19 1 1 A 76 76 VAL CB C 76 31.280 31.508 -0.228 1
1 884 . 19 1 1 A 76 76 VAL N N 76 121.030 121.598 -0.568 1
1 885 . 19 1 1 A 77 77 LEU H H 77 6.900 7.907 -1.007 1
1 886 . 19 1 1 A 77 77 LEU HA H 77 3.800 3.947 -0.147 1
1 896 . 19 1 1 A 77 77 LEU C C 77 177.960 178.434 -0.474 1
1 897 . 19 1 1 A 77 77 LEU CA C 77 57.710 58.149 -0.439 1
1 898 . 19 1 1 A 77 77 LEU CB C 77 40.070 41.732 -1.662 1
1 902 . 19 1 1 A 77 77 LEU N N 77 120.310 120.783 -0.473 1
1 903 . 19 1 1 A 78 78 VAL H H 78 7.240 7.395 -0.155 1
1 904 . 19 1 1 A 78 78 VAL HA H 78 3.030 3.606 -0.576 1
1 912 . 19 1 1 A 78 78 VAL C C 78 179.600 178.256 1.344 1
1 913 . 19 1 1 A 78 78 VAL CA C 78 66.420 66.304 0.116 1
1 914 . 19 1 1 A 78 78 VAL CB C 78 30.700 31.362 -0.662 1
1 917 . 19 1 1 A 78 78 VAL N N 78 117.180 119.317 -2.137 1
1 918 . 19 1 1 A 79 79 ALA H H 79 9.000 8.387 0.613 1
1 919 . 19 1 1 A 79 79 ALA HA H 79 3.610 3.953 -0.343 1
1 923 . 19 1 1 A 79 79 ALA C C 79 182.260 179.932 2.328 1
1 924 . 19 1 1 A 79 79 ALA CA C 79 55.580 55.429 0.151 1
1 925 . 19 1 1 A 79 79 ALA CB C 79 18.400 17.955 0.445 1
1 926 . 19 1 1 A 79 79 ALA N N 79 126.000 122.285 3.715 1
1 927 . 19 1 1 A 80 80 ALA H H 80 8.000 7.724 0.276 1
1 928 . 19 1 1 A 80 80 ALA HA H 80 4.100 4.097 0.003 1
1 932 . 19 1 1 A 80 80 ALA C C 80 175.460 179.894 -4.434 1
1 933 . 19 1 1 A 80 80 ALA CA C 80 56.020 54.654 1.366 1
1 934 . 19 1 1 A 80 80 ALA CB C 80 18.040 18.379 -0.339 1
1 935 . 19 1 1 A 80 80 ALA N N 80 120.730 120.802 -0.072 1
1 936 . 19 1 1 A 81 81 LEU H H 81 8.460 7.777 0.683 1
1 937 . 19 1 1 A 81 81 LEU HA H 81 4.000 4.078 -0.078 1
1 941 . 19 1 1 A 81 81 LEU C C 81 177.030 179.076 -2.046 1
1 942 . 19 1 1 A 81 81 LEU CA C 81 57.640 57.747 -0.107 1
1 943 . 19 1 1 A 81 81 LEU CB C 81 40.620 42.110 -1.490 1
1 945 . 19 1 1 A 81 81 LEU N N 81 119.890 119.873 0.017 1
1 946 . 19 1 1 A 82 82 THR H H 82 8.320 7.793 0.527 1
1 947 . 19 1 1 A 82 82 THR HA H 82 3.800 3.989 -0.189 1
1 952 . 19 1 1 A 82 82 THR C C 82 181.010 176.886 4.124 1
1 953 . 19 1 1 A 82 82 THR CA C 82 68.500 66.231 2.269 1
1 954 . 19 1 1 A 82 82 THR CB C 82 67.400 69.241 -1.841 1
1 956 . 19 1 1 A 82 82 THR N N 82 117.120 113.016 4.104 1
1 957 . 19 1 1 A 83 83 VAL H H 83 8.530 7.514 1.016 1
1 958 . 19 1 1 A 83 83 VAL HA H 83 3.890 3.833 0.057 1
1 966 . 19 1 1 A 83 83 VAL C C 83 178.120 178.228 -0.108 1
1 967 . 19 1 1 A 83 83 VAL CA C 83 67.400 65.140 2.260 1
1 968 . 19 1 1 A 83 83 VAL CB C 83 31.590 31.542 0.048 1
1 971 . 19 1 1 A 83 83 VAL N N 83 119.760 118.066 1.694 1
1 972 . 19 1 1 A 84 84 ALA H H 84 7.910 8.113 -0.203 1
1 973 . 19 1 1 A 84 84 ALA HA H 84 4.060 4.147 -0.087 1
1 977 . 19 1 1 A 84 84 ALA C C 84 180.560 179.647 0.913 1
1 978 . 19 1 1 A 84 84 ALA CA C 84 55.000 54.883 0.117 1
1 979 . 19 1 1 A 84 84 ALA CB C 84 17.230 18.207 -0.977 1
1 980 . 19 1 1 A 84 84 ALA N N 84 122.620 124.539 -1.919 1
1 981 . 19 1 1 A 85 85 CYS H H 85 8.580 7.856 0.724 1
1 982 . 19 1 1 A 85 85 CYS HA H 85 4.080 4.507 -0.427 1
1 985 . 19 1 1 A 85 85 CYS C C 85 179.060 177.021 2.039 1
1 986 . 19 1 1 A 85 85 CYS CA C 85 63.210 61.654 1.556 1
1 987 . 19 1 1 A 85 85 CYS CB C 85 26.310 27.533 -1.223 1
1 988 . 19 1 1 A 85 85 CYS N N 85 118.730 117.175 1.555 1
1 989 . 19 1 1 A 86 86 ASN H H 86 8.430 8.091 0.339 1
1 990 . 19 1 1 A 86 86 ASN CA C 86 55.860 56.837 -0.977 1
1 991 . 19 1 1 A 86 86 ASN CB C 86 37.440 39.717 -2.277 1
1 992 . 19 1 1 A 86 86 ASN N N 86 119.360 119.110 0.250 1
1 993 . 19 1 1 A 87 87 ASN H H 87 7.880 8.069 -0.189 1
1 994 . 19 1 1 A 87 87 ASN HA H 87 4.600 4.591 0.009 1
1 997 . 19 1 1 A 87 87 ASN C C 87 178.510 177.688 0.822 1
1 998 . 19 1 1 A 87 87 ASN CA C 87 56.470 56.410 0.060 1
1 999 . 19 1 1 A 87 87 ASN CB C 87 37.500 39.033 -1.533 1
1 1000 . 19 1 1 A 87 87 ASN N N 87 119.480 117.562 1.918 1
1 1001 . 19 1 1 A 88 88 PHE H H 88 8.050 7.813 0.237 1
1 1002 . 19 1 1 A 88 88 PHE HA H 88 4.200 4.291 -0.091 1
1 1005 . 19 1 1 A 88 88 PHE C C 88 178.510 177.627 0.883 1
1 1006 . 19 1 1 A 88 88 PHE CA C 88 56.460 59.874 -3.414 1
1 1007 . 19 1 1 A 88 88 PHE CB C 88 38.500 39.917 -1.417 1
1 1008 . 19 1 1 A 88 88 PHE N N 88 120.280 119.873 0.407 1
1 1009 . 19 1 1 A 89 89 PHE H H 89 8.020 8.256 -0.236 1
1 1010 . 19 1 1 A 89 89 PHE HA H 89 4.000 4.267 -0.267 1
1 1013 . 19 1 1 A 89 89 PHE C C 89 177.340 177.677 -0.337 1
1 1014 . 19 1 1 A 89 89 PHE CA C 89 59.000 61.128 -2.128 1
1 1015 . 19 1 1 A 89 89 PHE CB C 89 37.430 38.822 -1.392 1
1 1016 . 19 1 1 A 89 89 PHE N N 89 120.910 119.315 1.595 1
1 1017 . 19 1 1 A 90 90 TRP H H 90 7.800 7.962 -0.162 1
1 1018 . 19 1 1 A 90 90 TRP HA H 90 4.460 4.387 0.073 1
1 1021 . 19 1 1 A 90 90 TRP C C 90 177.340 178.350 -1.010 1
1 1022 . 19 1 1 A 90 90 TRP CA C 90 57.930 59.621 -1.691 1
1 1023 . 19 1 1 A 90 90 TRP CB C 90 42.000 30.100 11.900 1
1 1024 . 19 1 1 A 90 90 TRP N N 90 120.050 120.692 -0.642 1
1 1025 . 19 1 1 A 91 91 GLU H H 91 7.800 8.742 -0.942 1
1 1026 . 19 1 1 A 91 91 GLU HA H 91 4.050 3.702 0.348 1
1 1031 . 19 1 1 A 91 91 GLU C C 91 177.570 177.881 -0.311 1
1 1032 . 19 1 1 A 91 91 GLU CA C 91 57.350 59.850 -2.500 1
1 1033 . 19 1 1 A 91 91 GLU CB C 91 29.530 28.817 0.713 1
1 1035 . 19 1 1 A 91 91 GLU N N 91 120.730 118.308 2.422 1
1 1036 . 19 1 1 A 92 92 ASN H H 92 7.800 7.410 0.390 1
1 1037 . 19 1 1 A 92 92 ASN HA H 92 4.630 4.579 0.051 1
1 1040 . 19 1 1 A 92 92 ASN C C 92 174.450 174.786 -0.336 1
1 1041 . 19 1 1 A 92 92 ASN CA C 92 52.960 52.344 0.616 1
1 1042 . 19 1 1 A 92 92 ASN CB C 92 29.530 38.519 -8.989 1
1 1043 . 19 1 1 A 92 92 ASN N N 92 119.410 116.178 3.232 1
1 5 . 20 1 1 A 2 2 SER H H 2 9.000 9.115 -0.115 1
1 6 . 20 1 1 A 2 2 SER HA H 2 4.690 4.644 0.046 1
1 9 . 20 1 1 A 2 2 SER C C 2 176.170 174.643 1.527 1
1 10 . 20 1 1 A 2 2 SER CA C 2 57.340 58.469 -1.129 1
1 11 . 20 1 1 A 2 2 SER CB C 2 65.550 63.277 2.273 1
1 12 . 20 1 1 A 2 2 SER N N 2 119.330 117.689 1.641 1
1 13 . 20 1 1 A 3 3 GLU H H 3 9.350 8.187 1.163 1
1 14 . 20 1 1 A 3 3 GLU HA H 3 4.060 4.114 -0.054 1
1 17 . 20 1 1 A 3 3 GLU C C 3 180.150 179.605 0.545 1
1 18 . 20 1 1 A 3 3 GLU CA C 3 60.280 59.022 1.258 1
1 19 . 20 1 1 A 3 3 GLU CB C 3 29.230 29.254 -0.024 1
1 21 . 20 1 1 A 3 3 GLU N N 3 125.350 122.059 3.291 1
1 22 . 20 1 1 A 4 4 LEU H H 4 9.060 8.494 0.566 1
1 23 . 20 1 1 A 4 4 LEU HA H 4 4.080 3.999 0.081 1
1 33 . 20 1 1 A 4 4 LEU C C 4 177.890 179.090 -1.200 1
1 34 . 20 1 1 A 4 4 LEU CA C 4 58.090 58.067 0.023 1
1 35 . 20 1 1 A 4 4 LEU CB C 4 42.120 41.309 0.811 1
1 39 . 20 1 1 A 4 4 LEU N N 4 121.090 120.656 0.434 1
1 40 . 20 1 1 A 5 5 GLU H H 5 8.340 8.367 -0.027 1
1 41 . 20 1 1 A 5 5 GLU HA H 5 4.050 3.912 0.138 1
1 46 . 20 1 1 A 5 5 GLU C C 5 177.030 179.184 -2.154 1
1 47 . 20 1 1 A 5 5 GLU CA C 5 59.840 59.576 0.264 1
1 48 . 20 1 1 A 5 5 GLU CB C 5 28.940 29.277 -0.337 1
1 50 . 20 1 1 A 5 5 GLU N N 5 119.780 119.772 0.008 1
1 51 . 20 1 1 A 6 6 THR H H 6 8.370 8.003 0.367 1
1 52 . 20 1 1 A 6 6 THR HA H 6 4.310 3.930 0.380 1
1 57 . 20 1 1 A 6 6 THR C C 6 177.340 176.890 0.450 1
1 58 . 20 1 1 A 6 6 THR CA C 6 66.630 66.455 0.175 1
1 59 . 20 1 1 A 6 6 THR CB C 6 68.650 68.711 -0.061 1
1 61 . 20 1 1 A 6 6 THR N N 6 116.940 116.843 0.097 1
1 62 . 20 1 1 A 7 7 ALA H H 7 8.270 7.973 0.297 1
1 63 . 20 1 1 A 7 7 ALA HA H 7 4.190 4.240 -0.050 1
1 67 . 20 1 1 A 7 7 ALA C C 7 179.760 179.694 0.066 1
1 68 . 20 1 1 A 7 7 ALA CA C 7 55.880 55.134 0.746 1
1 69 . 20 1 1 A 7 7 ALA CB C 7 17.720 18.102 -0.382 1
1 70 . 20 1 1 A 7 7 ALA N N 7 127.400 124.078 3.322 1
1 71 . 20 1 1 A 8 8 MET H H 8 8.110 7.690 0.420 1
1 72 . 20 1 1 A 8 8 MET HA H 8 4.020 4.216 -0.196 1
1 80 . 20 1 1 A 8 8 MET C C 8 178.510 177.954 0.556 1
1 81 . 20 1 1 A 8 8 MET CA C 8 60.580 58.075 2.505 1
1 82 . 20 1 1 A 8 8 MET CB C 8 33.630 32.209 1.421 1
1 85 . 20 1 1 A 8 8 MET N N 8 117.520 118.442 -0.922 1
1 86 . 20 1 1 A 9 9 GLU H H 9 8.210 8.053 0.157 1
1 87 . 20 1 1 A 9 9 GLU HA H 9 3.830 4.054 -0.224 1
1 92 . 20 1 1 A 9 9 GLU C C 9 179.140 178.400 0.740 1
1 93 . 20 1 1 A 9 9 GLU CA C 9 59.690 58.929 0.761 1
1 94 . 20 1 1 A 9 9 GLU CB C 9 29.530 28.338 1.192 1
1 96 . 20 1 1 A 9 9 GLU N N 9 118.560 117.511 1.049 1
1 97 . 20 1 1 A 10 10 THR H H 10 8.490 7.475 1.015 1
1 98 . 20 1 1 A 10 10 THR HA H 10 4.000 3.837 0.163 1
1 103 . 20 1 1 A 10 10 THR C C 10 176.010 176.374 -0.364 1
1 104 . 20 1 1 A 10 10 THR CA C 10 67.110 66.328 0.782 1
1 105 . 20 1 1 A 10 10 THR CB C 10 67.770 68.448 -0.678 1
1 107 . 20 1 1 A 10 10 THR N N 10 118.310 115.828 2.482 1
1 108 . 20 1 1 A 11 11 LEU H H 11 7.920 7.636 0.284 1
1 109 . 20 1 1 A 11 11 LEU HA H 11 3.930 2.982 0.948 1
1 119 . 20 1 1 A 11 11 LEU C C 11 178.820 178.291 0.529 1
1 120 . 20 1 1 A 11 11 LEU CA C 11 59.690 57.492 2.198 1
1 121 . 20 1 1 A 11 11 LEU CB C 11 41.920 40.933 0.987 1
1 125 . 20 1 1 A 11 11 LEU N N 11 121.150 120.862 0.288 1
1 126 . 20 1 1 A 12 12 ILE H H 12 7.440 7.428 0.012 1
