data_15689_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15689
_Entry.PDB_ID 2K25
_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 4 . 1 1 1 A 2 2 SER H H 2 8.160 8.648 -0.488 1
1 5 . 1 1 1 A 2 2 SER HA H 2 4.370 5.128 -0.758 1
1 9 . 1 1 1 A 2 2 SER CA C 2 58.300 57.358 0.942 1
1 10 . 1 1 1 A 2 2 SER CB C 2 63.900 65.567 -1.667 1
1 11 . 1 1 1 A 2 2 SER N N 2 115.600 119.283 -3.683 1
1 12 . 1 1 1 A 3 3 LEU H H 3 8.250 8.809 -0.559 1
1 13 . 1 1 1 A 3 3 LEU HA H 3 4.280 5.258 -0.978 1
1 17 . 1 1 1 A 3 3 LEU CA C 3 55.200 52.870 2.330 1
1 18 . 1 1 1 A 3 3 LEU CB C 3 42.100 46.126 -4.026 1
1 19 . 1 1 1 A 3 3 LEU N N 3 124.100 121.970 2.130 1
1 20 . 1 1 1 A 4 4 VAL H H 4 7.950 8.859 -0.909 1
1 21 . 1 1 1 A 4 4 VAL HA H 4 4.680 4.534 0.146 1
1 26 . 1 1 1 A 4 4 VAL CA C 4 59.800 58.671 1.129 1
1 27 . 1 1 1 A 4 4 VAL CB C 4 32.500 32.887 -0.387 1
1 28 . 1 1 1 A 4 4 VAL N N 4 122.600 121.632 0.968 1
1 29 . 1 1 1 A 5 5 PRO CA C 5 63.100 62.530 0.570 1
1 30 . 1 1 1 A 5 5 PRO CB C 5 32.000 33.535 -1.535 1
1 32 . 1 1 1 A 6 6 ARG H H 6 8.360 8.823 -0.463 1
1 33 . 1 1 1 A 6 6 ARG HA H 6 4.250 4.413 -0.163 1
1 36 . 1 1 1 A 6 6 ARG CA C 6 56.000 57.252 -1.252 1
1 37 . 1 1 1 A 6 6 ARG CB C 6 30.900 31.800 -0.900 1
1 38 . 1 1 1 A 6 6 ARG N N 6 121.800 121.949 -0.149 1
1 39 . 1 1 1 A 7 7 GLY H H 7 8.460 8.116 0.344 1
1 40 . 1 1 1 A 7 7 GLY HA2 H 7 3.940 3.939 0.001 1
1 41 . 1 1 1 A 7 7 GLY HA3 H 7 3.760 3.942 -0.182 1
1 42 . 1 1 1 A 7 7 GLY CA C 7 45.000 45.401 -0.401 1
1 43 . 1 1 1 A 7 7 GLY N N 7 110.700 107.762 2.938 1
1 44 . 1 1 1 A 8 8 SER H H 8 7.990 8.173 -0.183 1
1 45 . 1 1 1 A 8 8 SER HA H 8 4.450 4.058 0.392 1
1 48 . 1 1 1 A 8 8 SER CA C 8 58.900 59.503 -0.603 1
1 49 . 1 1 1 A 8 8 SER CB C 8 64.200 62.108 2.092 1
1 50 . 1 1 1 A 8 8 SER N N 8 115.500 114.353 1.147 1
1 51 . 1 1 1 A 9 9 MET H H 9 9.040 7.745 1.295 1
1 52 . 1 1 1 A 9 9 MET HA H 9 4.610 4.913 -0.303 1
1 60 . 1 1 1 A 9 9 MET CA C 9 54.400 53.615 0.785 1
1 61 . 1 1 1 A 9 9 MET CB C 9 35.400 33.907 1.493 1
1 64 . 1 1 1 A 9 9 MET N N 9 120.500 120.523 -0.023 1
1 65 . 1 1 1 A 10 10 GLN H H 10 8.270 8.893 -0.623 1
1 66 . 1 1 1 A 10 10 GLN HA H 10 5.270 5.247 0.023 1
1 71 . 1 1 1 A 10 10 GLN CA C 10 54.200 54.222 -0.022 1
1 72 . 1 1 1 A 10 10 GLN CB C 10 30.500 32.293 -1.793 1
1 74 . 1 1 1 A 10 10 GLN N N 10 121.000 122.328 -1.328 1
1 75 . 1 1 1 A 11 11 ILE H H 11 8.270 8.667 -0.397 1
1 76 . 1 1 1 A 11 11 ILE HA H 11 4.100 4.684 -0.584 1
1 86 . 1 1 1 A 11 11 ILE CA C 11 59.400 59.139 0.261 1
1 87 . 1 1 1 A 11 11 ILE CB C 11 41.800 40.554 1.246 1
1 91 . 1 1 1 A 11 11 ILE N N 11 114.600 121.257 -6.657 1
1 92 . 1 1 1 A 12 12 PHE H H 12 8.520 8.773 -0.253 1
1 93 . 1 1 1 A 12 12 PHE HA H 12 5.540 5.335 0.205 1
1 96 . 1 1 1 A 12 12 PHE CA C 12 55.000 56.911 -1.911 1
1 97 . 1 1 1 A 12 12 PHE CB C 12 41.200 40.767 0.433 1
1 98 . 1 1 1 A 12 12 PHE N N 12 118.600 123.279 -4.679 1
1 99 . 1 1 1 A 13 13 VAL H H 13 9.230 9.161 0.069 1
1 100 . 1 1 1 A 13 13 VAL HA H 13 4.740 5.072 -0.332 1
1 108 . 1 1 1 A 13 13 VAL CA C 13 60.300 60.586 -0.286 1
1 109 . 1 1 1 A 13 13 VAL CB C 13 34.100 35.162 -1.062 1
1 112 . 1 1 1 A 13 13 VAL N N 13 121.400 122.209 -0.809 1
1 113 . 1 1 1 A 14 14 LYS H H 14 8.910 8.652 0.258 1
1 114 . 1 1 1 A 14 14 LYS HA H 14 5.190 4.817 0.373 1
1 122 . 1 1 1 A 14 14 LYS CA C 14 54.600 54.612 -0.012 1
1 123 . 1 1 1 A 14 14 LYS CB C 14 34.300 35.047 -0.747 1
1 126 . 1 1 1 A 14 14 LYS N N 14 128.000 126.478 1.522 1
1 127 . 1 1 1 A 15 15 THR H H 15 8.650 8.904 -0.254 1
1 128 . 1 1 1 A 15 15 THR HA H 15 4.870 4.722 0.148 1
1 133 . 1 1 1 A 15 15 THR CA C 15 60.300 60.715 -0.415 1
1 134 . 1 1 1 A 15 15 THR CB C 15 70.600 71.707 -1.107 1
1 136 . 1 1 1 A 15 15 THR N N 15 115.300 116.852 -1.552 1
1 137 . 1 1 1 A 16 16 LEU H H 16 9.070 8.851 0.219 1
1 138 . 1 1 1 A 16 16 LEU HA H 16 4.210 4.017 0.193 1
1 148 . 1 1 1 A 16 16 LEU CA C 16 57.400 57.765 -0.365 1
1 149 . 1 1 1 A 16 16 LEU CB C 16 41.800 41.547 0.253 1
1 153 . 1 1 1 A 16 16 LEU N N 16 121.400 122.220 -0.820 1
1 154 . 1 1 1 A 17 17 THR H H 17 7.560 7.802 -0.242 1
1 155 . 1 1 1 A 17 17 THR HA H 17 4.330 4.288 0.042 1
1 160 . 1 1 1 A 17 17 THR CA C 17 61.400 64.039 -2.639 1
1 161 . 1 1 1 A 17 17 THR CB C 17 68.900 69.480 -0.580 1
1 163 . 1 1 1 A 17 17 THR N N 17 105.900 112.241 -6.341 1
1 164 . 1 1 1 A 18 18 GLY H H 18 7.750 7.790 -0.040 1
1 165 . 1 1 1 A 18 18 GLY HA2 H 18 4.250 4.021 0.229 1
1 166 . 1 1 1 A 18 18 GLY HA3 H 18 3.520 4.031 -0.511 1
1 167 . 1 1 1 A 18 18 GLY CA C 18 45.300 45.157 0.143 1
1 168 . 1 1 1 A 18 18 GLY N N 18 109.300 109.326 -0.026 1
1 169 . 1 1 1 A 19 19 LYS H H 19 7.210 7.612 -0.402 1
1 170 . 1 1 1 A 19 19 LYS HA H 19 4.260 4.291 -0.031 1
1 175 . 1 1 1 A 19 19 LYS CA C 19 56.300 56.928 -0.628 1
1 176 . 1 1 1 A 19 19 LYS CB C 19 33.200 34.013 -0.813 1
1 179 . 1 1 1 A 19 19 LYS N N 19 122.000 121.245 0.755 1
1 180 . 1 1 1 A 20 20 THR H H 20 8.570 8.603 -0.033 1
1 181 . 1 1 1 A 20 20 THR HA H 20 4.950 5.312 -0.362 1
1 186 . 1 1 1 A 20 20 THR CA C 20 62.200 61.975 0.225 1
1 187 . 1 1 1 A 20 20 THR CB C 20 69.700 70.825 -1.125 1
1 189 . 1 1 1 A 20 20 THR N N 20 120.700 118.211 2.489 1
1 190 . 1 1 1 A 21 21 ILE H H 21 9.510 8.910 0.600 1
1 191 . 1 1 1 A 21 21 ILE HA H 21 4.390 4.868 -0.478 1
1 201 . 1 1 1 A 21 21 ILE CA C 21 60.000 59.131 0.869 1
1 202 . 1 1 1 A 21 21 ILE CB C 21 40.700 41.659 -0.959 1
1 206 . 1 1 1 A 21 21 ILE N N 21 128.200 122.063 6.137 1
1 207 . 1 1 1 A 22 22 THR H H 22 8.700 8.681 0.019 1
1 208 . 1 1 1 A 22 22 THR HA H 22 4.860 4.560 0.300 1
1 213 . 1 1 1 A 22 22 THR CA C 22 62.100 62.625 -0.525 1