1 127 . 20 1 1 A 12 12 ILE HA H 12 3.640 3.023 0.617 1
1 137 . 20 1 1 A 12 12 ILE C C 12 179.530 178.073 1.457 1
1 138 . 20 1 1 A 12 12 ILE CA C 12 63.740 64.689 -0.949 1
1 139 . 20 1 1 A 12 12 ILE CB C 12 38.800 37.373 1.427 1
1 143 . 20 1 1 A 12 12 ILE N N 12 118.010 119.563 -1.553 1
1 144 . 20 1 1 A 13 13 ASN H H 13 8.930 7.526 1.404 1
1 145 . 20 1 1 A 13 13 ASN HA H 13 4.520 4.371 0.149 1
1 148 . 20 1 1 A 13 13 ASN C C 13 179.450 177.555 1.895 1
1 149 . 20 1 1 A 13 13 ASN CA C 13 56.470 55.386 1.084 1
1 150 . 20 1 1 A 13 13 ASN CB C 13 37.930 38.673 -0.743 1
1 151 . 20 1 1 A 13 13 ASN N N 13 121.820 118.325 3.495 1
1 152 . 20 1 1 A 14 14 VAL H H 14 9.180 7.901 1.279 1
1 153 . 20 1 1 A 14 14 VAL HA H 14 3.830 3.753 0.077 1
1 161 . 20 1 1 A 14 14 VAL CA C 14 65.840 65.213 0.627 1
1 162 . 20 1 1 A 14 14 VAL CB C 14 31.290 31.172 0.118 1
1 165 . 20 1 1 A 14 14 VAL N N 14 122.040 119.138 2.902 1
1 166 . 20 1 1 A 15 15 PHE H H 15 7.590 7.497 0.093 1
1 167 . 20 1 1 A 15 15 PHE HA H 15 3.360 3.998 -0.638 1
1 170 . 20 1 1 A 15 15 PHE C C 15 177.890 178.135 -0.245 1
1 171 . 20 1 1 A 15 15 PHE CA C 15 62.030 60.046 1.984 1
1 172 . 20 1 1 A 15 15 PHE CB C 15 38.900 37.903 0.997 1
1 173 . 20 1 1 A 15 15 PHE N N 15 118.290 120.280 -1.990 1
1 174 . 20 1 1 A 16 16 HIS H H 16 7.790 7.827 -0.037 1
1 175 . 20 1 1 A 16 16 HIS HA H 16 4.890 4.299 0.591 1
1 178 . 20 1 1 A 16 16 HIS C C 16 177.810 177.419 0.391 1
1 179 . 20 1 1 A 16 16 HIS CA C 16 59.100 59.733 -0.633 1
1 180 . 20 1 1 A 16 16 HIS CB C 16 28.060 29.252 -1.192 1
1 181 . 20 1 1 A 16 16 HIS N N 16 118.290 117.439 0.851 1
1 182 . 20 1 1 A 17 17 ALA H H 17 8.040 7.996 0.044 1
1 183 . 20 1 1 A 17 17 ALA HA H 17 4.050 3.991 0.059 1
1 187 . 20 1 1 A 17 17 ALA C C 17 179.600 179.727 -0.127 1
1 188 . 20 1 1 A 17 17 ALA CA C 17 54.000 55.310 -1.310 1
1 189 . 20 1 1 A 17 17 ALA CB C 17 17.520 18.629 -1.109 1
1 190 . 20 1 1 A 17 17 ALA N N 17 124.410 122.019 2.391 1
1 191 . 20 1 1 A 18 18 HIS H H 18 7.000 7.373 -0.373 1
1 192 . 20 1 1 A 18 18 HIS HA H 18 4.330 4.231 0.099 1
1 195 . 20 1 1 A 18 18 HIS C C 18 176.320 177.129 -0.809 1
1 196 . 20 1 1 A 18 18 HIS CA C 18 57.350 59.286 -1.936 1
1 197 . 20 1 1 A 18 18 HIS CB C 18 32.920 29.955 2.965 1
1 198 . 20 1 1 A 18 18 HIS N N 18 115.160 118.422 -3.262 1
1 199 . 20 1 1 A 19 19 SER H H 19 8.380 8.168 0.212 1
1 200 . 20 1 1 A 19 19 SER HA H 19 3.640 4.508 -0.868 1
1 203 . 20 1 1 A 19 19 SER C C 19 177.340 175.884 1.456 1
1 204 . 20 1 1 A 19 19 SER CA C 19 60.160 62.932 -2.772 1
1 205 . 20 1 1 A 19 19 SER CB C 19 61.000 62.610 -1.610 1
1 206 . 20 1 1 A 19 19 SER N N 19 114.380 115.859 -1.479 1
1 207 . 20 1 1 A 20 20 GLY H H 20 7.600 7.544 0.056 1
1 208 . 20 1 1 A 20 20 GLY HA2 H 20 3.680 4.012 -0.332 1
1 209 . 20 1 1 A 20 20 GLY HA3 H 20 4.000 4.020 -0.020 1
1 210 . 20 1 1 A 20 20 GLY C C 20 174.140 174.503 -0.363 1
1 211 . 20 1 1 A 20 20 GLY CA C 20 47.000 45.353 1.647 1
1 212 . 20 1 1 A 20 20 GLY N N 20 112.550 107.514 5.036 1
1 213 . 20 1 1 A 21 21 LYS H H 21 7.230 7.722 -0.492 1
1 214 . 20 1 1 A 21 21 LYS HA H 21 3.860 4.469 -0.609 1
1 223 . 20 1 1 A 21 21 LYS C C 21 177.730 175.866 1.864 1
1 224 . 20 1 1 A 21 21 LYS CA C 21 59.110 55.342 3.768 1
1 225 . 20 1 1 A 21 21 LYS CB C 21 32.460 33.910 -1.450 1
1 229 . 20 1 1 A 21 21 LYS N N 21 123.240 117.904 5.336 1
1 230 . 20 1 1 A 22 22 GLU H H 22 9.350 7.768 1.582 1
1 231 . 20 1 1 A 22 22 GLU HA H 22 4.610 4.484 0.126 1
1 236 . 20 1 1 A 22 22 GLU C C 22 177.420 175.238 2.182 1
1 237 . 20 1 1 A 22 22 GLU CA C 22 53.700 55.626 -1.926 1
1 238 . 20 1 1 A 22 22 GLU CB C 22 32.000 30.918 1.082 1
1 240 . 20 1 1 A 22 22 GLU N N 22 116.770 121.026 -4.256 1
1 241 . 20 1 1 A 23 23 GLY H H 23 7.570 7.400 0.170 1
1 242 . 20 1 1 A 23 23 GLY HA2 H 23 3.630 4.102 -0.472 1
1 243 . 20 1 1 A 23 23 GLY HA3 H 23 3.880 4.114 -0.234 1
1 244 . 20 1 1 A 23 23 GLY C C 23 173.980 171.939 2.041 1
1 245 . 20 1 1 A 23 23 GLY CA C 23 45.250 45.740 -0.490 1
1 246 . 20 1 1 A 23 23 GLY N N 23 112.180 108.768 3.412 1
1 247 . 20 1 1 A 24 24 ASP H H 24 8.680 8.420 0.260 1
1 248 . 20 1 1 A 24 24 ASP HA H 24 4.380 4.458 -0.078 1
1 251 . 20 1 1 A 24 24 ASP C C 24 178.590 177.368 1.222 1
1 252 . 20 1 1 A 24 24 ASP CA C 24 60.000 54.531 5.469 1
1 253 . 20 1 1 A 24 24 ASP CB C 24 27.480 42.313 -14.833 1
1 254 . 20 1 1 A 24 24 ASP N N 24 127.470 121.258 6.212 1
1 255 . 20 1 1 A 25 25 LYS H H 25 9.270 8.830 0.440 1
1 256 . 20 1 1 A 25 25 LYS HA H 25 4.250 3.918 0.332 1
1 265 . 20 1 1 A 25 25 LYS C C 25 177.030 177.104 -0.074 1
1 266 . 20 1 1 A 25 25 LYS CA C 25 60.000 59.451 0.549 1
1 267 . 20 1 1 A 25 25 LYS CB C 25 31.170 32.306 -1.136 1
1 271 . 20 1 1 A 25 25 LYS N N 25 132.960 126.468 6.492 1
1 272 . 20 1 1 A 26 26 TYR H H 26 9.430 7.316 2.114 1
1 273 . 20 1 1 A 26 26 TYR HA H 26 4.640 4.823 -0.183 1
1 276 . 20 1 1 A 26 26 TYR C C 26 174.290 174.609 -0.319 1
1 277 . 20 1 1 A 26 26 TYR CA C 26 56.010 57.535 -1.525 1
1 278 . 20 1 1 A 26 26 TYR CB C 26 37.730 39.188 -1.458 1
1 279 . 20 1 1 A 26 26 TYR N N 26 120.650 113.668 6.982 1
1 280 . 20 1 1 A 27 27 LYS H H 27 7.110 7.321 -0.211 1
1 281 . 20 1 1 A 27 27 LYS HA H 27 5.110 4.877 0.233 1
1 290 . 20 1 1 A 27 27 LYS C C 27 175.150 174.564 0.586 1
1 291 . 20 1 1 A 27 27 LYS CA C 27 55.070 54.716 0.354 1
1 292 . 20 1 1 A 27 27 LYS CB C 27 38.900 35.934 2.966 1
1 296 . 20 1 1 A 27 27 LYS N N 27 115.830 120.051 -4.221 1
1 297 . 20 1 1 A 28 28 LEU H H 28 9.820 8.476 1.344 1
1 298 . 20 1 1 A 28 28 LEU HA H 28 5.080 4.861 0.219 1
1 308 . 20 1 1 A 28 28 LEU C C 28 176.640 176.012 0.628 1
1 309 . 20 1 1 A 28 28 LEU CA C 28 52.660 53.739 -1.079 1
1 310 . 20 1 1 A 28 28 LEU CB C 28 42.710 43.165 -0.455 1
1 314 . 20 1 1 A 28 28 LEU N N 28 126.930 125.139 1.791 1
1 315 . 20 1 1 A 29 29 SER H H 29 9.890 10.143 -0.253 1
1 316 . 20 1 1 A 29 29 SER HA H 29 4.530 4.492 0.038 1
1 319 . 20 1 1 A 29 29 SER C C 29 174.990 175.534 -0.544 1
1 320 . 20 1 1 A 29 29 SER CA C 29 56.180 57.935 -1.755 1
1 321 . 20 1 1 A 29 29 SER CB C 29 65.550 64.403 1.147 1
1 322 . 20 1 1 A 29 29 SER N N 29 121.600 122.952 -1.352 1
1 323 . 20 1 1 A 30 30 LYS H H 30 8.850 8.943 -0.093 1
1 324 . 20 1 1 A 30 30 LYS HA H 30 3.850 3.988 -0.138 1
1 333 . 20 1 1 A 30 30 LYS C C 30 175.620 178.525 -2.905 1
1 334 . 20 1 1 A 30 30 LYS CA C 30 60.860 60.091 0.769 1
1 335 . 20 1 1 A 30 30 LYS CB C 30 31.290 32.198 -0.908 1
1 339 . 20 1 1 A 30 30 LYS N N 30 121.260 124.703 -3.443 1
1 340 . 20 1 1 A 31 31 LYS H H 31 7.970 8.076 -0.106 1
1 341 . 20 1 1 A 31 31 LYS HA H 31 3.880 4.106 -0.226 1
1 350 . 20 1 1 A 31 31 LYS C C 31 179.290 178.543 0.747 1
1 351 . 20 1 1 A 31 31 LYS CA C 31 59.110 59.012 0.098 1
1 352 . 20 1 1 A 31 31 LYS CB C 31 32.640 32.220 0.420 1
1 356 . 20 1 1 A 31 31 LYS N N 31 121.260 117.915 3.345 1
1 357 . 20 1 1 A 32 32 GLU H H 32 7.510 8.536 -1.026 1
1 358 . 20 1 1 A 32 32 GLU HA H 32 3.830 3.958 -0.128 1
1 363 . 20 1 1 A 32 32 GLU C C 32 179.290 179.536 -0.246 1
1 364 . 20 1 1 A 32 32 GLU CA C 32 58.590 58.840 -0.250 1
1 365 . 20 1 1 A 32 32 GLU CB C 32 30.120 29.894 0.226 1
1 367 . 20 1 1 A 32 32 GLU N N 32 120.090 119.383 0.707 1
1 368 . 20 1 1 A 33 33 LEU H H 33 8.970 7.676 1.294 1
1 369 . 20 1 1 A 33 33 LEU HA H 33 3.830 3.976 -0.146 1
1 379 . 20 1 1 A 33 33 LEU C C 33 178.200 178.798 -0.598 1
1 380 . 20 1 1 A 33 33 LEU CA C 33 57.930 58.140 -0.210 1
1 381 . 20 1 1 A 33 33 LEU CB C 33 40.660 41.353 -0.693 1
1 385 . 20 1 1 A 33 33 LEU N N 33 120.200 119.328 0.872 1
1 386 . 20 1 1 A 34 34 LYS H H 34 8.230 7.449 0.781 1
1 387 . 20 1 1 A 34 34 LYS HA H 34 3.550 3.934 -0.384 1
1 396 . 20 1 1 A 34 34 LYS C C 34 178.040 178.688 -0.648 1
1 397 . 20 1 1 A 34 34 LYS CA C 34 60.720 59.628 1.092 1
1 398 . 20 1 1 A 34 34 LYS CB C 34 31.980 32.130 -0.150 1
1 402 . 20 1 1 A 34 34 LYS N N 34 120.780 119.251 1.529 1
1 403 . 20 1 1 A 35 35 ASP H H 35 7.990 7.849 0.141 1
1 404 . 20 1 1 A 35 35 ASP HA H 35 4.250 4.434 -0.184 1
1 407 . 20 1 1 A 35 35 ASP C C 35 179.060 178.437 0.623 1
1 408 . 20 1 1 A 35 35 ASP CA C 35 56.830 57.060 -0.230 1
1 409 . 20 1 1 A 35 35 ASP CB C 35 40.440 40.722 -0.282 1
1 410 . 20 1 1 A 35 35 ASP N N 35 119.550 119.918 -0.368 1
1 411 . 20 1 1 A 36 36 LEU H H 36 8.130 7.455 0.675 1
1 412 . 20 1 1 A 36 36 LEU HA H 36 2.580 4.007 -1.427 1
1 422 . 20 1 1 A 36 36 LEU C C 36 179.450 178.412 1.038 1
1 423 . 20 1 1 A 36 36 LEU CA C 36 59.980 58.320 1.660 1
1 424 . 20 1 1 A 36 36 LEU CB C 36 42.180 41.532 0.648 1
1 428 . 20 1 1 A 36 36 LEU N N 36 125.560 121.979 3.581 1
1 429 . 20 1 1 A 37 37 LEU H H 37 8.740 8.050 0.690 1
1 430 . 20 1 1 A 37 37 LEU HA H 37 3.580 4.044 -0.464 1
1 440 . 20 1 1 A 37 37 LEU C C 37 179.290 179.232 0.058 1
1 441 . 20 1 1 A 37 37 LEU CA C 37 58.230 58.211 0.019 1
1 442 . 20 1 1 A 37 37 LEU CB C 37 41.590 40.805 0.785 1
1 446 . 20 1 1 A 37 37 LEU N N 37 120.520 118.595 1.925 1