1 214 . 1 1 1 A 22 22 THR CB C 22 69.500 69.407 0.093 1
1 216 . 1 1 1 A 22 22 THR N N 22 122.300 120.896 1.404 1
1 217 . 1 1 1 A 23 23 LEU H H 23 8.720 8.735 -0.015 1
1 218 . 1 1 1 A 23 23 LEU HA H 23 4.690 4.974 -0.284 1
1 228 . 1 1 1 A 23 23 LEU CA C 23 52.700 53.716 -1.016 1
1 229 . 1 1 1 A 23 23 LEU CB C 23 46.600 45.660 0.940 1
1 233 . 1 1 1 A 23 23 LEU N N 23 125.400 126.390 -0.990 1
1 234 . 1 1 1 A 24 24 GLU H H 24 8.080 8.340 -0.260 1
1 235 . 1 1 1 A 24 24 GLU HA H 24 4.800 4.751 0.049 1
1 238 . 1 1 1 A 24 24 GLU CA C 24 55.400 55.795 -0.395 1
1 239 . 1 1 1 A 24 24 GLU CB C 24 30.100 30.764 -0.664 1
1 241 . 1 1 1 A 24 24 GLU N N 24 121.800 119.866 1.934 1
1 242 . 1 1 1 A 25 25 VAL H H 25 8.800 8.850 -0.050 1
1 243 . 1 1 1 A 25 25 VAL HA H 25 4.640 4.967 -0.327 1
1 251 . 1 1 1 A 25 25 VAL CA C 25 58.600 59.635 -1.035 1
1 252 . 1 1 1 A 25 25 VAL CB C 25 36.300 35.719 0.581 1
1 255 . 1 1 1 A 25 25 VAL N N 25 116.700 116.610 0.090 1
1 256 . 1 1 1 A 26 26 GLU H H 26 8.500 8.444 0.056 1
1 257 . 1 1 1 A 26 26 GLU HA H 26 4.900 4.641 0.259 1
1 260 . 1 1 1 A 26 26 GLU CA C 26 53.000 54.613 -1.613 1
1 261 . 1 1 1 A 26 26 GLU CB C 26 31.200 34.001 -2.801 1
1 262 . 1 1 1 A 26 26 GLU N N 26 117.900 121.461 -3.561 1
1 263 . 1 1 1 A 27 27 PRO HA H 27 4.040 4.363 -0.323 1
1 270 . 1 1 1 A 27 27 PRO CA C 27 65.400 64.915 0.485 1
1 271 . 1 1 1 A 27 27 PRO CB C 27 31.700 32.021 -0.321 1
1 274 . 1 1 1 A 28 28 SER H H 28 7.010 8.171 -1.161 1
1 275 . 1 1 1 A 28 28 SER HA H 28 4.280 4.664 -0.384 1
1 278 . 1 1 1 A 28 28 SER CA C 28 57.400 58.211 -0.811 1
1 279 . 1 1 1 A 28 28 SER CB C 28 63.400 63.834 -0.434 1
1 280 . 1 1 1 A 28 28 SER N N 28 103.800 111.285 -7.485 1
1 281 . 1 1 1 A 29 29 ASP H H 29 7.960 7.771 0.189 1
1 282 . 1 1 1 A 29 29 ASP HA H 29 4.600 4.959 -0.359 1
1 285 . 1 1 1 A 29 29 ASP CA C 29 55.900 53.316 2.584 1
1 286 . 1 1 1 A 29 29 ASP CB C 29 41.000 41.779 -0.779 1
1 287 . 1 1 1 A 29 29 ASP N N 29 123.700 121.154 2.546 1
1 288 . 1 1 1 A 30 30 THR H H 30 7.780 8.749 -0.969 1
1 289 . 1 1 1 A 30 30 THR HA H 30 4.850 4.666 0.184 1
1 294 . 1 1 1 A 30 30 THR CA C 30 59.400 60.151 -0.751 1
1 295 . 1 1 1 A 30 30 THR CB C 30 71.100 71.215 -0.115 1
1 297 . 1 1 1 A 30 30 THR N N 30 108.800 118.207 -9.407 1
1 298 . 1 1 1 A 31 31 ILE H H 31 8.320 9.018 -0.698 1
1 299 . 1 1 1 A 31 31 ILE HA H 31 3.580 3.752 -0.172 1
1 309 . 1 1 1 A 31 31 ILE CA C 31 62.200 64.850 -2.650 1
1 310 . 1 1 1 A 31 31 ILE CB C 31 34.300 37.486 -3.186 1
1 314 . 1 1 1 A 31 31 ILE N N 31 121.300 127.067 -5.767 1
1 315 . 1 1 1 A 32 32 GLU H H 32 9.850 8.345 1.505 1
1 316 . 1 1 1 A 32 32 GLU HA H 32 3.780 3.917 -0.137 1
1 321 . 1 1 1 A 32 32 GLU CA C 32 60.500 59.954 0.546 1
1 322 . 1 1 1 A 32 32 GLU CB C 32 28.800 29.319 -0.519 1
1 324 . 1 1 1 A 32 32 GLU N N 32 121.600 122.046 -0.446 1
1 325 . 1 1 1 A 33 33 ASN H H 33 7.810 7.586 0.224 1
1 326 . 1 1 1 A 33 33 ASN HA H 33 4.440 4.528 -0.088 1
1 329 . 1 1 1 A 33 33 ASN CA C 33 55.800 55.760 0.040 1
1 330 . 1 1 1 A 33 33 ASN CB C 33 38.100 38.345 -0.245 1
1 331 . 1 1 1 A 33 33 ASN N N 33 121.000 118.817 2.183 1
1 332 . 1 1 1 A 34 34 VAL H H 34 8.000 8.152 -0.152 1
1 333 . 1 1 1 A 34 34 VAL HA H 34 3.300 3.584 -0.284 1
1 341 . 1 1 1 A 34 34 VAL CA C 34 67.600 66.572 1.028 1
1 342 . 1 1 1 A 34 34 VAL CB C 34 30.700 31.686 -0.986 1
1 345 . 1 1 1 A 34 34 VAL N N 34 122.200 120.143 2.057 1
1 346 . 1 1 1 A 35 35 LYS H H 35 8.490 8.470 0.020 1
1 347 . 1 1 1 A 35 35 LYS HA H 35 4.500 4.079 0.421 1
1 352 . 1 1 1 A 35 35 LYS CA C 35 59.300 58.631 0.669 1
1 353 . 1 1 1 A 35 35 LYS CB C 35 33.500 31.965 1.535 1
1 354 . 1 1 1 A 35 35 LYS N N 35 119.200 120.264 -1.064 1
1 355 . 1 1 1 A 36 36 ALA H H 36 7.880 8.292 -0.412 1
1 356 . 1 1 1 A 36 36 ALA HA H 36 4.060 4.101 -0.041 1
1 360 . 1 1 1 A 36 36 ALA CA C 36 55.300 54.645 0.655 1
1 361 . 1 1 1 A 36 36 ALA CB C 36 17.600 18.078 -0.478 1
1 362 . 1 1 1 A 36 36 ALA N N 36 123.300 122.107 1.193 1
1 363 . 1 1 1 A 37 37 LYS H H 37 7.790 7.856 -0.066 1
1 364 . 1 1 1 A 37 37 LYS HA H 37 4.110 4.104 0.006 1
1 373 . 1 1 1 A 37 37 LYS CA C 37 59.700 59.486 0.214 1
1 374 . 1 1 1 A 37 37 LYS CB C 37 33.100 32.373 0.727 1
1 378 . 1 1 1 A 37 37 LYS N N 37 120.400 117.120 3.280 1
1 379 . 1 1 1 A 38 38 ILE H H 38 8.240 8.034 0.206 1
1 380 . 1 1 1 A 38 38 ILE HA H 38 3.410 4.017 -0.607 1
1 390 . 1 1 1 A 38 38 ILE CA C 38 66.200 62.005 4.195 1
1 391 . 1 1 1 A 38 38 ILE CB C 38 36.800 37.685 -0.885 1
1 395 . 1 1 1 A 38 38 ILE N N 38 121.400 119.872 1.528 1
1 396 . 1 1 1 A 39 39 GLN H H 39 8.460 8.229 0.231 1
1 397 . 1 1 1 A 39 39 GLN HA H 39 3.730 4.043 -0.313 1
1 402 . 1 1 1 A 39 39 GLN CA C 39 60.000 58.667 1.333 1
1 403 . 1 1 1 A 39 39 GLN CB C 39 27.600 28.681 -1.081 1
1 405 . 1 1 1 A 39 39 GLN N N 39 123.500 121.425 2.075 1
1 406 . 1 1 1 A 40 40 ASP H H 40 7.970 8.203 -0.233 1
1 407 . 1 1 1 A 40 40 ASP HA H 40 4.240 4.381 -0.141 1
1 410 . 1 1 1 A 40 40 ASP CA C 40 57.400 56.651 0.749 1
1 411 . 1 1 1 A 40 40 ASP CB C 40 41.000 40.741 0.259 1
1 412 . 1 1 1 A 40 40 ASP N N 40 119.900 119.458 0.442 1
1 413 . 1 1 1 A 41 41 LYS H H 41 7.420 7.569 -0.149 1
1 414 . 1 1 1 A 41 41 LYS HA H 41 4.200 4.136 0.064 1
1 423 . 1 1 1 A 41 41 LYS CA C 41 58.200 59.045 -0.845 1
1 424 . 1 1 1 A 41 41 LYS CB C 41 33.900 33.008 0.892 1
1 427 . 1 1 1 A 41 41 LYS N N 41 115.700 118.822 -3.122 1
1 428 . 1 1 1 A 42 42 GLU H H 42 8.650 7.927 0.723 1
1 429 . 1 1 1 A 42 42 GLU HA H 42 4.470 4.564 -0.094 1
1 434 . 1 1 1 A 42 42 GLU CA C 42 55.300 56.071 -0.771 1
1 435 . 1 1 1 A 42 42 GLU CB C 42 33.200 32.047 1.153 1
1 437 . 1 1 1 A 42 42 GLU N N 42 114.200 115.358 -1.158 1
1 438 . 1 1 1 A 43 43 GLY H H 43 8.400 7.950 0.450 1
1 439 . 1 1 1 A 43 43 GLY HA2 H 43 4.040 4.001 0.039 1
1 440 . 1 1 1 A 43 43 GLY HA3 H 43 3.820 4.028 -0.208 1
1 441 . 1 1 1 A 43 43 GLY CA C 43 45.900 45.628 0.272 1
1 442 . 1 1 1 A 43 43 GLY N N 43 109.000 108.740 0.260 1
1 443 . 1 1 1 A 44 44 ILE H H 44 6.080 7.729 -1.649 1
1 444 . 1 1 1 A 44 44 ILE HA H 44 4.290 4.178 0.112 1
1 446 . 1 1 1 A 44 44 ILE CA C 44 57.700 59.203 -1.503 1
1 447 . 1 1 1 A 44 44 ILE CB C 44 40.400 38.551 1.849 1
1 448 . 1 1 1 A 44 44 ILE N N 44 120.500 121.729 -1.229 1
1 449 . 1 1 1 A 46 46 PRO HA H 46 4.030 4.274 -0.244 1
1 454 . 1 1 1 A 46 46 PRO CA C 46 66.100 65.064 1.036 1
1 455 . 1 1 1 A 46 46 PRO CB C 46 32.600 32.016 0.584 1
1 458 . 1 1 1 A 47 47 ASP H H 47 8.470 8.522 -0.052 1
1 459 . 1 1 1 A 47 47 ASP HA H 47 4.310 4.365 -0.055 1
1 462 . 1 1 1 A 47 47 ASP CA C 47 55.700 56.963 -1.263 1
1 463 . 1 1 1 A 47 47 ASP CB C 47 39.700 40.143 -0.443 1
1 464 . 1 1 1 A 47 47 ASP N N 47 113.700 117.435 -3.735 1
1 465 . 1 1 1 A 48 48 GLN H H 48 7.720 7.770 -0.050 1
1 466 . 1 1 1 A 48 48 GLN HA H 48 4.340 4.498 -0.158 1
1 471 . 1 1 1 A 48 48 GLN CA C 48 55.500 56.296 -0.796 1
1 472 . 1 1 1 A 48 48 GLN CB C 48 29.900 29.362 0.538 1
1 474 . 1 1 1 A 48 48 GLN N N 48 116.900 116.667 0.233 1
1 475 . 1 1 1 A 49 49 GLN H H 49 7.410 7.660 -0.250 1
1 476 . 1 1 1 A 49 49 GLN HA H 49 4.110 4.090 0.020 1
1 481 . 1 1 1 A 49 49 GLN CA C 49 56.600 56.304 0.296 1
1 482 . 1 1 1 A 49 49 GLN CB C 49 31.300 29.514 1.786 1
1 484 . 1 1 1 A 49 49 GLN N N 49 118.000 120.692 -2.692 1
1 485 . 1 1 1 A 50 50 ARG H H 50 8.400 8.780 -0.380 1
1 486 . 1 1 1 A 50 50 ARG HA H 50 4.380 4.957 -0.577 1
1 491 . 1 1 1 A 50 50 ARG CA C 50 55.100 54.842 0.258 1
1 492 . 1 1 1 A 50 50 ARG CB C 50 31.600 33.198 -1.598 1
1 494 . 1 1 1 A 50 50 ARG N N 50 123.100 125.363 -2.263 1
1 495 . 1 1 1 A 51 51 LEU H H 51 8.710 8.912 -0.202 1
1 496 . 1 1 1 A 51 51 LEU HA H 51 5.300 5.062 0.238 1
1 506 . 1 1 1 A 51 51 LEU CA C 51 52.900 53.853 -0.953 1
1 507 . 1 1 1 A 51 51 LEU CB C 51 45.700 44.047 1.653 1
1 511 . 1 1 1 A 51 51 LEU N N 51 124.400 125.527 -1.127 1
1 512 . 1 1 1 A 52 52 ILE H H 52 9.060 9.058 0.002 1
1 513 . 1 1 1 A 52 52 ILE HA H 52 4.840 4.934 -0.094 1
1 523 . 1 1 1 A 52 52 ILE CA C 52 58.900 60.426 -1.526 1
1 524 . 1 1 1 A 52 52 ILE CB C 52 41.200 39.848 1.352 1
1 528 . 1 1 1 A 52 52 ILE N N 52 122.500 128.529 -6.029 1
1 529 . 1 1 1 A 53 53 PHE H H 53 8.730 9.531 -0.801 1
1 530 . 1 1 1 A 53 53 PHE HA H 53 5.100 4.818 0.282 1
1 535 . 1 1 1 A 53 53 PHE CA C 53 56.300 57.464 -1.164 1
1 536 . 1 1 1 A 53 53 PHE CB C 53 43.500 42.043 1.457 1
1 537 . 1 1 1 A 53 53 PHE N N 53 124.800 127.644 -2.844 1
1 538 . 1 1 1 A 54 54 ALA H H 54 8.940 9.050 -0.110 1
1 539 . 1 1 1 A 54 54 ALA HA H 54 3.610 3.826 -0.216 1
1 543 . 1 1 1 A 54 54 ALA CA C 54 52.500 52.960 -0.460 1
1 544 . 1 1 1 A 54 54 ALA CB C 54 16.300 17.309 -1.009 1
1 545 . 1 1 1 A 54 54 ALA N N 54 133.100 130.333 2.767 1
1 546 . 1 1 1 A 55 55 GLY H H 55 8.070 8.448 -0.378 1
1 547 . 1 1 1 A 55 55 GLY HA2 H 55 4.000 3.797 0.203 1
1 548 . 1 1 1 A 55 55 GLY HA3 H 55 3.340 3.823 -0.483 1
1 549 . 1 1 1 A 55 55 GLY CA C 55 45.200 45.268 -0.068 1
1 550 . 1 1 1 A 55 55 GLY N N 55 102.500 102.636 -0.136 1
1 551 . 1 1 1 A 56 56 LYS H H 56 7.860 7.962 -0.102 1
1 552 . 1 1 1 A 56 56 LYS HA H 56 4.510 4.583 -0.073 1
1 558 . 1 1 1 A 56 56 LYS CA C 56 54.500 54.715 -0.215 1
1 559 . 1 1 1 A 56 56 LYS CB C 56 34.400 33.819 0.581 1
1 561 . 1 1 1 A 56 56 LYS N N 56 121.800 121.917 -0.117 1
1 562 . 1 1 1 A 57 57 GLN H H 57 8.600 8.512 0.088 1
1 563 . 1 1 1 A 57 57 GLN HA H 57 4.410 4.859 -0.449 1
1 568 . 1 1 1 A 57 57 GLN CA C 57 55.900 55.369 0.531 1
1 569 . 1 1 1 A 57 57 GLN CB C 57 28.800 29.793 -0.993 1
1 571 . 1 1 1 A 57 57 GLN N N 57 123.200 124.624 -1.424 1
1 572 . 1 1 1 A 58 58 LEU H H 58 8.480 8.854 -0.374 1
1 573 . 1 1 1 A 58 58 LEU HA H 58 4.060 4.989 -0.929 1
1 583 . 1 1 1 A 58 58 LEU CA C 58 54.100 53.171 0.929 1
1 584 . 1 1 1 A 58 58 LEU CB C 58 41.500 45.855 -4.355 1
1 588 . 1 1 1 A 58 58 LEU N N 58 125.900 121.518 4.382 1
1 589 . 1 1 1 A 59 59 GLU H H 59 8.400 8.832 -0.432 1
1 590 . 1 1 1 A 59 59 GLU HA H 59 4.400 4.614 -0.214 1
1 595 . 1 1 1 A 59 59 GLU CA C 59 55.900 57.169 -1.269 1
1 596 . 1 1 1 A 59 59 GLU CB C 59 31.900 32.254 -0.354 1
1 598 . 1 1 1 A 59 59 GLU N N 59 123.100 118.625 4.475 1
1 599 . 1 1 1 A 60 60 ASP H H 60 8.110 7.766 0.344 1
1 600 . 1 1 1 A 60 60 ASP HA H 60 4.270 4.345 -0.075 1
1 603 . 1 1 1 A 60 60 ASP CA C 60 57.100 54.866 2.234 1
1 604 . 1 1 1 A 60 60 ASP CB C 60 40.800 41.340 -0.540 1
1 605 . 1 1 1 A 60 60 ASP N N 60 120.300 120.082 0.218 1
1 606 . 1 1 1 A 61 61 GLY HA2 H 61 4.000 4.021 -0.021 1
1 607 . 1 1 1 A 61 61 GLY HA3 H 61 3.830 4.065 -0.235 1
1 608 . 1 1 1 A 61 61 GLY CA C 61 45.000 45.242 -0.242 1
1 609 . 1 1 1 A 62 62 ARG H H 62 7.350 8.367 -1.017 1
1 610 . 1 1 1 A 62 62 ARG HA H 62 4.640 4.861 -0.221 1
1 615 . 1 1 1 A 62 62 ARG CA C 62 54.400 53.672 0.728 1
1 616 . 1 1 1 A 62 62 ARG CB C 62 32.600 34.212 -1.612 1
1 618 . 1 1 1 A 62 62 ARG N N 62 119.300 124.778 -5.478 1
1 619 . 1 1 1 A 63 63 THR H H 63 8.460 8.763 -0.303 1
1 620 . 1 1 1 A 63 63 THR HA H 63 5.060 4.567 0.493 1
1 625 . 1 1 1 A 63 63 THR CA C 63 59.700 60.833 -1.133 1
1 626 . 1 1 1 A 63 63 THR CB C 63 72.000 70.863 1.137 1
1 628 . 1 1 1 A 63 63 THR N N 63 109.100 112.839 -3.739 1
1 629 . 1 1 1 A 64 64 LEU H H 64 8.190 8.709 -0.519 1
1 630 . 1 1 1 A 64 64 LEU HA H 64 3.920 4.014 -0.094 1
1 640 . 1 1 1 A 64 64 LEU CA C 64 58.400 57.766 0.634 1
1 641 . 1 1 1 A 64 64 LEU CB C 64 40.200 41.332 -1.132 1