1 447 . 20 1 1 A 38 38 GLN H H 38 8.520 8.070 0.450 1
1 448 . 20 1 1 A 38 38 GLN HA H 38 4.000 4.010 -0.010 1
1 453 . 20 1 1 A 38 38 GLN C C 38 177.960 178.572 -0.612 1
1 454 . 20 1 1 A 38 38 GLN CA C 38 58.210 59.050 -0.840 1
1 455 . 20 1 1 A 38 38 GLN CB C 38 28.650 28.192 0.458 1
1 457 . 20 1 1 A 38 38 GLN N N 38 116.740 118.823 -2.083 1
1 458 . 20 1 1 A 39 39 THR H H 39 7.910 8.231 -0.321 1
1 459 . 20 1 1 A 39 39 THR HA H 39 4.210 3.804 0.406 1
1 464 . 20 1 1 A 39 39 THR C C 39 177.180 175.678 1.502 1
1 465 . 20 1 1 A 39 39 THR CA C 39 64.730 67.261 -2.531 1
1 466 . 20 1 1 A 39 39 THR CB C 39 69.650 68.716 0.934 1
1 468 . 20 1 1 A 39 39 THR N N 39 111.400 117.146 -5.746 1
1 469 . 20 1 1 A 40 40 GLU H H 40 8.590 7.944 0.646 1
1 470 . 20 1 1 A 40 40 GLU HA H 40 4.680 4.461 0.219 1
1 475 . 20 1 1 A 40 40 GLU C C 40 178.280 177.156 1.124 1
1 476 . 20 1 1 A 40 40 GLU CA C 40 55.880 56.825 -0.945 1
1 477 . 20 1 1 A 40 40 GLU CB C 40 30.990 30.683 0.307 1
1 479 . 20 1 1 A 40 40 GLU N N 40 117.840 116.919 0.921 1
1 480 . 20 1 1 A 41 41 LEU H H 41 7.680 7.537 0.143 1
1 481 . 20 1 1 A 41 41 LEU HA H 41 5.080 4.840 0.240 1
1 491 . 20 1 1 A 41 41 LEU C C 41 179.450 177.326 2.124 1
1 492 . 20 1 1 A 41 41 LEU CA C 41 53.830 53.716 0.114 1
1 493 . 20 1 1 A 41 41 LEU CB C 41 41.360 42.798 -1.438 1
1 497 . 20 1 1 A 41 41 LEU N N 41 121.410 118.785 2.625 1
1 498 . 20 1 1 A 42 42 SER H H 42 8.380 7.963 0.417 1
1 499 . 20 1 1 A 42 42 SER HA H 42 4.130 4.122 0.008 1
1 502 . 20 1 1 A 42 42 SER C C 42 176.640 176.938 -0.298 1
1 503 . 20 1 1 A 42 42 SER CA C 42 61.280 61.688 -0.408 1
1 504 . 20 1 1 A 42 42 SER CB C 42 63.040 62.929 0.111 1
1 505 . 20 1 1 A 42 42 SER N N 42 117.420 117.651 -0.231 1
1 506 . 20 1 1 A 43 43 SER H H 43 8.900 8.173 0.727 1
1 507 . 20 1 1 A 43 43 SER HA H 43 4.290 4.250 0.040 1
1 510 . 20 1 1 A 43 43 SER C C 43 175.620 176.798 -1.178 1
1 511 . 20 1 1 A 43 43 SER CA C 43 60.860 62.046 -1.186 1
1 512 . 20 1 1 A 43 43 SER CB C 43 62.910 63.255 -0.345 1
1 513 . 20 1 1 A 43 43 SER N N 43 117.580 117.003 0.577 1
1 514 . 20 1 1 A 44 44 PHE H H 44 7.880 8.112 -0.232 1
1 515 . 20 1 1 A 44 44 PHE HA H 44 4.240 4.202 0.038 1
1 518 . 20 1 1 A 44 44 PHE C C 44 176.950 175.415 1.535 1
1 519 . 20 1 1 A 44 44 PHE CA C 44 62.710 61.353 1.357 1
1 520 . 20 1 1 A 44 44 PHE CB C 44 39.020 38.915 0.105 1
1 521 . 20 1 1 A 44 44 PHE N N 44 119.480 122.458 -2.978 1
1 522 . 20 1 1 A 45 45 LEU H H 45 8.060 8.090 -0.030 1
1 523 . 20 1 1 A 45 45 LEU HA H 45 3.810 3.824 -0.014 1
1 533 . 20 1 1 A 45 45 LEU C C 45 177.500 175.463 2.037 1
1 534 . 20 1 1 A 45 45 LEU CA C 45 59.980 55.464 4.516 1
1 535 . 20 1 1 A 45 45 LEU CB C 45 39.640 42.424 -2.784 1
1 538 . 20 1 1 A 45 45 LEU N N 45 118.010 122.179 -4.169 1
1 539 . 20 1 1 A 46 46 ASP H H 46 8.150 8.459 -0.309 1
1 540 . 20 1 1 A 46 46 ASP HA H 46 4.470 5.047 -0.577 1
1 543 . 20 1 1 A 46 46 ASP C C 46 179.920 175.102 4.818 1
1 544 . 20 1 1 A 46 46 ASP CA C 46 52.950 53.049 -0.099 1
1 545 . 20 1 1 A 46 46 ASP CB C 46 40.000 41.839 -1.839 1
1 546 . 20 1 1 A 46 46 ASP N N 46 119.460 121.725 -2.265 1
1 547 . 20 1 1 A 47 47 VAL H H 47 8.010 8.443 -0.433 1
1 548 . 20 1 1 A 47 47 VAL HA H 47 3.800 4.350 -0.550 1
1 556 . 20 1 1 A 47 47 VAL C C 47 175.460 176.904 -1.444 1
1 557 . 20 1 1 A 47 47 VAL CA C 47 60.000 62.640 -2.640 1
1 558 . 20 1 1 A 47 47 VAL CB C 47 31.580 33.296 -1.716 1
1 561 . 20 1 1 A 47 47 VAL N N 47 117.720 120.748 -3.028 1
1 562 . 20 1 1 A 48 48 GLN H H 48 7.960 8.951 -0.991 1
1 563 . 20 1 1 A 48 48 GLN HA H 48 4.060 3.943 0.117 1
1 568 . 20 1 1 A 48 48 GLN C C 48 179.370 178.843 0.527 1
1 569 . 20 1 1 A 48 48 GLN CA C 48 57.350 58.729 -1.379 1
1 570 . 20 1 1 A 48 48 GLN CB C 48 28.990 28.725 0.265 1
1 572 . 20 1 1 A 48 48 GLN N N 48 119.900 121.842 -1.942 1
1 573 . 20 1 1 A 49 49 LYS H H 49 7.810 7.677 0.133 1
1 574 . 20 1 1 A 49 49 LYS HA H 49 3.860 4.115 -0.255 1
1 583 . 20 1 1 A 49 49 LYS C C 49 177.890 176.597 1.293 1
1 584 . 20 1 1 A 49 49 LYS CA C 49 58.230 58.718 -0.488 1
1 585 . 20 1 1 A 49 49 LYS CB C 49 30.990 32.410 -1.420 1
1 587 . 20 1 1 A 49 49 LYS N N 49 120.030 119.905 0.125 1
1 588 . 20 1 1 A 50 50 ASP H H 50 7.570 7.705 -0.135 1
1 589 . 20 1 1 A 50 50 ASP HA H 50 4.700 4.783 -0.083 1
1 590 . 20 1 1 A 50 50 ASP CA C 50 52.950 53.325 -0.375 1
1 591 . 20 1 1 A 50 50 ASP CB C 50 38.900 41.180 -2.280 1
1 592 . 20 1 1 A 50 50 ASP N N 50 116.730 119.234 -2.504 1
1 593 . 20 1 1 A 51 51 ALA H H 51 7.570 8.741 -1.171 1
1 594 . 20 1 1 A 51 51 ALA HA H 51 4.200 3.981 0.219 1
1 598 . 20 1 1 A 51 51 ALA C C 51 179.760 179.160 0.600 1
1 599 . 20 1 1 A 51 51 ALA CA C 51 54.200 55.352 -1.152 1
1 600 . 20 1 1 A 51 51 ALA CB C 51 18.110 18.264 -0.154 1
1 601 . 20 1 1 A 51 51 ALA N N 51 118.390 127.331 -8.941 1
1 602 . 20 1 1 A 52 52 ASP H H 52 8.430 8.470 -0.040 1
1 603 . 20 1 1 A 52 52 ASP HA H 52 4.600 4.321 0.279 1
1 606 . 20 1 1 A 52 52 ASP C C 52 177.570 178.364 -0.794 1
1 607 . 20 1 1 A 52 52 ASP CA C 52 54.420 56.821 -2.401 1
1 608 . 20 1 1 A 52 52 ASP CB C 52 40.360 40.029 0.331 1
1 609 . 20 1 1 A 52 52 ASP N N 52 117.530 119.902 -2.372 1
1 610 . 20 1 1 A 53 53 ALA H H 53 7.660 7.500 0.160 1
1 611 . 20 1 1 A 53 53 ALA HA H 53 3.860 3.979 -0.119 1
1 615 . 20 1 1 A 53 53 ALA C C 53 180.070 180.599 -0.529 1
1 616 . 20 1 1 A 53 53 ALA CA C 53 55.590 55.350 0.240 1
1 617 . 20 1 1 A 53 53 ALA CB C 53 18.800 17.993 0.807 1
1 618 . 20 1 1 A 53 53 ALA N N 53 123.450 122.524 0.926 1
1 619 . 20 1 1 A 54 54 VAL H H 54 8.030 7.817 0.213 1
1 620 . 20 1 1 A 54 54 VAL HA H 54 3.240 3.636 -0.396 1
1 628 . 20 1 1 A 54 54 VAL C C 54 177.340 177.827 -0.487 1
1 629 . 20 1 1 A 54 54 VAL CA C 54 66.620 66.023 0.597 1
1 630 . 20 1 1 A 54 54 VAL CB C 54 30.480 31.036 -0.556 1
1 633 . 20 1 1 A 54 54 VAL N N 54 116.150 117.283 -1.133 1
1 634 . 20 1 1 A 55 55 ASP H H 55 7.660 7.697 -0.037 1
1 635 . 20 1 1 A 55 55 ASP HA H 55 4.080 4.365 -0.285 1
1 638 . 20 1 1 A 55 55 ASP C C 55 177.260 179.315 -2.055 1
1 639 . 20 1 1 A 55 55 ASP CA C 55 57.640 57.319 0.321 1
1 640 . 20 1 1 A 55 55 ASP CB C 55 40.360 40.150 0.210 1
1 641 . 20 1 1 A 55 55 ASP N N 55 120.830 122.199 -1.369 1
1 642 . 20 1 1 A 56 56 LYS H H 56 7.780 7.530 0.250 1
1 643 . 20 1 1 A 56 56 LYS HA H 56 3.860 4.025 -0.165 1
1 652 . 20 1 1 A 56 56 LYS C C 56 179.530 179.343 0.187 1
1 653 . 20 1 1 A 56 56 LYS CA C 56 59.690 59.750 -0.060 1
1 654 . 20 1 1 A 56 56 LYS CB C 56 31.870 32.435 -0.565 1
1 658 . 20 1 1 A 56 56 LYS N N 56 120.010 119.414 0.596 1
1 659 . 20 1 1 A 57 57 ILE H H 57 8.090 7.748 0.342 1
1 660 . 20 1 1 A 57 57 ILE HA H 57 3.390 3.579 -0.189 1
1 670 . 20 1 1 A 57 57 ILE C C 57 176.710 177.629 -0.919 1
1 671 . 20 1 1 A 57 57 ILE CA C 57 64.960 65.058 -0.098 1
1 672 . 20 1 1 A 57 57 ILE CB C 57 38.080 38.411 -0.331 1
1 676 . 20 1 1 A 57 57 ILE N N 57 120.960 120.450 0.510 1
1 677 . 20 1 1 A 58 58 MET H H 58 8.480 8.229 0.251 1
1 678 . 20 1 1 A 58 58 MET HA H 58 3.800 4.088 -0.288 1
1 686 . 20 1 1 A 58 58 MET C C 58 177.570 178.171 -0.601 1
1 687 . 20 1 1 A 58 58 MET CA C 58 58.570 58.387 0.183 1
1 688 . 20 1 1 A 58 58 MET CB C 58 32.570 31.934 0.636 1
1 691 . 20 1 1 A 58 58 MET N N 58 119.160 120.648 -1.488 1
1 692 . 20 1 1 A 59 59 LYS H H 59 7.550 7.970 -0.420 1
1 693 . 20 1 1 A 59 59 LYS HA H 59 3.930 3.946 -0.016 1
1 702 . 20 1 1 A 59 59 LYS C C 59 179.530 179.245 0.285 1
1 703 . 20 1 1 A 59 59 LYS CA C 59 58.820 59.686 -0.866 1
1 704 . 20 1 1 A 59 59 LYS CB C 59 32.450 32.446 0.004 1
1 708 . 20 1 1 A 59 59 LYS N N 59 116.730 119.800 -3.070 1
1 709 . 20 1 1 A 60 60 GLU H H 60 7.470 7.878 -0.408 1
1 710 . 20 1 1 A 60 60 GLU HA H 60 4.050 4.056 -0.006 1
1 715 . 20 1 1 A 60 60 GLU C C 60 178.950 177.706 1.244 1
1 716 . 20 1 1 A 60 60 GLU CA C 60 58.600 58.844 -0.244 1
1 717 . 20 1 1 A 60 60 GLU CB C 60 31.700 29.307 2.393 1
1 719 . 20 1 1 A 60 60 GLU N N 60 116.820 119.463 -2.643 1
1 720 . 20 1 1 A 61 61 LEU H H 61 8.030 7.629 0.401 1
1 721 . 20 1 1 A 61 61 LEU HA H 61 4.310 4.304 0.006 1
1 731 . 20 1 1 A 61 61 LEU C C 61 179.450 177.155 2.295 1
1 732 . 20 1 1 A 61 61 LEU CA C 61 54.840 55.511 -0.671 1
1 733 . 20 1 1 A 61 61 LEU CB C 61 43.820 42.390 1.430 1
1 737 . 20 1 1 A 61 61 LEU N N 61 116.000 117.810 -1.810 1
1 738 . 20 1 1 A 62 62 ASP H H 62 7.890 8.421 -0.531 1
1 739 . 20 1 1 A 62 62 ASP HA H 62 4.660 4.860 -0.200 1
1 742 . 20 1 1 A 62 62 ASP C C 62 177.030 176.134 0.896 1
1 743 . 20 1 1 A 62 62 ASP CA C 62 53.660 53.706 -0.046 1
1 744 . 20 1 1 A 62 62 ASP CB C 62 38.700 39.267 -0.567 1
1 745 . 20 1 1 A 62 62 ASP N N 62 117.550 118.788 -1.238 1
1 746 . 20 1 1 A 63 63 GLU H H 63 8.430 9.410 -0.980 1
1 747 . 20 1 1 A 63 63 GLU HA H 63 4.020 4.026 -0.006 1
1 752 . 20 1 1 A 63 63 GLU C C 63 178.120 178.721 -0.601 1
1 753 . 20 1 1 A 63 63 GLU CA C 63 58.470 59.218 -0.748 1
1 754 . 20 1 1 A 63 63 GLU CB C 63 30.120 29.399 0.721 1