1 645 . 1 1 1 A 64 64 LEU N N 64 118.100 123.005 -4.905 1
1 646 . 1 1 1 A 65 65 SER H H 65 8.370 7.876 0.494 1
1 647 . 1 1 1 A 65 65 SER HA H 65 4.150 4.182 -0.032 1
1 650 . 1 1 1 A 65 65 SER CA C 65 60.900 61.302 -0.402 1
1 651 . 1 1 1 A 65 65 SER CB C 65 62.500 62.807 -0.307 1
1 652 . 1 1 1 A 65 65 SER N N 65 112.200 114.553 -2.353 1
1 653 . 1 1 1 A 66 66 GLU H H 66 7.780 7.853 -0.073 1
1 654 . 1 1 1 A 66 66 GLU HA H 66 3.890 4.164 -0.274 1
1 659 . 1 1 1 A 66 66 GLU CA C 66 59.200 58.962 0.238 1
1 660 . 1 1 1 A 66 66 GLU CB C 66 29.400 29.617 -0.217 1
1 662 . 1 1 1 A 66 66 GLU N N 66 123.600 121.742 1.858 1
1 663 . 1 1 1 A 67 67 TYR H H 67 7.290 7.977 -0.687 1
1 664 . 1 1 1 A 67 67 TYR HA H 67 4.590 4.527 0.063 1
1 669 . 1 1 1 A 67 67 TYR CA C 67 58.400 59.361 -0.961 1
1 670 . 1 1 1 A 67 67 TYR CB C 67 39.800 39.085 0.715 1
1 671 . 1 1 1 A 67 67 TYR N N 67 116.400 120.011 -3.611 1
1 672 . 1 1 1 A 68 68 ASN H H 68 8.040 7.871 0.169 1
1 673 . 1 1 1 A 68 68 ASN HA H 68 4.240 4.480 -0.240 1
1 676 . 1 1 1 A 68 68 ASN CA C 68 54.100 54.324 -0.224 1
1 677 . 1 1 1 A 68 68 ASN CB C 68 37.200 36.715 0.485 1
1 678 . 1 1 1 A 68 68 ASN N N 68 115.600 115.146 0.454 1
1 679 . 1 1 1 A 69 69 ILE H H 69 7.200 7.456 -0.256 1
1 680 . 1 1 1 A 69 69 ILE HA H 69 3.280 4.823 -1.543 1
1 690 . 1 1 1 A 69 69 ILE CA C 69 59.800 59.070 0.730 1
1 691 . 1 1 1 A 69 69 ILE CB C 69 36.600 40.623 -4.023 1
1 695 . 1 1 1 A 69 69 ILE N N 69 119.100 114.026 5.074 1
1 696 . 1 1 1 A 70 70 GLN H H 70 7.570 8.513 -0.943 1
1 697 . 1 1 1 A 70 70 GLN HA H 70 4.410 4.626 -0.216 1
1 702 . 1 1 1 A 70 70 GLN CA C 70 53.500 54.378 -0.878 1
1 703 . 1 1 1 A 70 70 GLN CB C 70 31.500 28.522 2.978 1
1 705 . 1 1 1 A 70 70 GLN N N 70 124.800 120.870 3.930 1
1 706 . 1 1 1 A 71 71 LYS H H 71 8.370 8.857 -0.487 1
1 707 . 1 1 1 A 71 71 LYS HA H 71 3.870 4.285 -0.415 1
1 716 . 1 1 1 A 71 71 LYS CA C 71 58.000 55.881 2.119 1
1 717 . 1 1 1 A 71 71 LYS CB C 71 32.500 33.577 -1.077 1
1 720 . 1 1 1 A 71 71 LYS N N 71 120.200 127.052 -6.852 1
1 721 . 1 1 1 A 72 72 GLU H H 72 9.230 8.110 1.120 1
1 722 . 1 1 1 A 72 72 GLU HA H 72 3.240 4.188 -0.948 1
1 727 . 1 1 1 A 72 72 GLU CA C 72 58.300 56.823 1.477 1
1 728 . 1 1 1 A 72 72 GLU CB C 72 26.000 29.030 -3.030 1
1 730 . 1 1 1 A 72 72 GLU N N 72 115.100 117.101 -2.001 1
1 731 . 1 1 1 A 73 73 SER H H 73 7.690 8.047 -0.357 1
1 732 . 1 1 1 A 73 73 SER HA H 73 4.520 4.739 -0.219 1
1 735 . 1 1 1 A 73 73 SER CA C 73 61.100 58.267 2.833 1
1 736 . 1 1 1 A 73 73 SER CB C 73 64.800 63.970 0.830 1
1 737 . 1 1 1 A 73 73 SER N N 73 115.300 112.395 2.905 1
1 738 . 1 1 1 A 74 74 THR H H 74 8.620 7.665 0.955 1
1 739 . 1 1 1 A 74 74 THR HA H 74 5.200 5.140 0.060 1
1 744 . 1 1 1 A 74 74 THR CA C 74 62.400 61.813 0.587 1
1 745 . 1 1 1 A 74 74 THR CB C 74 70.200 70.828 -0.628 1
1 747 . 1 1 1 A 74 74 THR N N 74 117.500 112.775 4.725 1
1 748 . 1 1 1 A 75 75 LEU H H 75 9.350 9.149 0.201 1
1 749 . 1 1 1 A 75 75 LEU HA H 75 4.990 5.020 -0.030 1
1 759 . 1 1 1 A 75 75 LEU CA C 75 53.800 53.753 0.047 1
1 760 . 1 1 1 A 75 75 LEU CB C 75 44.400 46.369 -1.969 1
1 764 . 1 1 1 A 75 75 LEU N N 75 128.000 127.938 0.062 1
1 765 . 1 1 1 A 76 76 HIS H H 76 9.140 8.326 0.814 1
1 766 . 1 1 1 A 76 76 HIS HA H 76 5.040 5.140 -0.100 1
1 769 . 1 1 1 A 76 76 HIS CA C 76 56.200 54.184 2.016 1
1 770 . 1 1 1 A 76 76 HIS CB C 76 32.500 31.515 0.985 1
1 771 . 1 1 1 A 76 76 HIS N N 76 119.600 122.644 -3.044 1
1 772 . 1 1 1 A 77 77 LEU H H 77 8.240 8.953 -0.713 1
1 773 . 1 1 1 A 77 77 LEU HA H 77 5.080 5.458 -0.378 1
1 783 . 1 1 1 A 77 77 LEU CA C 77 53.600 53.776 -0.176 1
1 784 . 1 1 1 A 77 77 LEU CB C 77 44.100 43.597 0.503 1
1 788 . 1 1 1 A 77 77 LEU N N 77 123.800 121.156 2.644 1
1 789 . 1 1 1 A 78 78 VAL H H 78 9.110 8.863 0.247 1
1 790 . 1 1 1 A 78 78 VAL HA H 78 4.260 4.671 -0.411 1
1 798 . 1 1 1 A 78 78 VAL CA C 78 60.400 60.907 -0.507 1
1 799 . 1 1 1 A 78 78 VAL CB C 78 34.700 35.780 -1.080 1
1 802 . 1 1 1 A 78 78 VAL N N 78 127.100 124.216 2.884 1
1 803 . 1 1 1 A 79 79 LEU H H 79 8.050 8.894 -0.844 1
1 804 . 1 1 1 A 79 79 LEU HA H 79 4.950 4.913 0.037 1
1 813 . 1 1 1 A 79 79 LEU CA C 79 53.800 53.199 0.601 1
1 814 . 1 1 1 A 79 79 LEU CB C 79 42.700 44.340 -1.640 1
1 818 . 1 1 1 A 79 79 LEU N N 79 123.400 128.744 -5.344 1
1 819 . 1 1 1 A 80 80 ARG H H 80 8.540 9.079 -0.539 1
1 820 . 1 1 1 A 80 80 ARG HA H 80 4.170 3.942 0.228 1
1 827 . 1 1 1 A 80 80 ARG CA C 80 55.800 56.953 -1.153 1
1 828 . 1 1 1 A 80 80 ARG CB C 80 31.100 28.802 2.298 1
1 830 . 1 1 1 A 80 80 ARG N N 80 123.500 126.368 -2.868 1
1 831 . 1 1 1 A 81 81 LEU H H 81 8.250 7.728 0.522 1
1 832 . 1 1 1 A 81 81 LEU HA H 81 4.270 4.332 -0.062 1
1 842 . 1 1 1 A 81 81 LEU CA C 81 55.000 54.456 0.544 1
1 843 . 1 1 1 A 81 81 LEU CB C 81 42.200 43.347 -1.147 1
1 847 . 1 1 1 A 81 81 LEU N N 81 124.100 118.506 5.594 1
1 848 . 1 1 1 A 82 82 ARG H H 82 8.310 8.933 -0.623 1
1 849 . 1 1 1 A 82 82 ARG HA H 82 4.200 4.486 -0.286 1
1 852 . 1 1 1 A 82 82 ARG CA C 82 56.300 57.437 -1.137 1
1 853 . 1 1 1 A 82 82 ARG CB C 82 30.700 33.274 -2.574 1
1 855 . 1 1 1 A 82 82 ARG N N 82 121.500 122.109 -0.609 1
1 856 . 1 1 1 A 83 83 GLY H H 83 8.410 8.471 -0.061 1
1 857 . 1 1 1 A 83 83 GLY HA2 H 83 3.750 4.038 -0.288 1
1 858 . 1 1 1 A 83 83 GLY HA3 H 83 3.754 4.039 -0.285 1
1 859 . 1 1 1 A 83 83 GLY CA C 83 45.100 45.677 -0.577 1
1 860 . 1 1 1 A 83 83 GLY N N 83 110.200 106.784 3.416 1
1 861 . 1 1 1 A 84 84 TYR H H 84 7.950 8.108 -0.158 1
1 862 . 1 1 1 A 84 84 TYR HA H 84 4.400 4.929 -0.529 1
1 865 . 1 1 1 A 84 84 TYR CA C 84 58.100 58.199 -0.099 1
1 866 . 1 1 1 A 84 84 TYR CB C 84 38.800 41.037 -2.237 1