1 756 . 20 1 1 A 63 63 GLU N N 63 130.230 120.401 9.829 1
1 757 . 20 1 1 A 64 64 ASN H H 64 8.010 7.723 0.287 1
1 758 . 20 1 1 A 64 64 ASN HA H 64 4.680 4.801 -0.121 1
1 761 . 20 1 1 A 64 64 ASN C C 64 177.100 175.630 1.470 1
1 762 . 20 1 1 A 64 64 ASN CA C 64 51.780 53.395 -1.615 1
1 763 . 20 1 1 A 64 64 ASN CB C 64 37.260 39.192 -1.932 1
1 764 . 20 1 1 A 64 64 ASN N N 64 113.640 115.201 -1.561 1
1 765 . 20 1 1 A 65 65 GLY H H 65 7.550 7.882 -0.332 1
1 766 . 20 1 1 A 65 65 GLY HA2 H 65 3.770 3.964 -0.194 1
1 767 . 20 1 1 A 65 65 GLY HA3 H 65 3.770 3.966 -0.196 1
1 768 . 20 1 1 A 65 65 GLY C C 65 178.980 174.986 3.994 1
1 769 . 20 1 1 A 65 65 GLY CA C 65 47.200 46.488 0.712 1
1 770 . 20 1 1 A 65 65 GLY N N 65 113.640 107.321 6.319 1
1 771 . 20 1 1 A 66 66 ASP H H 66 8.110 8.162 -0.052 1
1 772 . 20 1 1 A 66 66 ASP HA H 66 4.490 4.575 -0.085 1
1 775 . 20 1 1 A 66 66 ASP C C 66 177.960 177.434 0.526 1
1 776 . 20 1 1 A 66 66 ASP CA C 66 52.960 53.572 -0.612 1
1 777 . 20 1 1 A 66 66 ASP CB C 66 40.540 40.602 -0.062 1
1 778 . 20 1 1 A 66 66 ASP N N 66 120.030 120.388 -0.358 1
1 779 . 20 1 1 A 67 67 GLY H H 67 10.260 9.541 0.719 1
1 780 . 20 1 1 A 67 67 GLY HA2 H 67 3.360 3.882 -0.522 1
1 781 . 20 1 1 A 67 67 GLY HA3 H 67 4.000 3.883 0.117 1
1 782 . 20 1 1 A 67 67 GLY C C 67 173.120 173.364 -0.244 1
1 783 . 20 1 1 A 67 67 GLY CA C 67 45.460 45.551 -0.091 1
1 784 . 20 1 1 A 67 67 GLY N N 67 114.100 111.108 2.992 1
1 785 . 20 1 1 A 68 68 GLU H H 68 7.750 8.241 -0.491 1
1 786 . 20 1 1 A 68 68 GLU HA H 68 4.780 4.943 -0.163 1
1 791 . 20 1 1 A 68 68 GLU C C 68 175.930 174.852 1.078 1
1 792 . 20 1 1 A 68 68 GLU CA C 68 54.430 54.398 0.032 1
1 793 . 20 1 1 A 68 68 GLU CB C 68 35.850 33.637 2.213 1
1 795 . 20 1 1 A 68 68 GLU N N 68 118.000 119.084 -1.084 1
1 796 . 20 1 1 A 69 69 VAL H H 69 9.380 8.649 0.731 1
1 797 . 20 1 1 A 69 69 VAL HA H 69 5.260 5.000 0.260 1
1 805 . 20 1 1 A 69 69 VAL C C 69 176.710 174.639 2.071 1
1 806 . 20 1 1 A 69 69 VAL CA C 69 61.280 61.287 -0.007 1
1 807 . 20 1 1 A 69 69 VAL CB C 69 33.980 33.749 0.231 1
1 810 . 20 1 1 A 69 69 VAL N N 69 125.970 121.009 4.961 1
1 811 . 20 1 1 A 70 70 ASP H H 70 9.100 8.983 0.117 1
1 812 . 20 1 1 A 70 70 ASP HA H 70 5.190 4.977 0.213 1
1 815 . 20 1 1 A 70 70 ASP C C 70 175.700 177.674 -1.974 1
1 816 . 20 1 1 A 70 70 ASP CA C 70 52.370 53.268 -0.898 1
1 817 . 20 1 1 A 70 70 ASP CB C 70 40.950 42.251 -1.301 1
1 818 . 20 1 1 A 70 70 ASP N N 70 130.320 127.163 3.157 1
1 819 . 20 1 1 A 71 71 PHE H H 71 9.090 9.347 -0.257 1
1 820 . 20 1 1 A 71 71 PHE HA H 71 4.100 4.208 -0.108 1
1 823 . 20 1 1 A 71 71 PHE C C 71 177.000 177.247 -0.247 1
1 824 . 20 1 1 A 71 71 PHE CA C 71 58.230 62.214 -3.984 1
1 825 . 20 1 1 A 71 71 PHE CB C 71 36.910 39.741 -2.831 1
1 826 . 20 1 1 A 71 71 PHE N N 71 119.760 123.352 -3.592 1
1 827 . 20 1 1 A 72 72 GLN H H 72 8.440 8.170 0.270 1
1 828 . 20 1 1 A 72 72 GLN HA H 72 3.600 3.917 -0.317 1
1 831 . 20 1 1 A 72 72 GLN C C 72 178.820 178.051 0.769 1
1 832 . 20 1 1 A 72 72 GLN CA C 72 59.500 58.713 0.787 1
1 833 . 20 1 1 A 72 72 GLN CB C 72 29.553 28.103 1.450 1
1 835 . 20 1 1 A 72 72 GLN N N 72 121.820 117.788 4.032 1
1 836 . 20 1 1 A 73 73 GLU H H 73 8.290 8.836 -0.546 1
1 837 . 20 1 1 A 73 73 GLU HA H 73 4.070 4.093 -0.023 1
1 842 . 20 1 1 A 73 73 GLU C C 73 179.370 178.765 0.605 1
1 843 . 20 1 1 A 73 73 GLU CA C 73 58.030 58.833 -0.803 1
1 844 . 20 1 1 A 73 73 GLU CB C 73 29.530 29.739 -0.209 1
1 846 . 20 1 1 A 73 73 GLU N N 73 120.550 120.049 0.501 1
1 847 . 20 1 1 A 74 74 PHE H H 74 8.630 8.485 0.145 1
1 848 . 20 1 1 A 74 74 PHE HA H 74 4.020 4.035 -0.015 1
1 851 . 20 1 1 A 74 74 PHE C C 74 177.890 176.945 0.945 1
1 852 . 20 1 1 A 74 74 PHE CA C 74 60.090 61.286 -1.196 1
1 853 . 20 1 1 A 74 74 PHE CB C 74 38.020 39.003 -0.983 1
1 854 . 20 1 1 A 74 74 PHE N N 74 121.010 121.963 -0.953 1
1 855 . 20 1 1 A 75 75 VAL H H 75 8.080 8.545 -0.465 1
1 856 . 20 1 1 A 75 75 VAL HA H 75 2.860 3.741 -0.881 1
1 864 . 20 1 1 A 75 75 VAL C C 75 177.030 178.166 -1.136 1
1 865 . 20 1 1 A 75 75 VAL CA C 75 66.430 66.739 -0.309 1
1 866 . 20 1 1 A 75 75 VAL CB C 75 30.600 31.210 -0.610 1
1 869 . 20 1 1 A 75 75 VAL N N 75 119.460 119.256 0.204 1
1 870 . 20 1 1 A 76 76 VAL H H 76 7.100 8.126 -1.026 1
1 871 . 20 1 1 A 76 76 VAL HA H 76 3.330 3.500 -0.170 1
1 879 . 20 1 1 A 76 76 VAL C C 76 178.670 178.469 0.201 1
1 880 . 20 1 1 A 76 76 VAL CA C 76 67.000 66.626 0.374 1
1 881 . 20 1 1 A 76 76 VAL CB C 76 31.280 31.490 -0.210 1
1 884 . 20 1 1 A 76 76 VAL N N 76 121.030 119.945 1.085 1
1 885 . 20 1 1 A 77 77 LEU H H 77 6.900 7.680 -0.780 1
1 886 . 20 1 1 A 77 77 LEU HA H 77 3.800 3.955 -0.155 1
1 896 . 20 1 1 A 77 77 LEU C C 77 177.960 178.437 -0.477 1
1 897 . 20 1 1 A 77 77 LEU CA C 77 57.710 58.023 -0.313 1
1 898 . 20 1 1 A 77 77 LEU CB C 77 40.070 41.645 -1.575 1
1 902 . 20 1 1 A 77 77 LEU N N 77 120.310 120.974 -0.664 1
1 903 . 20 1 1 A 78 78 VAL H H 78 7.240 7.617 -0.377 1
1 904 . 20 1 1 A 78 78 VAL HA H 78 3.030 3.786 -0.756 1
1 912 . 20 1 1 A 78 78 VAL C C 78 179.600 178.084 1.516 1
1 913 . 20 1 1 A 78 78 VAL CA C 78 66.420 64.854 1.566 1
1 914 . 20 1 1 A 78 78 VAL CB C 78 30.700 31.656 -0.956 1
1 917 . 20 1 1 A 78 78 VAL N N 78 117.180 116.484 0.696 1
1 918 . 20 1 1 A 79 79 ALA H H 79 9.000 8.125 0.875 1
1 919 . 20 1 1 A 79 79 ALA HA H 79 3.610 4.017 -0.407 1
1 923 . 20 1 1 A 79 79 ALA C C 79 182.260 180.085 2.175 1
1 924 . 20 1 1 A 79 79 ALA CA C 79 55.580 55.388 0.192 1
1 925 . 20 1 1 A 79 79 ALA CB C 79 18.400 18.010 0.390 1
1 926 . 20 1 1 A 79 79 ALA N N 79 126.000 125.193 0.807 1
1 927 . 20 1 1 A 80 80 ALA H H 80 8.000 7.639 0.361 1
1 928 . 20 1 1 A 80 80 ALA HA H 80 4.100 4.061 0.039 1
1 932 . 20 1 1 A 80 80 ALA C C 80 175.460 179.571 -4.111 1
1 933 . 20 1 1 A 80 80 ALA CA C 80 56.020 54.409 1.611 1
1 934 . 20 1 1 A 80 80 ALA CB C 80 18.040 18.183 -0.143 1
1 935 . 20 1 1 A 80 80 ALA N N 80 120.730 120.849 -0.119 1
1 936 . 20 1 1 A 81 81 LEU H H 81 8.460 7.644 0.816 1
1 937 . 20 1 1 A 81 81 LEU HA H 81 4.000 4.089 -0.089 1
1 941 . 20 1 1 A 81 81 LEU C C 81 177.030 179.115 -2.085 1
1 942 . 20 1 1 A 81 81 LEU CA C 81 57.640 57.206 0.434 1
1 943 . 20 1 1 A 81 81 LEU CB C 81 40.620 41.654 -1.034 1
1 945 . 20 1 1 A 81 81 LEU N N 81 119.890 119.103 0.787 1
1 946 . 20 1 1 A 82 82 THR H H 82 8.320 7.905 0.415 1
1 947 . 20 1 1 A 82 82 THR HA H 82 3.800 4.023 -0.223 1
1 952 . 20 1 1 A 82 82 THR C C 82 181.010 176.917 4.093 1
1 953 . 20 1 1 A 82 82 THR CA C 82 68.500 66.113 2.387 1
1 954 . 20 1 1 A 82 82 THR CB C 82 67.400 68.894 -1.494 1
1 956 . 20 1 1 A 82 82 THR N N 82 117.120 113.562 3.558 1
1 957 . 20 1 1 A 83 83 VAL H H 83 8.530 7.514 1.016 1
1 958 . 20 1 1 A 83 83 VAL HA H 83 3.890 3.828 0.062 1
1 966 . 20 1 1 A 83 83 VAL C C 83 178.120 178.186 -0.066 1
1 967 . 20 1 1 A 83 83 VAL CA C 83 67.400 65.128 2.272 1
1 968 . 20 1 1 A 83 83 VAL CB C 83 31.590 31.621 -0.031 1
1 971 . 20 1 1 A 83 83 VAL N N 83 119.760 118.085 1.675 1
1 972 . 20 1 1 A 84 84 ALA H H 84 7.910 8.544 -0.634 1
1 973 . 20 1 1 A 84 84 ALA HA H 84 4.060 4.023 0.037 1
1 977 . 20 1 1 A 84 84 ALA C C 84 180.560 179.880 0.680 1
1 978 . 20 1 1 A 84 84 ALA CA C 84 55.000 55.152 -0.152 1
1 979 . 20 1 1 A 84 84 ALA CB C 84 17.230 18.179 -0.949 1
1 980 . 20 1 1 A 84 84 ALA N N 84 122.620 124.436 -1.816 1
1 981 . 20 1 1 A 85 85 CYS H H 85 8.580 7.904 0.676 1
1 982 . 20 1 1 A 85 85 CYS HA H 85 4.080 4.437 -0.357 1
1 985 . 20 1 1 A 85 85 CYS C C 85 179.060 177.161 1.899 1
1 986 . 20 1 1 A 85 85 CYS CA C 85 63.210 61.509 1.701 1
1 987 . 20 1 1 A 85 85 CYS CB C 85 26.310 27.221 -0.911 1
1 988 . 20 1 1 A 85 85 CYS N N 85 118.730 117.352 1.378 1
1 989 . 20 1 1 A 86 86 ASN H H 86 8.430 8.047 0.383 1
1 990 . 20 1 1 A 86 86 ASN CA C 86 55.860 56.916 -1.056 1
1 991 . 20 1 1 A 86 86 ASN CB C 86 37.440 40.067 -2.627 1
1 992 . 20 1 1 A 86 86 ASN N N 86 119.360 119.430 -0.070 1
1 993 . 20 1 1 A 87 87 ASN H H 87 7.880 7.998 -0.118 1
1 994 . 20 1 1 A 87 87 ASN HA H 87 4.600 4.594 0.006 1
1 997 . 20 1 1 A 87 87 ASN C C 87 178.510 177.561 0.949 1
1 998 . 20 1 1 A 87 87 ASN CA C 87 56.470 56.864 -0.394 1
1 999 . 20 1 1 A 87 87 ASN CB C 87 37.500 38.182 -0.682 1
1 1000 . 20 1 1 A 87 87 ASN N N 87 119.480 117.152 2.328 1
1 1001 . 20 1 1 A 88 88 PHE H H 88 8.050 7.655 0.395 1
1 1002 . 20 1 1 A 88 88 PHE HA H 88 4.200 4.541 -0.341 1
1 1005 . 20 1 1 A 88 88 PHE C C 88 178.510 177.250 1.260 1
1 1006 . 20 1 1 A 88 88 PHE CA C 88 56.460 58.708 -2.248 1
1 1007 . 20 1 1 A 88 88 PHE CB C 88 38.500 38.589 -0.089 1
1 1008 . 20 1 1 A 88 88 PHE N N 88 120.280 117.266 3.014 1
1 1009 . 20 1 1 A 89 89 PHE H H 89 8.020 8.211 -0.191 1
1 1010 . 20 1 1 A 89 89 PHE HA H 89 4.000 4.180 -0.180 1
1 1013 . 20 1 1 A 89 89 PHE C C 89 177.340 177.241 0.099 1
1 1014 . 20 1 1 A 89 89 PHE CA C 89 59.000 61.069 -2.069 1
1 1015 . 20 1 1 A 89 89 PHE CB C 89 37.430 38.944 -1.514 1