1 867 . 1 1 1 A 84 84 TYR N N 84 119.900 124.330 -4.430 1
1 868 . 1 1 1 A 85 85 ALA H H 85 8.150 8.626 -0.476 1
1 869 . 1 1 1 A 85 85 ALA HA H 85 4.150 5.112 -0.962 1
1 873 . 1 1 1 A 85 85 ALA CA C 85 52.600 50.373 2.227 1
1 874 . 1 1 1 A 85 85 ALA CB C 85 19.200 23.986 -4.786 1
1 875 . 1 1 1 A 85 85 ALA N N 85 124.800 130.073 -5.273 1
1 876 . 1 1 1 A 86 86 ASP H H 86 8.020 8.443 -0.423 1
1 877 . 1 1 1 A 86 86 ASP HA H 86 4.450 4.985 -0.535 1
1 880 . 1 1 1 A 86 86 ASP CA C 86 54.100 53.384 0.716 1
1 881 . 1 1 1 A 86 86 ASP CB C 86 41.100 44.138 -3.038 1
1 882 . 1 1 1 A 86 86 ASP N N 86 118.900 117.576 1.324 1
1 883 . 1 1 1 A 87 87 LEU H H 87 8.010 8.352 -0.342 1
1 884 . 1 1 1 A 87 87 LEU HA H 87 4.210 4.387 -0.177 1
1 893 . 1 1 1 A 87 87 LEU CA C 87 55.300 55.499 -0.199 1
1 894 . 1 1 1 A 87 87 LEU CB C 87 42.000 43.132 -1.132 1
1 898 . 1 1 1 A 87 87 LEU N N 87 122.400 121.405 0.995 1
1 899 . 1 1 1 A 88 88 ARG H H 88 8.170 7.767 0.403 1
1 900 . 1 1 1 A 88 88 ARG HA H 88 4.210 4.663 -0.453 1
1 903 . 1 1 1 A 88 88 ARG CA C 88 56.300 54.174 2.126 1
1 904 . 1 1 1 A 88 88 ARG CB C 88 30.600 32.866 -2.266 1
1 905 . 1 1 1 A 88 88 ARG N N 88 121.200 120.729 0.471 1
1 906 . 1 1 1 A 91 91 PRO HA H 91 4.290 4.743 -0.453 1
1 911 . 1 1 1 A 91 91 PRO CA C 91 63.800 62.621 1.179 1
1 912 . 1 1 1 A 91 91 PRO CB C 91 32.100 30.527 1.573 1
1 915 . 1 1 1 A 92 92 ASP H H 92 8.280 8.003 0.277 1
1 916 . 1 1 1 A 92 92 ASP HA H 92 4.540 5.069 -0.529 1
1 919 . 1 1 1 A 92 92 ASP CA C 92 54.600 53.270 1.330 1
1 920 . 1 1 1 A 92 92 ASP CB C 92 41.000 45.137 -4.137 1
1 921 . 1 1 1 A 92 92 ASP N N 92 118.700 124.006 -5.306 1
1 922 . 1 1 1 A 93 93 ARG H H 93 7.780 8.884 -1.104 1
1 923 . 1 1 1 A 93 93 ARG HA H 93 4.190 4.774 -0.584 1
1 930 . 1 1 1 A 93 93 ARG CA C 93 56.300 54.100 2.200 1
1 931 . 1 1 1 A 93 93 ARG CB C 93 30.700 33.755 -3.055 1
1 934 . 1 1 1 A 93 93 ARG N N 93 120.700 122.488 -1.788 1
1 935 . 1 1 1 A 94 94 GLN H H 94 8.280 8.415 -0.135 1
1 936 . 1 1 1 A 94 94 GLN HA H 94 4.210 4.648 -0.438 1
1 941 . 1 1 1 A 94 94 GLN CA C 94 55.800 55.252 0.548 1
1 942 . 1 1 1 A 94 94 GLN CB C 94 29.300 30.526 -1.226 1
1 944 . 1 1 1 A 94 94 GLN N N 94 121.000 119.278 1.722 1
1 945 . 1 1 1 A 95 95 ASP H H 95 8.270 8.869 -0.599 1
1 946 . 1 1 1 A 95 95 ASP HA H 95 4.450 4.979 -0.529 1
1 949 . 1 1 1 A 95 95 ASP CA C 95 54.300 53.228 1.072 1
1 950 . 1 1 1 A 95 95 ASP CB C 95 41.000 40.109 0.891 1
1 951 . 1 1 1 A 95 95 ASP N N 95 121.000 123.688 -2.688 1
1 952 . 1 1 1 A 96 96 HIS H H 96 8.090 8.501 -0.411 1
1 953 . 1 1 1 A 96 96 HIS HA H 96 4.470 4.909 -0.439 1
1 956 . 1 1 1 A 96 96 HIS CA C 96 55.900 56.185 -0.285 1
1 957 . 1 1 1 A 96 96 HIS CB C 96 30.500 31.886 -1.386 1
1 958 . 1 1 1 A 96 96 HIS N N 96 119.300 120.797 -1.497 1
1 959 . 1 1 1 A 97 97 HIS H H 97 8.240 8.847 -0.607 1
1 960 . 1 1 1 A 97 97 HIS HA H 97 4.470 4.911 -0.441 1
1 963 . 1 1 1 A 97 97 HIS CA C 97 56.200 53.887 2.313 1
1 964 . 1 1 1 A 97 97 HIS CB C 97 30.400 32.141 -1.741 1
1 965 . 1 1 1 A 97 97 HIS N N 97 121.300 118.112 3.188 1
1 966 . 1 1 1 A 98 98 PRO HA H 98 4.340 4.513 -0.173 1
1 973 . 1 1 1 A 98 98 PRO CA C 98 63.700 62.734 0.966 1
1 974 . 1 1 1 A 98 98 PRO CB C 98 31.900 32.459 -0.559 1
1 977 . 1 1 1 A 99 99 GLY H H 99 8.660 8.550 0.110 1
1 978 . 1 1 1 A 99 99 GLY HA2 H 99 3.920 4.057 -0.137 1
1 979 . 1 1 1 A 99 99 GLY HA3 H 99 3.920 4.061 -0.141 1
1 980 . 1 1 1 A 99 99 GLY CA C 99 45.200 46.568 -1.368 1
1 981 . 1 1 1 A 99 99 GLY N N 99 110.000 108.574 1.426 1
1 982 . 1 1 1 A 100 100 SER H H 100 8.170 8.233 -0.063 1
1 983 . 1 1 1 A 100 100 SER HA H 100 4.360 4.080 0.280 1
1 986 . 1 1 1 A 100 100 SER CA C 100 58.500 59.090 -0.590 1
1 987 . 1 1 1 A 100 100 SER CB C 100 64.000 61.480 2.520 1
1 988 . 1 1 1 A 100 100 SER N N 100 115.600 114.581 1.019 1
1 989 . 1 1 1 A 101 101 GLY H H 101 8.420 8.097 0.323 1
1 990 . 1 1 1 A 101 101 GLY HA2 H 101 3.890 4.113 -0.223 1
1 991 . 1 1 1 A 101 101 GLY HA3 H 101 3.920 4.113 -0.193 1
1 992 . 1 1 1 A 101 101 GLY CA C 101 45.200 45.606 -0.406 1
1 993 . 1 1 1 A 101 101 GLY N N 101 111.000 107.884 3.116 1
1 994 . 1 1 1 A 102 102 ALA H H 102 8.030 8.740 -0.710 1
1 995 . 1 1 1 A 102 102 ALA HA H 102 4.250 4.673 -0.423 1
1 999 . 1 1 1 A 102 102 ALA CA C 102 52.500 50.417 2.083 1
1 1000 . 1 1 1 A 102 102 ALA CB C 102 19.200 21.520 -2.320 1
1 4 . 2 1 1 A 2 2 SER H H 2 8.160 8.929 -0.769 1
1 5 . 2 1 1 A 2 2 SER HA H 2 4.370 5.061 -0.691 1
1 9 . 2 1 1 A 2 2 SER CA C 2 58.300 57.414 0.886 1
1 10 . 2 1 1 A 2 2 SER CB C 2 63.900 67.164 -3.264 1
1 11 . 2 1 1 A 2 2 SER N N 2 115.600 120.138 -4.538 1
1 12 . 2 1 1 A 3 3 LEU H H 3 8.250 8.392 -0.142 1
1 13 . 2 1 1 A 3 3 LEU HA H 3 4.280 4.232 0.048 1
1 17 . 2 1 1 A 3 3 LEU CA C 3 55.200 54.917 0.283 1
1 18 . 2 1 1 A 3 3 LEU CB C 3 42.100 42.954 -0.854 1
1 19 . 2 1 1 A 3 3 LEU N N 3 124.100 122.028 2.072 1
1 20 . 2 1 1 A 4 4 VAL H H 4 7.950 8.740 -0.790 1
1 21 . 2 1 1 A 4 4 VAL HA H 4 4.680 4.830 -0.150 1
1 26 . 2 1 1 A 4 4 VAL CA C 4 59.800 58.086 1.714 1
1 27 . 2 1 1 A 4 4 VAL CB C 4 32.500 33.652 -1.152 1
1 28 . 2 1 1 A 4 4 VAL N N 4 122.600 113.966 8.634 1
1 29 . 2 1 1 A 5 5 PRO CA C 5 63.100 62.613 0.487 1
1 30 . 2 1 1 A 5 5 PRO CB C 5 32.000 33.318 -1.318 1
1 32 . 2 1 1 A 6 6 ARG H H 6 8.360 8.756 -0.396 1
1 33 . 2 1 1 A 6 6 ARG HA H 6 4.250 4.930 -0.680 1
1 36 . 2 1 1 A 6 6 ARG CA C 6 56.000 55.488 0.512 1
1 37 . 2 1 1 A 6 6 ARG CB C 6 30.900 33.486 -2.586 1
1 38 . 2 1 1 A 6 6 ARG N N 6 121.800 122.737 -0.937 1
1 39 . 2 1 1 A 7 7 GLY H H 7 8.460 8.374 0.086 1
1 40 . 2 1 1 A 7 7 GLY HA2 H 7 3.940 4.240 -0.300 1
1 41 . 2 1 1 A 7 7 GLY HA3 H 7 3.760 4.248 -0.488 1
1 42 . 2 1 1 A 7 7 GLY CA C 7 45.000 45.349 -0.349 1
1 43 . 2 1 1 A 7 7 GLY N N 7 110.700 113.090 -2.390 1
1 44 . 2 1 1 A 8 8 SER H H 8 7.990 8.832 -0.842 1
1 45 . 2 1 1 A 8 8 SER HA H 8 4.450 4.516 -0.066 1
1 48 . 2 1 1 A 8 8 SER CA C 8 58.900 59.414 -0.514 1
1 49 . 2 1 1 A 8 8 SER CB C 8 64.200 64.477 -0.277 1
1 50 . 2 1 1 A 8 8 SER N N 8 115.500 116.034 -0.534 1
1 51 . 2 1 1 A 9 9 MET H H 9 9.040 7.472 1.568 1
1 52 . 2 1 1 A 9 9 MET HA H 9 4.610 5.101 -0.491 1
1 60 . 2 1 1 A 9 9 MET CA C 9 54.400 53.622 0.778 1
1 61 . 2 1 1 A 9 9 MET CB C 9 35.400 33.877 1.523 1
1 64 . 2 1 1 A 9 9 MET N N 9 120.500 119.292 1.208 1
1 65 . 2 1 1 A 10 10 GLN H H 10 8.270 8.940 -0.670 1
1 66 . 2 1 1 A 10 10 GLN HA H 10 5.270 5.249 0.021 1
1 71 . 2 1 1 A 10 10 GLN CA C 10 54.200 54.352 -0.152 1
1 72 . 2 1 1 A 10 10 GLN CB C 10 30.500 32.327 -1.827 1
1 74 . 2 1 1 A 10 10 GLN N N 10 121.000 122.279 -1.279 1
1 75 . 2 1 1 A 11 11 ILE H H 11 8.270 8.712 -0.442 1
1 76 . 2 1 1 A 11 11 ILE HA H 11 4.100 4.753 -0.653 1
1 86 . 2 1 1 A 11 11 ILE CA C 11 59.400 59.143 0.257 1
1 87 . 2 1 1 A 11 11 ILE CB C 11 41.800 40.773 1.027 1
1 91 . 2 1 1 A 11 11 ILE N N 11 114.600 121.324 -6.724 1
1 92 . 2 1 1 A 12 12 PHE H H 12 8.520 8.833 -0.313 1
1 93 . 2 1 1 A 12 12 PHE HA H 12 5.540 5.316 0.224 1
1 96 . 2 1 1 A 12 12 PHE CA C 12 55.000 56.935 -1.935 1
1 97 . 2 1 1 A 12 12 PHE CB C 12 41.200 40.786 0.414 1
1 98 . 2 1 1 A 12 12 PHE N N 12 118.600 123.415 -4.815 1
1 99 . 2 1 1 A 13 13 VAL H H 13 9.230 9.034 0.196 1
1 100 . 2 1 1 A 13 13 VAL HA H 13 4.740 5.105 -0.365 1
1 108 . 2 1 1 A 13 13 VAL CA C 13 60.300 60.178 0.122 1
1 109 . 2 1 1 A 13 13 VAL CB C 13 34.100 35.235 -1.135 1
1 112 . 2 1 1 A 13 13 VAL N N 13 121.400 122.140 -0.740 1
1 113 . 2 1 1 A 14 14 LYS H H 14 8.910 8.622 0.288 1
1 114 . 2 1 1 A 14 14 LYS HA H 14 5.190 4.775 0.415 1
1 122 . 2 1 1 A 14 14 LYS CA C 14 54.600 54.877 -0.277 1
1 123 . 2 1 1 A 14 14 LYS CB C 14 34.300 34.396 -0.096 1
1 126 . 2 1 1 A 14 14 LYS N N 14 128.000 126.158 1.842 1
1 127 . 2 1 1 A 15 15 THR H H 15 8.650 8.801 -0.151 1
1 128 . 2 1 1 A 15 15 THR HA H 15 4.870 4.692 0.178 1
1 133 . 2 1 1 A 15 15 THR CA C 15 60.300 60.782 -0.482 1
1 134 . 2 1 1 A 15 15 THR CB C 15 70.600 71.330 -0.730 1
1 136 . 2 1 1 A 15 15 THR N N 15 115.300 117.911 -2.611 1
1 137 . 2 1 1 A 16 16 LEU H H 16 9.070 8.764 0.306 1
1 138 . 2 1 1 A 16 16 LEU HA H 16 4.210 4.159 0.051 1
1 148 . 2 1 1 A 16 16 LEU CA C 16 57.400 57.108 0.292 1
1 149 . 2 1 1 A 16 16 LEU CB C 16 41.800 41.907 -0.107 1
1 153 . 2 1 1 A 16 16 LEU N N 16 121.400 119.316 2.084 1
1 154 . 2 1 1 A 17 17 THR H H 17 7.560 7.831 -0.271 1
1 155 . 2 1 1 A 17 17 THR HA H 17 4.330 4.356 -0.026 1
1 160 . 2 1 1 A 17 17 THR CA C 17 61.400 63.282 -1.882 1
1 161 . 2 1 1 A 17 17 THR CB C 17 68.900 69.945 -1.045 1
1 163 . 2 1 1 A 17 17 THR N N 17 105.900 113.947 -8.047 1
1 164 . 2 1 1 A 18 18 GLY H H 18 7.750 7.848 -0.098 1
1 165 . 2 1 1 A 18 18 GLY HA2 H 18 4.250 4.049 0.201 1
1 166 . 2 1 1 A 18 18 GLY HA3 H 18 3.520 4.052 -0.532 1
1 167 . 2 1 1 A 18 18 GLY CA C 18 45.300 45.117 0.183 1
1 168 . 2 1 1 A 18 18 GLY N N 18 109.300 109.372 -0.072 1
1 169 . 2 1 1 A 19 19 LYS H H 19 7.210 7.894 -0.684 1
1 170 . 2 1 1 A 19 19 LYS HA H 19 4.260 4.297 -0.037 1
1 175 . 2 1 1 A 19 19 LYS CA C 19 56.300 56.667 -0.367 1
1 176 . 2 1 1 A 19 19 LYS CB C 19 33.200 34.030 -0.830 1
1 179 . 2 1 1 A 19 19 LYS N N 19 122.000 122.010 -0.010 1
1 180 . 2 1 1 A 20 20 THR H H 20 8.570 8.846 -0.276 1
1 181 . 2 1 1 A 20 20 THR HA H 20 4.950 5.585 -0.635 1
1 186 . 2 1 1 A 20 20 THR CA C 20 62.200 60.531 1.669 1
1 187 . 2 1 1 A 20 20 THR CB C 20 69.700 70.847 -1.147 1
1 189 . 2 1 1 A 20 20 THR N N 20 120.700 114.094 6.606 1
1 190 . 2 1 1 A 21 21 ILE H H 21 9.510 8.866 0.644 1
1 191 . 2 1 1 A 21 21 ILE HA H 21 4.390 4.833 -0.443 1
1 201 . 2 1 1 A 21 21 ILE CA C 21 60.000 59.021 0.979 1
1 202 . 2 1 1 A 21 21 ILE CB C 21 40.700 41.658 -0.958 1
1 206 . 2 1 1 A 21 21 ILE N N 21 128.200 123.137 5.063 1
1 207 . 2 1 1 A 22 22 THR H H 22 8.700 8.631 0.069 1
1 208 . 2 1 1 A 22 22 THR HA H 22 4.860 4.553 0.307 1
1 213 . 2 1 1 A 22 22 THR CA C 22 62.100 62.524 -0.424 1
1 214 . 2 1 1 A 22 22 THR CB C 22 69.500 69.624 -0.124 1
1 216 . 2 1 1 A 22 22 THR N N 22 122.300 121.048 1.252 1
1 217 . 2 1 1 A 23 23 LEU H H 23 8.720 8.728 -0.008 1
1 218 . 2 1 1 A 23 23 LEU HA H 23 4.690 5.022 -0.332 1
1 228 . 2 1 1 A 23 23 LEU CA C 23 52.700 53.789 -1.089 1
1 229 . 2 1 1 A 23 23 LEU CB C 23 46.600 45.836 0.764 1
1 233 . 2 1 1 A 23 23 LEU N N 23 125.400 126.483 -1.083 1
1 234 . 2 1 1 A 24 24 GLU H H 24 8.080 8.817 -0.737 1
1 235 . 2 1 1 A 24 24 GLU HA H 24 4.800 5.054 -0.254 1
1 238 . 2 1 1 A 24 24 GLU CA C 24 55.400 55.168 0.232 1
1 239 . 2 1 1 A 24 24 GLU CB C 24 30.100 31.894 -1.794 1
1 241 . 2 1 1 A 24 24 GLU N N 24 121.800 121.809 -0.009 1
1 242 . 2 1 1 A 25 25 VAL H H 25 8.800 8.897 -0.097 1
1 243 . 2 1 1 A 25 25 VAL HA H 25 4.640 4.975 -0.335 1
1 251 . 2 1 1 A 25 25 VAL CA C 25 58.600 59.392 -0.792 1
1 252 . 2 1 1 A 25 25 VAL CB C 25 36.300 35.489 0.811 1
1 255 . 2 1 1 A 25 25 VAL N N 25 116.700 120.230 -3.530 1
1 256 . 2 1 1 A 26 26 GLU H H 26 8.500 8.451 0.049 1
1 257 . 2 1 1 A 26 26 GLU HA H 26 4.900 4.533 0.367 1
1 260 . 2 1 1 A 26 26 GLU CA C 26 53.000 54.238 -1.238 1
1 261 . 2 1 1 A 26 26 GLU CB C 26 31.200 33.103 -1.903 1
1 262 . 2 1 1 A 26 26 GLU N N 26 117.900 121.752 -3.852 1
1 263 . 2 1 1 A 27 27 PRO HA H 27 4.040 4.349 -0.309 1
1 270 . 2 1 1 A 27 27 PRO CA C 27 65.400 64.693 0.707 1
1 271 . 2 1 1 A 27 27 PRO CB C 27 31.700 31.904 -0.204 1
1 274 . 2 1 1 A 28 28 SER H H 28 7.010 8.080 -1.070 1