1 1016 . 20 1 1 A 89 89 PHE N N 89 120.910 120.038 0.872 1
1 1017 . 20 1 1 A 90 90 TRP H H 90 7.800 7.691 0.109 1
1 1018 . 20 1 1 A 90 90 TRP HA H 90 4.460 4.697 -0.237 1
1 1021 . 20 1 1 A 90 90 TRP C C 90 177.340 178.089 -0.749 1
1 1022 . 20 1 1 A 90 90 TRP CA C 90 57.930 58.796 -0.866 1
1 1023 . 20 1 1 A 90 90 TRP CB C 90 42.000 29.236 12.764 1
1 1024 . 20 1 1 A 90 90 TRP N N 90 120.050 115.804 4.246 1
1 1025 . 20 1 1 A 91 91 GLU H H 91 7.800 8.602 -0.802 1
1 1026 . 20 1 1 A 91 91 GLU HA H 91 4.050 4.102 -0.052 1
1 1031 . 20 1 1 A 91 91 GLU C C 91 177.570 176.868 0.702 1
1 1032 . 20 1 1 A 91 91 GLU CA C 91 57.350 58.918 -1.568 1
1 1033 . 20 1 1 A 91 91 GLU CB C 91 29.530 28.995 0.535 1
1 1035 . 20 1 1 A 91 91 GLU N N 91 120.730 119.006 1.724 1
1 1036 . 20 1 1 A 92 92 ASN H H 92 7.800 7.843 -0.043 1
1 1037 . 20 1 1 A 92 92 ASN HA H 92 4.630 4.701 -0.071 1
1 1040 . 20 1 1 A 92 92 ASN C C 92 174.450 175.815 -1.365 1
1 1041 . 20 1 1 A 92 92 ASN CA C 92 52.960 51.714 1.246 1
1 1042 . 20 1 1 A 92 92 ASN CB C 92 29.530 36.766 -7.236 1
1 1043 . 20 1 1 A 92 92 ASN N N 92 119.410 118.708 0.702 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 88 1.427 1
2 1 1 1 "RMS(OBS, PRED)" CA 91 1.466 1
3 1 1 1 "RMS(OBS, PRED)" CB 87 2.467 1
4 1 1 1 "RMS(OBS, PRED)" H 91 0.588 1
5 1 1 1 "RMS(OBS, PRED)" HA 94 0.260 1
6 1 1 1 "RMS(OBS, PRED)" N 91 3.187 1
7 1 2 1 "RMS(OBS, PRED)" C 88 1.452 1
8 1 2 1 "RMS(OBS, PRED)" CA 91 1.458 1
9 1 2 1 "RMS(OBS, PRED)" CB 87 2.571 1
10 1 2 1 "RMS(OBS, PRED)" H 91 0.625 1
11 1 2 1 "RMS(OBS, PRED)" HA 94 0.293 1
12 1 2 1 "RMS(OBS, PRED)" N 91 3.192 1
13 1 3 1 "RMS(OBS, PRED)" C 88 1.452 1
14 1 3 1 "RMS(OBS, PRED)" CA 91 1.471 1
15 1 3 1 "RMS(OBS, PRED)" CB 87 2.642 1
16 1 3 1 "RMS(OBS, PRED)" H 91 0.648 1
17 1 3 1 "RMS(OBS, PRED)" HA 94 0.301 1
18 1 3 1 "RMS(OBS, PRED)" N 91 3.167 1
19 1 4 1 "RMS(OBS, PRED)" C 88 1.422 1
20 1 4 1 "RMS(OBS, PRED)" CA 91 1.436 1
21 1 4 1 "RMS(OBS, PRED)" CB 87 2.440 1
22 1 4 1 "RMS(OBS, PRED)" H 91 0.581 1
23 1 4 1 "RMS(OBS, PRED)" HA 94 0.269 1
24 1 4 1 "RMS(OBS, PRED)" N 91 3.149 1
25 1 5 1 "RMS(OBS, PRED)" C 88 1.433 1
26 1 5 1 "RMS(OBS, PRED)" CA 91 1.403 1
27 1 5 1 "RMS(OBS, PRED)" CB 87 2.418 1
28 1 5 1 "RMS(OBS, PRED)" H 91 0.612 1
29 1 5 1 "RMS(OBS, PRED)" HA 94 0.261 1
30 1 5 1 "RMS(OBS, PRED)" N 91 3.368 1
31 1 6 1 "RMS(OBS, PRED)" C 88 1.471 1
32 1 6 1 "RMS(OBS, PRED)" CA 91 1.461 1
33 1 6 1 "RMS(OBS, PRED)" CB 87 2.554 1
34 1 6 1 "RMS(OBS, PRED)" H 91 0.669 1
35 1 6 1 "RMS(OBS, PRED)" HA 94 0.302 1
36 1 6 1 "RMS(OBS, PRED)" N 91 3.229 1
37 1 7 1 "RMS(OBS, PRED)" C 88 1.445 1
38 1 7 1 "RMS(OBS, PRED)" CA 91 1.471 1
39 1 7 1 "RMS(OBS, PRED)" CB 87 2.608 1
40 1 7 1 "RMS(OBS, PRED)" H 91 0.602 1
41 1 7 1 "RMS(OBS, PRED)" HA 94 0.294 1
42 1 7 1 "RMS(OBS, PRED)" N 91 3.274 1
43 1 8 1 "RMS(OBS, PRED)" C 88 1.525 1
44 1 8 1 "RMS(OBS, PRED)" CA 91 1.545 1
45 1 8 1 "RMS(OBS, PRED)" CB 87 2.529 1
46 1 8 1 "RMS(OBS, PRED)" H 91 0.662 1
47 1 8 1 "RMS(OBS, PRED)" HA 94 0.292 1
48 1 8 1 "RMS(OBS, PRED)" N 91 3.475 1
49 1 9 1 "RMS(OBS, PRED)" C 88 1.420 1
50 1 9 1 "RMS(OBS, PRED)" CA 91 1.451 1
51 1 9 1 "RMS(OBS, PRED)" CB 87 2.408 1
52 1 9 1 "RMS(OBS, PRED)" H 91 0.632 1
53 1 9 1 "RMS(OBS, PRED)" HA 94 0.298 1
54 1 9 1 "RMS(OBS, PRED)" N 91 3.258 1
55 1 10 1 "RMS(OBS, PRED)" C 88 1.424 1
56 1 10 1 "RMS(OBS, PRED)" CA 91 1.469 1
57 1 10 1 "RMS(OBS, PRED)" CB 87 2.534 1
58 1 10 1 "RMS(OBS, PRED)" H 91 0.633 1
59 1 10 1 "RMS(OBS, PRED)" HA 94 0.300 1
60 1 10 1 "RMS(OBS, PRED)" N 91 3.232 1
61 1 11 1 "RMS(OBS, PRED)" C 88 1.451 1
62 1 11 1 "RMS(OBS, PRED)" CA 91 1.575 1
63 1 11 1 "RMS(OBS, PRED)" CB 87 2.567 1
64 1 11 1 "RMS(OBS, PRED)" H 91 0.707 1
65 1 11 1 "RMS(OBS, PRED)" HA 94 0.347 1
66 1 11 1 "RMS(OBS, PRED)" N 91 3.264 1
67 1 12 1 "RMS(OBS, PRED)" C 88 1.427 1
68 1 12 1 "RMS(OBS, PRED)" CA 91 1.423 1
69 1 12 1 "RMS(OBS, PRED)" CB 87 2.559 1
70 1 12 1 "RMS(OBS, PRED)" H 91 0.626 1
71 1 12 1 "RMS(OBS, PRED)" HA 94 0.306 1
72 1 12 1 "RMS(OBS, PRED)" N 91 3.226 1
73 1 13 1 "RMS(OBS, PRED)" C 88 1.455 1
74 1 13 1 "RMS(OBS, PRED)" CA 91 1.624 1
75 1 13 1 "RMS(OBS, PRED)" CB 87 2.563 1
76 1 13 1 "RMS(OBS, PRED)" H 91 0.614 1
77 1 13 1 "RMS(OBS, PRED)" HA 94 0.338 1
78 1 13 1 "RMS(OBS, PRED)" N 91 3.220 1
79 1 14 1 "RMS(OBS, PRED)" C 88 1.468 1
80 1 14 1 "RMS(OBS, PRED)" CA 91 1.446 1
81 1 14 1 "RMS(OBS, PRED)" CB 87 2.498 1
82 1 14 1 "RMS(OBS, PRED)" H 91 0.644 1
83 1 14 1 "RMS(OBS, PRED)" HA 94 0.352 1
84 1 14 1 "RMS(OBS, PRED)" N 91 2.987 1
85 1 15 1 "RMS(OBS, PRED)" C 88 1.427 1
86 1 15 1 "RMS(OBS, PRED)" CA 91 1.521 1
87 1 15 1 "RMS(OBS, PRED)" CB 87 2.670 1
88 1 15 1 "RMS(OBS, PRED)" H 91 0.684 1
89 1 15 1 "RMS(OBS, PRED)" HA 94 0.304 1
90 1 15 1 "RMS(OBS, PRED)" N 91 3.210 1
91 1 16 1 "RMS(OBS, PRED)" C 88 1.424 1
92 1 16 1 "RMS(OBS, PRED)" CA 91 1.535 1
93 1 16 1 "RMS(OBS, PRED)" CB 87 2.568 1
94 1 16 1 "RMS(OBS, PRED)" H 91 0.657 1
95 1 16 1 "RMS(OBS, PRED)" HA 94 0.328 1
96 1 16 1 "RMS(OBS, PRED)" N 91 3.302 1
97 1 17 1 "RMS(OBS, PRED)" C 88 1.440 1
98 1 17 1 "RMS(OBS, PRED)" CA 91 1.500 1
99 1 17 1 "RMS(OBS, PRED)" CB 87 2.555 1
100 1 17 1 "RMS(OBS, PRED)" H 91 0.585 1
101 1 17 1 "RMS(OBS, PRED)" HA 94 0.312 1
102 1 17 1 "RMS(OBS, PRED)" N 91 3.147 1
103 1 18 1 "RMS(OBS, PRED)" C 88 1.455 1
104 1 18 1 "RMS(OBS, PRED)" CA 91 1.441 1
105 1 18 1 "RMS(OBS, PRED)" CB 87 2.705 1
106 1 18 1 "RMS(OBS, PRED)" H 91 0.649 1
107 1 18 1 "RMS(OBS, PRED)" HA 94 0.321 1
108 1 18 1 "RMS(OBS, PRED)" N 91 3.296 1
109 1 19 1 "RMS(OBS, PRED)" C 88 1.372 1
110 1 19 1 "RMS(OBS, PRED)" CA 91 1.417 1
111 1 19 1 "RMS(OBS, PRED)" CB 87 2.536 1
112 1 19 1 "RMS(OBS, PRED)" H 91 0.598 1
113 1 19 1 "RMS(OBS, PRED)" HA 94 0.313 1
114 1 19 1 "RMS(OBS, PRED)" N 91 3.427 1
115 1 20 1 "RMS(OBS, PRED)" C 88 1.477 1
116 1 20 1 "RMS(OBS, PRED)" CA 91 1.514 1
117 1 20 1 "RMS(OBS, PRED)" CB 87 2.550 1
118 1 20 1 "RMS(OBS, PRED)" H 91 0.629 1
119 1 20 1 "RMS(OBS, PRED)" HA 94 0.342 1
120 1 20 1 "RMS(OBS, PRED)" N 91 3.061 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 5 . 1 1 A 2 2 SER H H 2 9.000 8.276 0.724 2
1 6 . 1 1 A 2 2 SER HA H 2 4.690 4.616 0.074 2
1 9 . 1 1 A 2 2 SER C C 2 176.170 175.237 0.933 2
1 10 . 1 1 A 2 2 SER CA C 2 57.340 58.049 -0.709 2
1 11 . 1 1 A 2 2 SER CB C 2 65.550 64.112 1.438 2
1 12 . 1 1 A 2 2 SER N N 2 119.330 115.789 3.541 2
1 13 . 1 1 A 3 3 GLU H H 3 9.350 8.819 0.531 2
1 14 . 1 1 A 3 3 GLU HA H 3 4.060 4.016 0.045 2
1 17 . 1 1 A 3 3 GLU C C 3 180.150 178.752 1.398 2
1 18 . 1 1 A 3 3 GLU CA C 3 60.280 59.337 0.943 2
1 19 . 1 1 A 3 3 GLU CB C 3 29.230 29.371 -0.141 2
1 21 . 1 1 A 3 3 GLU N N 3 125.350 123.072 2.278 2
1 22 . 1 1 A 4 4 LEU H H 4 9.060 8.241 0.819 2
1 23 . 1 1 A 4 4 LEU HA H 4 4.080 4.032 0.049 2
1 33 . 1 1 A 4 4 LEU C C 4 177.890 178.957 -1.067 2
1 34 . 1 1 A 4 4 LEU CA C 4 58.090 57.970 0.120 2
1 35 . 1 1 A 4 4 LEU CB C 4 42.120 41.509 0.611 2
1 39 . 1 1 A 4 4 LEU N N 4 121.090 120.653 0.437 2
1 40 . 1 1 A 5 5 GLU H H 5 8.340 8.280 0.060 2
1 41 . 1 1 A 5 5 GLU HA H 5 4.050 3.947 0.102 2
1 46 . 1 1 A 5 5 GLU C C 5 177.030 179.174 -2.144 2
1 47 . 1 1 A 5 5 GLU CA C 5 59.840 59.465 0.375 2
1 48 . 1 1 A 5 5 GLU CB C 5 28.940 29.242 -0.302 2
1 50 . 1 1 A 5 5 GLU N N 5 119.780 119.364 0.416 2
1 51 . 1 1 A 6 6 THR H H 6 8.370 8.303 0.067 2
1 52 . 1 1 A 6 6 THR HA H 6 4.310 3.902 0.408 2
1 57 . 1 1 A 6 6 THR C C 6 177.340 176.965 0.375 2
1 58 . 1 1 A 6 6 THR CA C 6 66.630 66.281 0.349 2
1 59 . 1 1 A 6 6 THR CB C 6 68.650 68.620 0.030 2
1 61 . 1 1 A 6 6 THR N N 6 116.940 116.903 0.036 2
1 62 . 1 1 A 7 7 ALA H H 7 8.270 7.796 0.474 2
1 63 . 1 1 A 7 7 ALA HA H 7 4.190 4.179 0.011 2
1 67 . 1 1 A 7 7 ALA C C 7 179.760 179.541 0.219 2
1 68 . 1 1 A 7 7 ALA CA C 7 55.880 55.111 0.769 2
1 69 . 1 1 A 7 7 ALA CB C 7 17.720 18.115 -0.395 2
1 70 . 1 1 A 7 7 ALA N N 7 127.400 124.044 3.356 2
1 71 . 1 1 A 8 8 MET H H 8 8.110 7.740 0.370 2
1 72 . 1 1 A 8 8 MET HA H 8 4.020 4.205 -0.185 2
1 80 . 1 1 A 8 8 MET C C 8 178.510 178.185 0.324 2
1 81 . 1 1 A 8 8 MET CA C 8 60.580 58.187 2.393 2
1 82 . 1 1 A 8 8 MET CB C 8 33.630 32.400 1.230 2
1 85 . 1 1 A 8 8 MET N N 8 117.520 117.877 -0.357 2
1 86 . 1 1 A 9 9 GLU H H 9 8.210 7.809 0.401 2
1 87 . 1 1 A 9 9 GLU HA H 9 3.830 4.117 -0.286 2
1 92 . 1 1 A 9 9 GLU C C 9 179.140 178.785 0.355 2
1 93 . 1 1 A 9 9 GLU CA C 9 59.690 59.193 0.497 2
1 94 . 1 1 A 9 9 GLU CB C 9 29.530 29.071 0.459 2
1 96 . 1 1 A 9 9 GLU N N 9 118.560 118.474 0.086 2
1 97 . 1 1 A 10 10 THR H H 10 8.490 7.621 0.869 2
1 98 . 1 1 A 10 10 THR HA H 10 4.000 4.025 -0.025 2
1 103 . 1 1 A 10 10 THR C C 10 176.010 176.473 -0.463 2
1 104 . 1 1 A 10 10 THR CA C 10 67.110 66.227 0.883 2
1 105 . 1 1 A 10 10 THR CB C 10 67.770 68.804 -1.034 2
1 107 . 1 1 A 10 10 THR N N 10 118.310 116.102 2.208 2
1 108 . 1 1 A 11 11 LEU H H 11 7.920 7.804 0.116 2