1 275 . 2 1 1 A 28 28 SER HA H 28 4.280 4.431 -0.151 1
1 278 . 2 1 1 A 28 28 SER CA C 28 57.400 58.293 -0.893 1
1 279 . 2 1 1 A 28 28 SER CB C 28 63.400 64.151 -0.751 1
1 280 . 2 1 1 A 28 28 SER N N 28 103.800 110.363 -6.563 1
1 281 . 2 1 1 A 29 29 ASP H H 29 7.960 7.650 0.310 1
1 282 . 2 1 1 A 29 29 ASP HA H 29 4.600 5.129 -0.529 1
1 285 . 2 1 1 A 29 29 ASP CA C 29 55.900 53.090 2.810 1
1 286 . 2 1 1 A 29 29 ASP CB C 29 41.000 43.190 -2.190 1
1 287 . 2 1 1 A 29 29 ASP N N 29 123.700 122.512 1.188 1
1 288 . 2 1 1 A 30 30 THR H H 30 7.780 8.843 -1.063 1
1 289 . 2 1 1 A 30 30 THR HA H 30 4.850 4.527 0.323 1
1 294 . 2 1 1 A 30 30 THR CA C 30 59.400 60.990 -1.590 1
1 295 . 2 1 1 A 30 30 THR CB C 30 71.100 70.180 0.920 1
1 297 . 2 1 1 A 30 30 THR N N 30 108.800 120.007 -11.207 1
1 298 . 2 1 1 A 31 31 ILE H H 31 8.320 8.877 -0.557 1
1 299 . 2 1 1 A 31 31 ILE HA H 31 3.580 3.728 -0.148 1
1 309 . 2 1 1 A 31 31 ILE CA C 31 62.200 64.671 -2.471 1
1 310 . 2 1 1 A 31 31 ILE CB C 31 34.300 37.565 -3.265 1
1 314 . 2 1 1 A 31 31 ILE N N 31 121.300 127.225 -5.925 1
1 315 . 2 1 1 A 32 32 GLU H H 32 9.850 8.438 1.412 1
1 316 . 2 1 1 A 32 32 GLU HA H 32 3.780 3.957 -0.177 1
1 321 . 2 1 1 A 32 32 GLU CA C 32 60.500 59.683 0.817 1
1 322 . 2 1 1 A 32 32 GLU CB C 32 28.800 29.172 -0.372 1
1 324 . 2 1 1 A 32 32 GLU N N 32 121.600 121.806 -0.206 1
1 325 . 2 1 1 A 33 33 ASN H H 33 7.810 7.556 0.254 1
1 326 . 2 1 1 A 33 33 ASN HA H 33 4.440 4.516 -0.076 1
1 329 . 2 1 1 A 33 33 ASN CA C 33 55.800 55.908 -0.108 1
1 330 . 2 1 1 A 33 33 ASN CB C 33 38.100 38.662 -0.562 1
1 331 . 2 1 1 A 33 33 ASN N N 33 121.000 118.134 2.866 1
1 332 . 2 1 1 A 34 34 VAL H H 34 8.000 7.959 0.041 1
1 333 . 2 1 1 A 34 34 VAL HA H 34 3.300 3.774 -0.474 1
1 341 . 2 1 1 A 34 34 VAL CA C 34 67.600 66.602 0.998 1
1 342 . 2 1 1 A 34 34 VAL CB C 34 30.700 31.624 -0.924 1
1 345 . 2 1 1 A 34 34 VAL N N 34 122.200 120.158 2.042 1
1 346 . 2 1 1 A 35 35 LYS H H 35 8.490 8.547 -0.057 1
1 347 . 2 1 1 A 35 35 LYS HA H 35 4.500 4.070 0.430 1
1 352 . 2 1 1 A 35 35 LYS CA C 35 59.300 58.620 0.680 1
1 353 . 2 1 1 A 35 35 LYS CB C 35 33.500 31.870 1.630 1
1 354 . 2 1 1 A 35 35 LYS N N 35 119.200 120.299 -1.099 1
1 355 . 2 1 1 A 36 36 ALA H H 36 7.880 8.311 -0.431 1
1 356 . 2 1 1 A 36 36 ALA HA H 36 4.060 4.004 0.056 1
1 360 . 2 1 1 A 36 36 ALA CA C 36 55.300 55.431 -0.131 1
1 361 . 2 1 1 A 36 36 ALA CB C 36 17.600 18.368 -0.768 1
1 362 . 2 1 1 A 36 36 ALA N N 36 123.300 122.269 1.031 1
1 363 . 2 1 1 A 37 37 LYS H H 37 7.790 7.814 -0.024 1
1 364 . 2 1 1 A 37 37 LYS HA H 37 4.110 3.951 0.159 1
1 373 . 2 1 1 A 37 37 LYS CA C 37 59.700 59.513 0.187 1
1 374 . 2 1 1 A 37 37 LYS CB C 37 33.100 32.343 0.757 1
1 378 . 2 1 1 A 37 37 LYS N N 37 120.400 117.113 3.287 1
1 379 . 2 1 1 A 38 38 ILE H H 38 8.240 7.607 0.633 1
1 380 . 2 1 1 A 38 38 ILE HA H 38 3.410 3.982 -0.572 1
1 390 . 2 1 1 A 38 38 ILE CA C 38 66.200 62.037 4.163 1
1 391 . 2 1 1 A 38 38 ILE CB C 38 36.800 37.730 -0.930 1
1 395 . 2 1 1 A 38 38 ILE N N 38 121.400 119.898 1.502 1
1 396 . 2 1 1 A 39 39 GLN H H 39 8.460 8.349 0.111 1
1 397 . 2 1 1 A 39 39 GLN HA H 39 3.730 4.044 -0.314 1
1 402 . 2 1 1 A 39 39 GLN CA C 39 60.000 58.935 1.065 1
1 403 . 2 1 1 A 39 39 GLN CB C 39 27.600 28.151 -0.551 1
1 405 . 2 1 1 A 39 39 GLN N N 39 123.500 121.859 1.641 1
1 406 . 2 1 1 A 40 40 ASP H H 40 7.970 7.746 0.224 1
1 407 . 2 1 1 A 40 40 ASP HA H 40 4.240 4.329 -0.089 1
1 410 . 2 1 1 A 40 40 ASP CA C 40 57.400 56.574 0.826 1
1 411 . 2 1 1 A 40 40 ASP CB C 40 41.000 40.693 0.307 1
1 412 . 2 1 1 A 40 40 ASP N N 40 119.900 119.508 0.392 1
1 413 . 2 1 1 A 41 41 LYS H H 41 7.420 7.687 -0.267 1
1 414 . 2 1 1 A 41 41 LYS HA H 41 4.200 3.795 0.405 1
1 423 . 2 1 1 A 41 41 LYS CA C 41 58.200 58.979 -0.779 1
1 424 . 2 1 1 A 41 41 LYS CB C 41 33.900 32.593 1.307 1
1 427 . 2 1 1 A 41 41 LYS N N 41 115.700 118.953 -3.253 1
1 428 . 2 1 1 A 42 42 GLU H H 42 8.650 7.668 0.982 1
1 429 . 2 1 1 A 42 42 GLU HA H 42 4.470 4.624 -0.154 1
1 434 . 2 1 1 A 42 42 GLU CA C 42 55.300 55.773 -0.473 1
1 435 . 2 1 1 A 42 42 GLU CB C 42 33.200 32.130 1.070 1
1 437 . 2 1 1 A 42 42 GLU N N 42 114.200 113.657 0.543 1
1 438 . 2 1 1 A 43 43 GLY H H 43 8.400 7.857 0.543 1
1 439 . 2 1 1 A 43 43 GLY HA2 H 43 4.040 3.945 0.095 1
1 440 . 2 1 1 A 43 43 GLY HA3 H 43 3.820 3.957 -0.137 1
1 441 . 2 1 1 A 43 43 GLY CA C 43 45.900 45.501 0.399 1
1 442 . 2 1 1 A 43 43 GLY N N 43 109.000 109.857 -0.857 1
1 443 . 2 1 1 A 44 44 ILE H H 44 6.080 7.513 -1.433 1
1 444 . 2 1 1 A 44 44 ILE HA H 44 4.290 4.211 0.079 1
1 446 . 2 1 1 A 44 44 ILE CA C 44 57.700 59.047 -1.347 1
1 447 . 2 1 1 A 44 44 ILE CB C 44 40.400 38.649 1.751 1
1 448 . 2 1 1 A 44 44 ILE N N 44 120.500 122.478 -1.978 1
1 449 . 2 1 1 A 46 46 PRO HA H 46 4.030 4.209 -0.179 1
1 454 . 2 1 1 A 46 46 PRO CA C 46 66.100 65.292 0.808 1
1 455 . 2 1 1 A 46 46 PRO CB C 46 32.600 32.093 0.507 1
1 458 . 2 1 1 A 47 47 ASP H H 47 8.470 8.507 -0.037 1
1 459 . 2 1 1 A 47 47 ASP HA H 47 4.310 4.413 -0.103 1
1 462 . 2 1 1 A 47 47 ASP CA C 47 55.700 56.821 -1.121 1
1 463 . 2 1 1 A 47 47 ASP CB C 47 39.700 41.211 -1.511 1
1 464 . 2 1 1 A 47 47 ASP N N 47 113.700 117.177 -3.477 1
1 465 . 2 1 1 A 48 48 GLN H H 48 7.720 7.504 0.216 1
1 466 . 2 1 1 A 48 48 GLN HA H 48 4.340 4.418 -0.078 1
1 471 . 2 1 1 A 48 48 GLN CA C 48 55.500 55.868 -0.368 1
1 472 . 2 1 1 A 48 48 GLN CB C 48 29.900 30.326 -0.426 1
1 474 . 2 1 1 A 48 48 GLN N N 48 116.900 115.628 1.272 1
1 475 . 2 1 1 A 49 49 GLN H H 49 7.410 7.956 -0.546 1
1 476 . 2 1 1 A 49 49 GLN HA H 49 4.110 4.116 -0.006 1
1 481 . 2 1 1 A 49 49 GLN CA C 49 56.600 56.241 0.359 1