1 109 . 1 1 A 11 11 LEU HA H 11 3.930 3.870 0.060 2
1 119 . 1 1 A 11 11 LEU C C 11 178.820 179.024 -0.204 2
1 120 . 1 1 A 11 11 LEU CA C 11 59.690 58.106 1.584 2
1 121 . 1 1 A 11 11 LEU CB C 11 41.920 41.548 0.372 2
1 125 . 1 1 A 11 11 LEU N N 11 121.150 120.982 0.168 2
1 126 . 1 1 A 12 12 ILE H H 12 7.440 7.716 -0.276 2
1 127 . 1 1 A 12 12 ILE HA H 12 3.640 3.592 0.048 2
1 137 . 1 1 A 12 12 ILE C C 12 179.530 178.661 0.869 2
1 138 . 1 1 A 12 12 ILE CA C 12 63.740 65.027 -1.287 2
1 139 . 1 1 A 12 12 ILE CB C 12 38.800 37.490 1.310 2
1 143 . 1 1 A 12 12 ILE N N 12 118.010 120.251 -2.241 2
1 144 . 1 1 A 13 13 ASN H H 13 8.930 8.201 0.729 2
1 145 . 1 1 A 13 13 ASN HA H 13 4.520 4.607 -0.087 2
1 148 . 1 1 A 13 13 ASN C C 13 179.450 177.613 1.837 2
1 149 . 1 1 A 13 13 ASN CA C 13 56.470 56.173 0.297 2
1 150 . 1 1 A 13 13 ASN CB C 13 37.930 38.754 -0.824 2
1 151 . 1 1 A 13 13 ASN N N 13 121.820 119.779 2.041 2
1 152 . 1 1 A 14 14 VAL H H 14 9.180 8.078 1.102 2
1 153 . 1 1 A 14 14 VAL HA H 14 3.830 3.846 -0.016 2
1 161 . 1 1 A 14 14 VAL CA C 14 65.840 65.364 0.477 2
1 162 . 1 1 A 14 14 VAL CB C 14 31.290 31.481 -0.191 2
1 165 . 1 1 A 14 14 VAL N N 14 122.040 118.472 3.568 2
1 166 . 1 1 A 15 15 PHE H H 15 7.590 8.099 -0.509 2
1 167 . 1 1 A 15 15 PHE HA H 15 3.360 4.062 -0.702 2
1 170 . 1 1 A 15 15 PHE C C 15 177.890 177.816 0.074 2
1 171 . 1 1 A 15 15 PHE CA C 15 62.030 61.268 0.762 2
1 172 . 1 1 A 15 15 PHE CB C 15 38.900 38.706 0.194 2
1 173 . 1 1 A 15 15 PHE N N 15 118.290 121.838 -3.548 2
1 174 . 1 1 A 16 16 HIS H H 16 7.790 7.958 -0.168 2
1 175 . 1 1 A 16 16 HIS HA H 16 4.890 4.312 0.578 2
1 178 . 1 1 A 16 16 HIS C C 16 177.810 177.198 0.612 2
1 179 . 1 1 A 16 16 HIS CA C 16 59.100 59.871 -0.771 2
1 180 . 1 1 A 16 16 HIS CB C 16 28.060 29.281 -1.221 2
1 181 . 1 1 A 16 16 HIS N N 16 118.290 118.264 0.026 2
1 182 . 1 1 A 17 17 ALA H H 17 8.040 7.891 0.149 2
1 183 . 1 1 A 17 17 ALA HA H 17 4.050 3.883 0.167 2
1 187 . 1 1 A 17 17 ALA C C 17 179.600 179.760 -0.160 2
1 188 . 1 1 A 17 17 ALA CA C 17 54.000 55.211 -1.211 2
1 189 . 1 1 A 17 17 ALA CB C 17 17.520 18.603 -1.083 2
1 190 . 1 1 A 17 17 ALA N N 17 124.410 121.270 3.140 2
1 191 . 1 1 A 18 18 HIS H H 18 7.000 7.492 -0.492 2
1 192 . 1 1 A 18 18 HIS HA H 18 4.330 4.296 0.034 2
1 195 . 1 1 A 18 18 HIS C C 18 176.320 177.839 -1.519 2
1 196 . 1 1 A 18 18 HIS CA C 18 57.350 59.235 -1.885 2
1 197 . 1 1 A 18 18 HIS CB C 18 32.920 30.126 2.794 2
1 198 . 1 1 A 18 18 HIS N N 18 115.160 116.170 -1.010 2
1 199 . 1 1 A 19 19 SER H H 19 8.380 8.051 0.329 2
1 200 . 1 1 A 19 19 SER HA H 19 3.640 4.082 -0.441 2
1 203 . 1 1 A 19 19 SER C C 19 177.340 175.859 1.481 2
1 204 . 1 1 A 19 19 SER CA C 19 60.160 61.452 -1.292 2
1 205 . 1 1 A 19 19 SER CB C 19 61.000 62.339 -1.339 2
1 206 . 1 1 A 19 19 SER N N 19 114.380 115.487 -1.107 2
1 207 . 1 1 A 20 20 GLY H H 20 7.600 7.689 -0.089 2
1 208 . 1 1 A 20 20 GLY HA2 H 20 3.680 3.788 -0.108 2
1 209 . 1 1 A 20 20 GLY HA3 H 20 4.000 3.885 0.115 2
1 210 . 1 1 A 20 20 GLY C C 20 174.140 174.294 -0.154 2
1 211 . 1 1 A 20 20 GLY CA C 20 47.000 45.192 1.808 2
1 212 . 1 1 A 20 20 GLY N N 20 112.550 108.121 4.429 2
1 213 . 1 1 A 21 21 LYS H H 21 7.230 7.645 -0.415 2
1 214 . 1 1 A 21 21 LYS HA H 21 3.860 4.418 -0.558 2
1 223 . 1 1 A 21 21 LYS C C 21 177.730 177.336 0.394 2
1 224 . 1 1 A 21 21 LYS CA C 21 59.110 57.010 2.100 2
1 225 . 1 1 A 21 21 LYS CB C 21 32.460 34.596 -2.136 2
1 229 . 1 1 A 21 21 LYS N N 21 123.240 118.538 4.702 2
1 230 . 1 1 A 22 22 GLU H H 22 9.350 7.994 1.356 2
1 231 . 1 1 A 22 22 GLU HA H 22 4.610 4.337 0.273 2
1 236 . 1 1 A 22 22 GLU C C 22 177.420 175.984 1.436 2
1 237 . 1 1 A 22 22 GLU CA C 22 53.700 56.332 -2.632 2
1 238 . 1 1 A 22 22 GLU CB C 22 32.000 29.234 2.766 2
1 240 . 1 1 A 22 22 GLU N N 22 116.770 117.598 -0.828 2
1 241 . 1 1 A 23 23 GLY H H 23 7.570 7.685 -0.115 2
1 242 . 1 1 A 23 23 GLY HA2 H 23 3.630 4.035 -0.405 2
1 243 . 1 1 A 23 23 GLY HA3 H 23 3.880 4.050 -0.170 2
1 244 . 1 1 A 23 23 GLY C C 23 173.980 171.789 2.191 2
1 245 . 1 1 A 23 23 GLY CA C 23 45.250 45.537 -0.287 2
1 246 . 1 1 A 23 23 GLY N N 23 112.180 108.169 4.011 2
1 247 . 1 1 A 24 24 ASP H H 24 8.680 8.402 0.278 2
1 248 . 1 1 A 24 24 ASP HA H 24 4.380 4.633 -0.254 2
1 251 . 1 1 A 24 24 ASP C C 24 178.590 177.550 1.040 2
1 252 . 1 1 A 24 24 ASP CA C 24 60.000 54.083 5.917 2
1 253 . 1 1 A 24 24 ASP CB C 24 27.480 41.769 -14.289 2
1 254 . 1 1 A 24 24 ASP N N 24 127.470 121.505 5.965 2
1 255 . 1 1 A 25 25 LYS H H 25 9.270 8.705 0.565 2
1 256 . 1 1 A 25 25 LYS HA H 25 4.250 3.880 0.370 2
1 265 . 1 1 A 25 25 LYS C C 25 177.030 176.966 0.064 2
1 266 . 1 1 A 25 25 LYS CA C 25 60.000 59.563 0.437 2
1 267 . 1 1 A 25 25 LYS CB C 25 31.170 32.292 -1.122 2
1 271 . 1 1 A 25 25 LYS N N 25 132.960 123.404 9.556 2
1 272 . 1 1 A 26 26 TYR H H 26 9.430 7.800 1.630 2
1 273 . 1 1 A 26 26 TYR HA H 26 4.640 4.831 -0.191 2
1 276 . 1 1 A 26 26 TYR C C 26 174.290 174.673 -0.383 2
1 277 . 1 1 A 26 26 TYR CA C 26 56.010 57.492 -1.482 2
1 278 . 1 1 A 26 26 TYR CB C 26 37.730 39.121 -1.391 2
1 279 . 1 1 A 26 26 TYR N N 26 120.650 116.290 4.360 2
1 280 . 1 1 A 27 27 LYS H H 27 7.110 7.322 -0.212 2
1 281 . 1 1 A 27 27 LYS HA H 27 5.110 5.016 0.094 2
1 290 . 1 1 A 27 27 LYS C C 27 175.150 173.998 1.152 2
1 291 . 1 1 A 27 27 LYS CA C 27 55.070 55.098 -0.028 2
1 292 . 1 1 A 27 27 LYS CB C 27 38.900 36.167 2.733 2
1 296 . 1 1 A 27 27 LYS N N 27 115.830 121.065 -5.235 2
1 297 . 1 1 A 28 28 LEU H H 28 9.820 8.492 1.328 2
1 298 . 1 1 A 28 28 LEU HA H 28 5.080 4.857 0.223 2
1 308 . 1 1 A 28 28 LEU C C 28 176.640 175.545 1.095 2
1 309 . 1 1 A 28 28 LEU CA C 28 52.660 53.856 -1.196 2
1 310 . 1 1 A 28 28 LEU CB C 28 42.710 43.866 -1.156 2
1 314 . 1 1 A 28 28 LEU N N 28 126.930 127.608 -0.678 2
1 315 . 1 1 A 29 29 SER H H 29 9.890 8.697 1.193 2
1 316 . 1 1 A 29 29 SER HA H 29 4.530 4.852 -0.322 2
1 319 . 1 1 A 29 29 SER C C 29 174.990 175.005 -0.015 2
1 320 . 1 1 A 29 29 SER CA C 29 56.180 56.875 -0.695 2
1 321 . 1 1 A 29 29 SER CB C 29 65.550 65.757 -0.207 2
1 322 . 1 1 A 29 29 SER N N 29 121.600 119.857 1.743 2
1 323 . 1 1 A 30 30 LYS H H 30 8.850 8.878 -0.028 2
1 324 . 1 1 A 30 30 LYS HA H 30 3.850 3.962 -0.112 2
1 333 . 1 1 A 30 30 LYS C C 30 175.620 177.799 -2.179 2
1 334 . 1 1 A 30 30 LYS CA C 30 60.860 60.071 0.790 2
1 335 . 1 1 A 30 30 LYS CB C 30 31.290 32.149 -0.859 2
1 339 . 1 1 A 30 30 LYS N N 30 121.260 124.999 -3.739 2
1 340 . 1 1 A 31 31 LYS H H 31 7.970 7.952 0.018 2
1 341 . 1 1 A 31 31 LYS HA H 31 3.880 4.050 -0.170 2
1 350 . 1 1 A 31 31 LYS C C 31 179.290 179.133 0.157 2
1 351 . 1 1 A 31 31 LYS CA C 31 59.110 59.112 -0.002 2
1 352 . 1 1 A 31 31 LYS CB C 31 32.640 31.793 0.847 2
1 356 . 1 1 A 31 31 LYS N N 31 121.260 118.501 2.759 2
1 357 . 1 1 A 32 32 GLU H H 32 7.510 8.134 -0.624 2
1 358 . 1 1 A 32 32 GLU HA H 32 3.830 4.089 -0.259 2
1 363 . 1 1 A 32 32 GLU C C 32 179.290 179.506 -0.216 2
1 364 . 1 1 A 32 32 GLU CA C 32 58.590 58.899 -0.309 2
1 365 . 1 1 A 32 32 GLU CB C 32 30.120 29.854 0.266 2
1 367 . 1 1 A 32 32 GLU N N 32 120.090 119.436 0.655 2
1 368 . 1 1 A 33 33 LEU H H 33 8.970 7.791 1.179 2
1 369 . 1 1 A 33 33 LEU HA H 33 3.830 3.815 0.015 2
1 379 . 1 1 A 33 33 LEU C C 33 178.200 178.775 -0.575 2
1 380 . 1 1 A 33 33 LEU CA C 33 57.930 57.998 -0.068 2
1 381 . 1 1 A 33 33 LEU CB C 33 40.660 41.497 -0.837 2
1 385 . 1 1 A 33 33 LEU N N 33 120.200 119.320 0.880 2
1 386 . 1 1 A 34 34 LYS H H 34 8.230 7.649 0.581 2
1 387 . 1 1 A 34 34 LYS HA H 34 3.550 3.878 -0.328 2
1 396 . 1 1 A 34 34 LYS C C 34 178.040 178.475 -0.435 2
1 397 . 1 1 A 34 34 LYS CA C 34 60.720 59.710 1.010 2
1 398 . 1 1 A 34 34 LYS CB C 34 31.980 32.036 -0.056 2
1 402 . 1 1 A 34 34 LYS N N 34 120.780 119.112 1.668 2
1 403 . 1 1 A 35 35 ASP H H 35 7.990 7.807 0.183 2
1 404 . 1 1 A 35 35 ASP HA H 35 4.250 4.432 -0.182 2
1 407 . 1 1 A 35 35 ASP C C 35 179.060 178.527 0.533 2
1 408 . 1 1 A 35 35 ASP CA C 35 56.830 57.149 -0.319 2
1 409 . 1 1 A 35 35 ASP CB C 35 40.440 40.634 -0.194 2
1 410 . 1 1 A 35 35 ASP N N 35 119.550 119.536 0.014 2
1 411 . 1 1 A 36 36 LEU H H 36 8.130 7.620 0.510 2
1 412 . 1 1 A 36 36 LEU HA H 36 2.580 3.606 -1.026 2
1 422 . 1 1 A 36 36 LEU C C 36 179.450 178.699 0.751 2
1 423 . 1 1 A 36 36 LEU CA C 36 59.980 57.935 2.045 2
1 424 . 1 1 A 36 36 LEU CB C 36 42.180 41.433 0.747 2
1 428 . 1 1 A 36 36 LEU N N 36 125.560 121.019 4.541 2
1 429 . 1 1 A 37 37 LEU H H 37 8.740 7.855 0.885 2
1 430 . 1 1 A 37 37 LEU HA H 37 3.580 3.998 -0.418 2
1 440 . 1 1 A 37 37 LEU C C 37 179.290 179.246 0.043 2
1 441 . 1 1 A 37 37 LEU CA C 37 58.230 58.062 0.168 2
1 442 . 1 1 A 37 37 LEU CB C 37 41.590 41.135 0.456 2
1 446 . 1 1 A 37 37 LEU N N 37 120.520 118.607 1.913 2
1 447 . 1 1 A 38 38 GLN H H 38 8.520 8.056 0.464 2
1 448 . 1 1 A 38 38 GLN HA H 38 4.000 4.041 -0.041 2
1 453 . 1 1 A 38 38 GLN C C 38 177.960 178.324 -0.364 2
1 454 . 1 1 A 38 38 GLN CA C 38 58.210 58.470 -0.260 2
1 455 . 1 1 A 38 38 GLN CB C 38 28.650 28.005 0.646 2
1 457 . 1 1 A 38 38 GLN N N 38 116.740 118.149 -1.409 2
1 458 . 1 1 A 39 39 THR H H 39 7.910 7.874 0.036 2
1 459 . 1 1 A 39 39 THR HA H 39 4.210 3.853 0.357 2
1 464 . 1 1 A 39 39 THR C C 39 177.180 175.786 1.394 2
1 465 . 1 1 A 39 39 THR CA C 39 64.730 66.914 -2.184 2
1 466 . 1 1 A 39 39 THR CB C 39 69.650 68.698 0.952 2
1 468 . 1 1 A 39 39 THR N N 39 111.400 116.862 -5.462 2
1 469 . 1 1 A 40 40 GLU H H 40 8.590 7.778 0.812 2
1 470 . 1 1 A 40 40 GLU HA H 40 4.680 4.463 0.216 2
1 475 . 1 1 A 40 40 GLU C C 40 178.280 177.229 1.051 2
1 476 . 1 1 A 40 40 GLU CA C 40 55.880 56.755 -0.875 2
1 477 . 1 1 A 40 40 GLU CB C 40 30.990 30.746 0.244 2
1 479 . 1 1 A 40 40 GLU N N 40 117.840 117.099 0.741 2
1 480 . 1 1 A 41 41 LEU H H 41 7.680 7.646 0.034 2
1 481 . 1 1 A 41 41 LEU HA H 41 5.080 4.818 0.262 2
1 491 . 1 1 A 41 41 LEU C C 41 179.450 177.088 2.362 2
1 492 . 1 1 A 41 41 LEU CA C 41 53.830 53.851 -0.021 2
1 493 . 1 1 A 41 41 LEU CB C 41 41.360 42.681 -1.321 2
1 497 . 1 1 A 41 41 LEU N N 41 121.410 119.331 2.079 2
1 498 . 1 1 A 42 42 SER H H 42 8.380 8.120 0.260 2
1 499 . 1 1 A 42 42 SER HA H 42 4.130 4.120 0.010 2
1 502 . 1 1 A 42 42 SER C C 42 176.640 176.876 -0.236 2
1 503 . 1 1 A 42 42 SER CA C 42 61.280 61.720 -0.440 2
1 504 . 1 1 A 42 42 SER CB C 42 63.040 62.820 0.220 2
1 505 . 1 1 A 42 42 SER N N 42 117.420 116.955 0.465 2
1 506 . 1 1 A 43 43 SER H H 43 8.900 8.229 0.671 2
1 507 . 1 1 A 43 43 SER HA H 43 4.290 4.296 -0.006 2
1 510 . 1 1 A 43 43 SER C C 43 175.620 176.803 -1.183 2
1 511 . 1 1 A 43 43 SER CA C 43 60.860 61.320 -0.460 2
1 512 . 1 1 A 43 43 SER CB C 43 62.910 63.097 -0.187 2
1 513 . 1 1 A 43 43 SER N N 43 117.580 116.514 1.066 2
1 514 . 1 1 A 44 44 PHE H H 44 7.880 8.059 -0.179 2
1 515 . 1 1 A 44 44 PHE HA H 44 4.240 4.234 0.006 2
1 518 . 1 1 A 44 44 PHE C C 44 176.950 175.645 1.305 2
1 519 . 1 1 A 44 44 PHE CA C 44 62.710 61.109 1.601 2
1 520 . 1 1 A 44 44 PHE CB C 44 39.020 39.078 -0.058 2
1 521 . 1 1 A 44 44 PHE N N 44 119.480 122.201 -2.721 2
1 522 . 1 1 A 45 45 LEU H H 45 8.060 7.929 0.131 2
1 523 . 1 1 A 45 45 LEU HA H 45 3.810 3.805 0.005 2
1 533 . 1 1 A 45 45 LEU C C 45 177.500 176.134 1.366 2
1 534 . 1 1 A 45 45 LEU CA C 45 59.980 55.594 4.386 2
1 535 . 1 1 A 45 45 LEU CB C 45 39.640 42.301 -2.661 2
1 538 . 1 1 A 45 45 LEU N N 45 118.010 121.572 -3.562 2
1 539 . 1 1 A 46 46 ASP H H 46 8.150 8.555 -0.405 2
1 540 . 1 1 A 46 46 ASP HA H 46 4.470 4.750 -0.280 2
1 543 . 1 1 A 46 46 ASP C C 46 179.920 175.801 4.119 2
1 544 . 1 1 A 46 46 ASP CA C 46 52.950 53.420 -0.470 2
1 545 . 1 1 A 46 46 ASP CB C 46 40.000 41.038 -1.038 2
1 546 . 1 1 A 46 46 ASP N N 46 119.460 124.608 -5.148 2
1 547 . 1 1 A 47 47 VAL H H 47 8.010 8.441 -0.431 2
1 548 . 1 1 A 47 47 VAL HA H 47 3.800 4.352 -0.552 2
1 556 . 1 1 A 47 47 VAL C C 47 175.460 176.944 -1.484 2
1 557 . 1 1 A 47 47 VAL CA C 47 60.000 62.814 -2.814 2
1 558 . 1 1 A 47 47 VAL CB C 47 31.580 33.387 -1.807 2
1 561 . 1 1 A 47 47 VAL N N 47 117.720 121.072 -3.352 2
1 562 . 1 1 A 48 48 GLN H H 48 7.960 8.520 -0.560 2
1 563 . 1 1 A 48 48 GLN HA H 48 4.060 4.103 -0.043 2
1 568 . 1 1 A 48 48 GLN C C 48 179.370 178.395 0.975 2
1 569 . 1 1 A 48 48 GLN CA C 48 57.350 58.543 -1.193 2
1 570 . 1 1 A 48 48 GLN CB C 48 28.990 28.689 0.301 2
1 572 . 1 1 A 48 48 GLN N N 48 119.900 121.307 -1.407 2
1 573 . 1 1 A 49 49 LYS H H 49 7.810 7.929 -0.119 2
1 574 . 1 1 A 49 49 LYS HA H 49 3.860 4.124 -0.264 2
1 583 . 1 1 A 49 49 LYS C C 49 177.890 176.506 1.384 2
1 584 . 1 1 A 49 49 LYS CA C 49 58.230 58.730 -0.501 2
1 585 . 1 1 A 49 49 LYS CB C 49 30.990 32.326 -1.336 2
1 587 . 1 1 A 49 49 LYS N N 49 120.030 119.165 0.865 2
1 588 . 1 1 A 50 50 ASP H H 50 7.570 7.798 -0.228 2
1 589 . 1 1 A 50 50 ASP HA H 50 4.700 4.849 -0.149 2
1 590 . 1 1 A 50 50 ASP CA C 50 52.950 52.927 0.023 2
1 591 . 1 1 A 50 50 ASP CB C 50 38.900 40.846 -1.946 2
1 592 . 1 1 A 50 50 ASP N N 50 116.730 118.807 -2.077 2
1 593 . 1 1 A 51 51 ALA H H 51 7.570 8.755 -1.185 2
1 594 . 1 1 A 51 51 ALA HA H 51 4.200 3.986 0.214 2
1 598 . 1 1 A 51 51 ALA C C 51 179.760 179.282 0.478 2
1 599 . 1 1 A 51 51 ALA CA C 51 54.200 55.327 -1.127 2
1 600 . 1 1 A 51 51 ALA CB C 51 18.110 18.417 -0.307 2
1 601 . 1 1 A 51 51 ALA N N 51 118.390 127.681 -9.291 2
1 602 . 1 1 A 52 52 ASP H H 52 8.430 8.281 0.149 2
1 603 . 1 1 A 52 52 ASP HA H 52 4.600 4.353 0.247 2
1 606 . 1 1 A 52 52 ASP C C 52 177.570 178.362 -0.792 2
1 607 . 1 1 A 52 52 ASP CA C 52 54.420 56.878 -2.458 2
1 608 . 1 1 A 52 52 ASP CB C 52 40.360 40.622 -0.262 2
1 609 . 1 1 A 52 52 ASP N N 52 117.530 119.181 -1.651 2
1 610 . 1 1 A 53 53 ALA H H 53 7.660 7.882 -0.222 2
1 611 . 1 1 A 53 53 ALA HA H 53 3.860 3.998 -0.138 2
1 615 . 1 1 A 53 53 ALA C C 53 180.070 180.494 -0.424 2
1 616 . 1 1 A 53 53 ALA CA C 53 55.590 55.385 0.205 2
1 617 . 1 1 A 53 53 ALA CB C 53 18.800 18.048 0.752 2
1 618 . 1 1 A 53 53 ALA N N 53 123.450 122.287 1.163 2
1 619 . 1 1 A 54 54 VAL H H 54 8.030 7.829 0.201 2
1 620 . 1 1 A 54 54 VAL HA H 54 3.240 3.617 -0.377 2
1 628 . 1 1 A 54 54 VAL C C 54 177.340 177.745 -0.405 2
1 629 . 1 1 A 54 54 VAL CA C 54 66.620 66.089 0.531 2
1 630 . 1 1 A 54 54 VAL CB C 54 30.480 31.067 -0.587 2
1 633 . 1 1 A 54 54 VAL N N 54 116.150 117.732 -1.582 2
1 634 . 1 1 A 55 55 ASP H H 55 7.660 7.835 -0.175 2
1 635 . 1 1 A 55 55 ASP HA H 55 4.080 4.352 -0.272 2
1 638 . 1 1 A 55 55 ASP C C 55 177.260 179.138 -1.878 2
1 639 . 1 1 A 55 55 ASP CA C 55 57.640 57.427 0.213 2
1 640 . 1 1 A 55 55 ASP CB C 55 40.360 40.480 -0.120 2
1 641 . 1 1 A 55 55 ASP N N 55 120.830 121.771 -0.941 2
1 642 . 1 1 A 56 56 LYS H H 56 7.780 7.569 0.211 2
1 643 . 1 1 A 56 56 LYS HA H 56 3.860 4.021 -0.161 2
1 652 . 1 1 A 56 56 LYS C C 56 179.530 179.463 0.067 2
1 653 . 1 1 A 56 56 LYS CA C 56 59.690 59.713 -0.023 2
1 654 . 1 1 A 56 56 LYS CB C 56 31.870 32.481 -0.611 2
1 658 . 1 1 A 56 56 LYS N N 56 120.010 119.197 0.813 2
1 659 . 1 1 A 57 57 ILE H H 57 8.090 7.835 0.255 2
1 660 . 1 1 A 57 57 ILE HA H 57 3.390 3.587 -0.197 2
1 670 . 1 1 A 57 57 ILE C C 57 176.710 177.644 -0.934 2
1 671 . 1 1 A 57 57 ILE CA C 57 64.960 65.192 -0.232 2
1 672 . 1 1 A 57 57 ILE CB C 57 38.080 38.283 -0.203 2
1 676 . 1 1 A 57 57 ILE N N 57 120.960 120.395 0.565 2
1 677 . 1 1 A 58 58 MET H H 58 8.480 8.297 0.183 2
1 678 . 1 1 A 58 58 MET HA H 58 3.800 4.087 -0.287 2
1 686 . 1 1 A 58 58 MET C C 58 177.570 178.106 -0.536 2
1 687 . 1 1 A 58 58 MET CA C 58 58.570 58.476 0.094 2
1 688 . 1 1 A 58 58 MET CB C 58 32.570 31.871 0.699 2
1 691 . 1 1 A 58 58 MET N N 58 119.160 120.516 -1.356 2
1 692 . 1 1 A 59 59 LYS H H 59 7.550 7.922 -0.372 2
1 693 . 1 1 A 59 59 LYS HA H 59 3.930 3.956 -0.026 2
1 702 . 1 1 A 59 59 LYS C C 59 179.530 179.250 0.280 2
1 703 . 1 1 A 59 59 LYS CA C 59 58.820 59.694 -0.874 2
1 704 . 1 1 A 59 59 LYS CB C 59 32.450 32.425 0.025 2
1 708 . 1 1 A 59 59 LYS N N 59 116.730 119.642 -2.912 2
1 709 . 1 1 A 60 60 GLU H H 60 7.470 7.740 -0.270 2
1 710 . 1 1 A 60 60 GLU HA H 60 4.050 4.085 -0.035 2
1 715 . 1 1 A 60 60 GLU C C 60 178.950 178.176 0.774 2
1 716 . 1 1 A 60 60 GLU CA C 60 58.600 58.904 -0.304 2
1 717 . 1 1 A 60 60 GLU CB C 60 31.700 29.473 2.227 2
1 719 . 1 1 A 60 60 GLU N N 60 116.820 119.301 -2.481 2
1 720 . 1 1 A 61 61 LEU H H 61 8.030 7.728 0.302 2
1 721 . 1 1 A 61 61 LEU HA H 61 4.310 4.272 0.038 2
1 731 . 1 1 A 61 61 LEU C C 61 179.450 177.247 2.203 2
1 732 . 1 1 A 61 61 LEU CA C 61 54.840 55.911 -1.071 2
1 733 . 1 1 A 61 61 LEU CB C 61 43.820 42.229 1.591 2
1 737 . 1 1 A 61 61 LEU N N 61 116.000 118.795 -2.795 2
1 738 . 1 1 A 62 62 ASP H H 62 7.890 8.669 -0.779 2
1 739 . 1 1 A 62 62 ASP HA H 62 4.660 4.835 -0.175 2
1 742 . 1 1 A 62 62 ASP C C 62 177.030 176.309 0.721 2
1 743 . 1 1 A 62 62 ASP CA C 62 53.660 53.492 0.168 2
1 744 . 1 1 A 62 62 ASP CB C 62 38.700 39.332 -0.632 2
1 745 . 1 1 A 62 62 ASP N N 62 117.550 118.699 -1.149 2
1 746 . 1 1 A 63 63 GLU H H 63 8.430 9.254 -0.824 2
1 747 . 1 1 A 63 63 GLU HA H 63 4.020 4.037 -0.017 2
1 752 . 1 1 A 63 63 GLU C C 63 178.120 178.823 -0.703 2
1 753 . 1 1 A 63 63 GLU CA C 63 58.470 59.223 -0.753 2
1 754 . 1 1 A 63 63 GLU CB C 63 30.120 29.422 0.698 2
1 756 . 1 1 A 63 63 GLU N N 63 130.230 121.435 8.795 2
1 757 . 1 1 A 64 64 ASN H H 64 8.010 7.877 0.133 2
1 758 . 1 1 A 64 64 ASN HA H 64 4.680 4.725 -0.045 2
1 761 . 1 1 A 64 64 ASN C C 64 177.100 175.866 1.234 2
1 762 . 1 1 A 64 64 ASN CA C 64 51.780 53.213 -1.433 2
1 763 . 1 1 A 64 64 ASN CB C 64 37.260 38.928 -1.668 2
1 764 . 1 1 A 64 64 ASN N N 64 113.640 115.263 -1.623 2
1 765 . 1 1 A 65 65 GLY H H 65 7.550 7.942 -0.392 2
1 766 . 1 1 A 65 65 GLY HA2 H 65 3.770 3.962 -0.192 2
1 767 . 1 1 A 65 65 GLY HA3 H 65 3.770 3.963 -0.193 2
1 768 . 1 1 A 65 65 GLY C C 65 178.980 174.794 4.186 2
1 769 . 1 1 A 65 65 GLY CA C 65 47.200 46.462 0.738 2
1 770 . 1 1 A 65 65 GLY N N 65 113.640 107.680 5.960 2
1 771 . 1 1 A 66 66 ASP H H 66 8.110 8.214 -0.104 2
1 772 . 1 1 A 66 66 ASP HA H 66 4.490 4.666 -0.176 2
1 775 . 1 1 A 66 66 ASP C C 66 177.960 177.203 0.757 2
1 776 . 1 1 A 66 66 ASP CA C 66 52.960 53.352 -0.392 2
1 777 . 1 1 A 66 66 ASP CB C 66 40.540 40.650 -0.110 2
1 778 . 1 1 A 66 66 ASP N N 66 120.030 120.175 -0.145 2
1 779 . 1 1 A 67 67 GLY H H 67 10.260 9.127 1.133 2
1 780 . 1 1 A 67 67 GLY HA2 H 67 3.360 3.918 -0.558 2
1 781 . 1 1 A 67 67 GLY HA3 H 67 4.000 3.919 0.081 2
1 782 . 1 1 A 67 67 GLY C C 67 173.120 173.408 -0.288 2
1 783 . 1 1 A 67 67 GLY CA C 67 45.460 45.747 -0.287 2
1 784 . 1 1 A 67 67 GLY N N 67 114.100 110.601 3.499 2
1 785 . 1 1 A 68 68 GLU H H 68 7.750 8.003 -0.253 2
1 786 . 1 1 A 68 68 GLU HA H 68 4.780 4.964 -0.184 2
1 791 . 1 1 A 68 68 GLU C C 68 175.930 174.900 1.030 2
1 792 . 1 1 A 68 68 GLU CA C 68 54.430 54.424 0.006 2
1 793 . 1 1 A 68 68 GLU CB C 68 35.850 33.714 2.136 2
1 795 . 1 1 A 68 68 GLU N N 68 118.000 119.302 -1.302 2
1 796 . 1 1 A 69 69 VAL H H 69 9.380 8.476 0.904 2
1 797 . 1 1 A 69 69 VAL HA H 69 5.260 5.042 0.218 2
1 805 . 1 1 A 69 69 VAL C C 69 176.710 174.215 2.495 2
1 806 . 1 1 A 69 69 VAL CA C 69 61.280 60.805 0.475 2
1 807 . 1 1 A 69 69 VAL CB C 69 33.980 34.912 -0.932 2
1 810 . 1 1 A 69 69 VAL N N 69 125.970 120.895 5.075 2
1 811 . 1 1 A 70 70 ASP H H 70 9.100 8.997 0.103 2
1 812 . 1 1 A 70 70 ASP HA H 70 5.190 5.040 0.150 2
1 815 . 1 1 A 70 70 ASP C C 70 175.700 177.208 -1.508 2
1 816 . 1 1 A 70 70 ASP CA C 70 52.370 53.288 -0.919 2
1 817 . 1 1 A 70 70 ASP CB C 70 40.950 42.355 -1.405 2
1 818 . 1 1 A 70 70 ASP N N 70 130.320 126.550 3.770 2
1 819 . 1 1 A 71 71 PHE H H 71 9.090 9.043 0.047 2
1 820 . 1 1 A 71 71 PHE HA H 71 4.100 4.075 0.025 2
1 823 . 1 1 A 71 71 PHE C C 71 177.000 177.293 -0.293 2
1 824 . 1 1 A 71 71 PHE CA C 71 58.230 61.755 -3.525 2
1 825 . 1 1 A 71 71 PHE CB C 71 36.910 39.422 -2.512 2
1 826 . 1 1 A 71 71 PHE N N 71 119.760 124.093 -4.333 2
1 827 . 1 1 A 72 72 GLN H H 72 8.440 8.345 0.095 2
1 828 . 1 1 A 72 72 GLN HA H 72 3.600 4.021 -0.421 2
1 831 . 1 1 A 72 72 GLN C C 72 178.820 178.144 0.676 2
1 832 . 1 1 A 72 72 GLN CA C 72 59.500 58.674 0.826 2
1 833 . 1 1 A 72 72 GLN CB C 72 29.553 28.256 1.297 2
1 835 . 1 1 A 72 72 GLN N N 72 121.820 118.024 3.796 2
1 836 . 1 1 A 73 73 GLU H H 73 8.290 8.307 -0.017 2
1 837 . 1 1 A 73 73 GLU HA H 73 4.070 4.111 -0.041 2
1 842 . 1 1 A 73 73 GLU C C 73 179.370 178.891 0.479 2
1 843 . 1 1 A 73 73 GLU CA C 73 58.030 58.865 -0.835 2
1 844 . 1 1 A 73 73 GLU CB C 73 29.530 29.974 -0.444 2
1 846 . 1 1 A 73 73 GLU N N 73 120.550 119.513 1.037 2
1 847 . 1 1 A 74 74 PHE H H 74 8.630 8.475 0.155 2
1 848 . 1 1 A 74 74 PHE HA H 74 4.020 4.089 -0.069 2
1 851 . 1 1 A 74 74 PHE C C 74 177.890 177.081 0.809 2
1 852 . 1 1 A 74 74 PHE CA C 74 60.090 61.264 -1.174 2
1 853 . 1 1 A 74 74 PHE CB C 74 38.020 39.143 -1.123 2
1 854 . 1 1 A 74 74 PHE N N 74 121.010 121.753 -0.743 2
1 855 . 1 1 A 75 75 VAL H H 75 8.080 8.264 -0.184 2
1 856 . 1 1 A 75 75 VAL HA H 75 2.860 3.446 -0.586 2
1 864 . 1 1 A 75 75 VAL C C 75 177.030 178.030 -1.000 2
1 865 . 1 1 A 75 75 VAL CA C 75 66.430 65.996 0.434 2
1 866 . 1 1 A 75 75 VAL CB C 75 30.600 31.154 -0.555 2
1 869 . 1 1 A 75 75 VAL N N 75 119.460 118.966 0.494 2
1 870 . 1 1 A 76 76 VAL H H 76 7.100 8.105 -1.005 2
1 871 . 1 1 A 76 76 VAL HA H 76 3.330 3.554 -0.225 2
1 879 . 1 1 A 76 76 VAL C C 76 178.670 178.042 0.628 2
1 880 . 1 1 A 76 76 VAL CA C 76 67.000 66.466 0.534 2
1 881 . 1 1 A 76 76 VAL CB C 76 31.280 31.392 -0.112 2
1 884 . 1 1 A 76 76 VAL N N 76 121.030 120.076 0.954 2
1 885 . 1 1 A 77 77 LEU H H 77 6.900 7.841 -0.941 2
1 886 . 1 1 A 77 77 LEU HA H 77 3.800 3.976 -0.176 2
1 896 . 1 1 A 77 77 LEU C C 77 177.960 178.450 -0.490 2
1 897 . 1 1 A 77 77 LEU CA C 77 57.710 58.156 -0.446 2
1 898 . 1 1 A 77 77 LEU CB C 77 40.070 41.786 -1.716 2
1 902 . 1 1 A 77 77 LEU N N 77 120.310 121.358 -1.048 2
1 903 . 1 1 A 78 78 VAL H H 78 7.240 7.569 -0.329 2
1 904 . 1 1 A 78 78 VAL HA H 78 3.030 3.799 -0.769 2
1 912 . 1 1 A 78 78 VAL C C 78 179.600 178.078 1.522 2
1 913 . 1 1 A 78 78 VAL CA C 78 66.420 65.167 1.253 2
1 914 . 1 1 A 78 78 VAL CB C 78 30.700 31.491 -0.791 2
1 917 . 1 1 A 78 78 VAL N N 78 117.180 116.858 0.322 2
1 918 . 1 1 A 79 79 ALA H H 79 9.000 8.126 0.874 2
1 919 . 1 1 A 79 79 ALA HA H 79 3.610 3.984 -0.374 2
1 923 . 1 1 A 79 79 ALA C C 79 182.260 180.051 2.209 2
1 924 . 1 1 A 79 79 ALA CA C 79 55.580 55.434 0.146 2
1 925 . 1 1 A 79 79 ALA CB C 79 18.400 18.024 0.376 2
1 926 . 1 1 A 79 79 ALA N N 79 126.000 124.403 1.597 2
1 927 . 1 1 A 80 80 ALA H H 80 8.000 7.725 0.275 2
1 928 . 1 1 A 80 80 ALA HA H 80 4.100 4.082 0.018 2
1 932 . 1 1 A 80 80 ALA C C 80 175.460 179.771 -4.311 2
1 933 . 1 1 A 80 80 ALA CA C 80 56.020 54.548 1.472 2
1 934 . 1 1 A 80 80 ALA CB C 80 18.040 18.390 -0.350 2
1 935 . 1 1 A 80 80 ALA N N 80 120.730 120.856 -0.127 2
1 936 . 1 1 A 81 81 LEU H H 81 8.460 7.695 0.765 2
1 937 . 1 1 A 81 81 LEU HA H 81 4.000 4.070 -0.070 2
1 941 . 1 1 A 81 81 LEU C C 81 177.030 178.987 -1.957 2
1 942 . 1 1 A 81 81 LEU CA C 81 57.640 57.674 -0.034 2
1 943 . 1 1 A 81 81 LEU CB C 81 40.620 41.718 -1.098 2
1 945 . 1 1 A 81 81 LEU N N 81 119.890 118.925 0.965 2
1 946 . 1 1 A 82 82 THR H H 82 8.320 7.818 0.502 2
1 947 . 1 1 A 82 82 THR HA H 82 3.800 3.998 -0.198 2
1 952 . 1 1 A 82 82 THR C C 82 181.010 176.879 4.131 2
1 953 . 1 1 A 82 82 THR CA C 82 68.500 66.165 2.335 2
1 954 . 1 1 A 82 82 THR CB C 82 67.400 69.009 -1.609 2
1 956 . 1 1 A 82 82 THR N N 82 117.120 113.750 3.370 2
1 957 . 1 1 A 83 83 VAL H H 83 8.530 7.525 1.005 2
1 958 . 1 1 A 83 83 VAL HA H 83 3.890 3.839 0.051 2
1 966 . 1 1 A 83 83 VAL C C 83 178.120 178.213 -0.093 2
1 967 . 1 1 A 83 83 VAL CA C 83 67.400 65.155 2.245 2
1 968 . 1 1 A 83 83 VAL CB C 83 31.590 31.547 0.043 2
1 971 . 1 1 A 83 83 VAL N N 83 119.760 118.077 1.683 2
1 972 . 1 1 A 84 84 ALA H H 84 7.910 8.289 -0.379 2
1 973 . 1 1 A 84 84 ALA HA H 84 4.060 4.108 -0.048 2
1 977 . 1 1 A 84 84 ALA C C 84 180.560 179.830 0.730 2
1 978 . 1 1 A 84 84 ALA CA C 84 55.000 55.141 -0.141 2
1 979 . 1 1 A 84 84 ALA CB C 84 17.230 18.225 -0.995 2
1 980 . 1 1 A 84 84 ALA N N 84 122.620 124.505 -1.885 2
1 981 . 1 1 A 85 85 CYS H H 85 8.580 7.962 0.618 2
1 982 . 1 1 A 85 85 CYS HA H 85 4.080 4.497 -0.416 2
1 985 . 1 1 A 85 85 CYS C C 85 179.060 177.012 2.048 2
1 986 . 1 1 A 85 85 CYS CA C 85 63.210 61.670 1.540 2
1 987 . 1 1 A 85 85 CYS CB C 85 26.310 27.354 -1.044 2
1 988 . 1 1 A 85 85 CYS N N 85 118.730 117.264 1.466 2
1 989 . 1 1 A 86 86 ASN H H 86 8.430 8.101 0.329 2
1 990 . 1 1 A 86 86 ASN CA C 86 55.860 56.717 -0.857 2
1 991 . 1 1 A 86 86 ASN CB C 86 37.440 39.454 -2.014 2
1 992 . 1 1 A 86 86 ASN N N 86 119.360 119.190 0.170 2
1 993 . 1 1 A 87 87 ASN H H 87 7.880 7.963 -0.083 2
1 994 . 1 1 A 87 87 ASN HA H 87 4.600 4.534 0.066 2
1 997 . 1 1 A 87 87 ASN C C 87 178.510 177.477 1.033 2
1 998 . 1 1 A 87 87 ASN CA C 87 56.470 56.497 -0.027 2
1 999 . 1 1 A 87 87 ASN CB C 87 37.500 38.695 -1.195 2
1 1000 . 1 1 A 87 87 ASN N N 87 119.480 117.510 1.970 2
1 1001 . 1 1 A 88 88 PHE H H 88 8.050 7.675 0.375 2
1 1002 . 1 1 A 88 88 PHE HA H 88 4.200 4.438 -0.238 2
1 1005 . 1 1 A 88 88 PHE C C 88 178.510 177.370 1.140 2
1 1006 . 1 1 A 88 88 PHE CA C 88 56.460 59.555 -3.095 2
1 1007 . 1 1 A 88 88 PHE CB C 88 38.500 39.329 -0.829 2
1 1008 . 1 1 A 88 88 PHE N N 88 120.280 119.150 1.130 2
1 1009 . 1 1 A 89 89 PHE H H 89 8.020 8.246 -0.226 2
1 1010 . 1 1 A 89 89 PHE HA H 89 4.000 4.241 -0.241 2
1 1013 . 1 1 A 89 89 PHE C C 89 177.340 177.567 -0.227 2
1 1014 . 1 1 A 89 89 PHE CA C 89 59.000 60.297 -1.297 2
1 1015 . 1 1 A 89 89 PHE CB C 89 37.430 39.499 -2.069 2
1 1016 . 1 1 A 89 89 PHE N N 89 120.910 119.248 1.662 2
1 1017 . 1 1 A 90 90 TRP H H 90 7.800 7.943 -0.143 2
1 1018 . 1 1 A 90 90 TRP HA H 90 4.460 4.428 0.032 2
1 1021 . 1 1 A 90 90 TRP C C 90 177.340 177.734 -0.394 2
1 1022 . 1 1 A 90 90 TRP CA C 90 57.930 59.618 -1.688 2
1 1023 . 1 1 A 90 90 TRP CB C 90 42.000 29.681 12.319 2
1 1024 . 1 1 A 90 90 TRP N N 90 120.050 120.070 -0.020 2
1 1025 . 1 1 A 91 91 GLU H H 91 7.800 8.393 -0.593 2
1 1026 . 1 1 A 91 91 GLU HA H 91 4.050 3.843 0.207 2
1 1031 . 1 1 A 91 91 GLU C C 91 177.570 177.461 0.109 2
1 1032 . 1 1 A 91 91 GLU CA C 91 57.350 58.809 -1.459 2
1 1033 . 1 1 A 91 91 GLU CB C 91 29.530 29.188 0.342 2
1 1035 . 1 1 A 91 91 GLU N N 91 120.730 118.472 2.258 2
1 1036 . 1 1 A 92 92 ASN H H 92 7.800 7.861 -0.061 2
1 1037 . 1 1 A 92 92 ASN HA H 92 4.630 4.518 0.112 2
1 1040 . 1 1 A 92 92 ASN C C 92 174.450 174.649 -0.199 2
1 1041 . 1 1 A 92 92 ASN CA C 92 52.960 52.838 0.122 2
1 1042 . 1 1 A 92 92 ASN CB C 92 29.530 37.923 -8.393 2
1 1043 . 1 1 A 92 92 ASN N N 92 119.410 116.468 2.942 2
stop_
save_