1 482 . 2 1 1 A 49 49 GLN CB C 49 31.300 28.971 2.329 1
1 484 . 2 1 1 A 49 49 GLN N N 49 118.000 120.878 -2.878 1
1 485 . 2 1 1 A 50 50 ARG H H 50 8.400 8.592 -0.192 1
1 486 . 2 1 1 A 50 50 ARG HA H 50 4.380 4.500 -0.120 1
1 491 . 2 1 1 A 50 50 ARG CA C 50 55.100 56.279 -1.179 1
1 492 . 2 1 1 A 50 50 ARG CB C 50 31.600 30.805 0.795 1
1 494 . 2 1 1 A 50 50 ARG N N 50 123.100 126.930 -3.830 1
1 495 . 2 1 1 A 51 51 LEU H H 51 8.710 8.889 -0.179 1
1 496 . 2 1 1 A 51 51 LEU HA H 51 5.300 5.220 0.080 1
1 506 . 2 1 1 A 51 51 LEU CA C 51 52.900 53.659 -0.759 1
1 507 . 2 1 1 A 51 51 LEU CB C 51 45.700 43.998 1.702 1
1 511 . 2 1 1 A 51 51 LEU N N 51 124.400 125.177 -0.777 1
1 512 . 2 1 1 A 52 52 ILE H H 52 9.060 9.073 -0.013 1
1 513 . 2 1 1 A 52 52 ILE HA H 52 4.840 5.032 -0.192 1
1 523 . 2 1 1 A 52 52 ILE CA C 52 58.900 60.103 -1.203 1
1 524 . 2 1 1 A 52 52 ILE CB C 52 41.200 41.022 0.178 1
1 528 . 2 1 1 A 52 52 ILE N N 52 122.500 126.208 -3.708 1
1 529 . 2 1 1 A 53 53 PHE H H 53 8.730 9.472 -0.742 1
1 530 . 2 1 1 A 53 53 PHE HA H 53 5.100 4.811 0.289 1
1 535 . 2 1 1 A 53 53 PHE CA C 53 56.300 57.476 -1.176 1
1 536 . 2 1 1 A 53 53 PHE CB C 53 43.500 41.937 1.563 1
1 537 . 2 1 1 A 53 53 PHE N N 53 124.800 127.843 -3.043 1
1 538 . 2 1 1 A 54 54 ALA H H 54 8.940 9.104 -0.164 1
1 539 . 2 1 1 A 54 54 ALA HA H 54 3.610 3.864 -0.254 1
1 543 . 2 1 1 A 54 54 ALA CA C 54 52.500 53.000 -0.500 1
1 544 . 2 1 1 A 54 54 ALA CB C 54 16.300 17.397 -1.097 1
1 545 . 2 1 1 A 54 54 ALA N N 54 133.100 130.292 2.808 1
1 546 . 2 1 1 A 55 55 GLY H H 55 8.070 8.342 -0.272 1
1 547 . 2 1 1 A 55 55 GLY HA2 H 55 4.000 3.791 0.209 1
1 548 . 2 1 1 A 55 55 GLY HA3 H 55 3.340 3.819 -0.479 1
1 549 . 2 1 1 A 55 55 GLY CA C 55 45.200 45.243 -0.043 1
1 550 . 2 1 1 A 55 55 GLY N N 55 102.500 102.645 -0.145 1
1 551 . 2 1 1 A 56 56 LYS H H 56 7.860 7.952 -0.092 1
1 552 . 2 1 1 A 56 56 LYS HA H 56 4.510 4.589 -0.079 1
1 558 . 2 1 1 A 56 56 LYS CA C 56 54.500 54.711 -0.211 1
1 559 . 2 1 1 A 56 56 LYS CB C 56 34.400 33.794 0.606 1
1 561 . 2 1 1 A 56 56 LYS N N 56 121.800 121.956 -0.156 1
1 562 . 2 1 1 A 57 57 GLN H H 57 8.600 8.500 0.100 1
1 563 . 2 1 1 A 57 57 GLN HA H 57 4.410 4.766 -0.356 1
1 568 . 2 1 1 A 57 57 GLN CA C 57 55.900 55.464 0.436 1
1 569 . 2 1 1 A 57 57 GLN CB C 57 28.800 29.688 -0.888 1
1 571 . 2 1 1 A 57 57 GLN N N 57 123.200 124.692 -1.492 1
1 572 . 2 1 1 A 58 58 LEU H H 58 8.480 8.230 0.250 1
1 573 . 2 1 1 A 58 58 LEU HA H 58 4.060 4.882 -0.822 1
1 583 . 2 1 1 A 58 58 LEU CA C 58 54.100 53.805 0.295 1
1 584 . 2 1 1 A 58 58 LEU CB C 58 41.500 42.832 -1.332 1
1 588 . 2 1 1 A 58 58 LEU N N 58 125.900 122.830 3.070 1
1 589 . 2 1 1 A 59 59 GLU H H 59 8.400 9.291 -0.891 1
1 590 . 2 1 1 A 59 59 GLU HA H 59 4.400 4.485 -0.085 1
1 595 . 2 1 1 A 59 59 GLU CA C 59 55.900 58.332 -2.432 1
1 596 . 2 1 1 A 59 59 GLU CB C 59 31.900 30.688 1.212 1
1 598 . 2 1 1 A 59 59 GLU N N 59 123.100 121.828 1.272 1
1 599 . 2 1 1 A 60 60 ASP H H 60 8.110 8.292 -0.182 1
1 600 . 2 1 1 A 60 60 ASP HA H 60 4.270 4.899 -0.629 1
1 603 . 2 1 1 A 60 60 ASP CA C 60 57.100 52.198 4.902 1
1 604 . 2 1 1 A 60 60 ASP CB C 60 40.800 43.763 -2.963 1
1 605 . 2 1 1 A 60 60 ASP N N 60 120.300 119.097 1.203 1
1 606 . 2 1 1 A 61 61 GLY HA2 H 61 4.000 3.918 0.082 1
1 607 . 2 1 1 A 61 61 GLY HA3 H 61 3.830 3.964 -0.134 1
1 608 . 2 1 1 A 61 61 GLY CA C 61 45.000 45.433 -0.433 1
1 609 . 2 1 1 A 62 62 ARG H H 62 7.350 8.528 -1.178 1
1 610 . 2 1 1 A 62 62 ARG HA H 62 4.640 4.805 -0.165 1
1 615 . 2 1 1 A 62 62 ARG CA C 62 54.400 53.876 0.524 1
1 616 . 2 1 1 A 62 62 ARG CB C 62 32.600 33.114 -0.514 1
1 618 . 2 1 1 A 62 62 ARG N N 62 119.300 124.676 -5.376 1
1 619 . 2 1 1 A 63 63 THR H H 63 8.460 8.727 -0.267 1
1 620 . 2 1 1 A 63 63 THR HA H 63 5.060 4.551 0.509 1
1 625 . 2 1 1 A 63 63 THR CA C 63 59.700 60.757 -1.057 1
1 626 . 2 1 1 A 63 63 THR CB C 63 72.000 70.868 1.132 1
1 628 . 2 1 1 A 63 63 THR N N 63 109.100 114.400 -5.300 1
1 629 . 2 1 1 A 64 64 LEU H H 64 8.190 8.684 -0.494 1
1 630 . 2 1 1 A 64 64 LEU HA H 64 3.920 3.946 -0.026 1
1 640 . 2 1 1 A 64 64 LEU CA C 64 58.400 58.075 0.325 1
1 641 . 2 1 1 A 64 64 LEU CB C 64 40.200 41.266 -1.066 1
1 645 . 2 1 1 A 64 64 LEU N N 64 118.100 122.964 -4.864 1
1 646 . 2 1 1 A 65 65 SER H H 65 8.370 7.863 0.507 1
1 647 . 2 1 1 A 65 65 SER HA H 65 4.150 4.195 -0.045 1
1 650 . 2 1 1 A 65 65 SER CA C 65 60.900 60.573 0.327 1
1 651 . 2 1 1 A 65 65 SER CB C 65 62.500 63.201 -0.701 1
1 652 . 2 1 1 A 65 65 SER N N 65 112.200 114.533 -2.333 1
1 653 . 2 1 1 A 66 66 GLU H H 66 7.780 7.897 -0.117 1
1 654 . 2 1 1 A 66 66 GLU HA H 66 3.890 4.188 -0.298 1
1 659 . 2 1 1 A 66 66 GLU CA C 66 59.200 58.959 0.241 1
1 660 . 2 1 1 A 66 66 GLU CB C 66 29.400 29.613 -0.213 1
1 662 . 2 1 1 A 66 66 GLU N N 66 123.600 121.921 1.679 1
1 663 . 2 1 1 A 67 67 TYR H H 67 7.290 7.840 -0.550 1
1 664 . 2 1 1 A 67 67 TYR HA H 67 4.590 4.633 -0.043 1
1 669 . 2 1 1 A 67 67 TYR CA C 67 58.400 57.389 1.011 1
1 670 . 2 1 1 A 67 67 TYR CB C 67 39.800 38.527 1.273 1
1 671 . 2 1 1 A 67 67 TYR N N 67 116.400 117.432 -1.032 1
1 672 . 2 1 1 A 68 68 ASN H H 68 8.040 7.897 0.143 1
1 673 . 2 1 1 A 68 68 ASN HA H 68 4.240 4.386 -0.146 1
1 676 . 2 1 1 A 68 68 ASN CA C 68 54.100 54.456 -0.356 1
1 677 . 2 1 1 A 68 68 ASN CB C 68 37.200 37.848 -0.648 1
1 678 . 2 1 1 A 68 68 ASN N N 68 115.600 115.067 0.533 1
1 679 . 2 1 1 A 69 69 ILE H H 69 7.200 7.604 -0.404 1
1 680 . 2 1 1 A 69 69 ILE HA H 69 3.280 4.440 -1.160 1
1 690 . 2 1 1 A 69 69 ILE CA C 69 59.800 59.839 -0.039 1
1 691 . 2 1 1 A 69 69 ILE CB C 69 36.600 39.242 -2.642 1
1 695 . 2 1 1 A 69 69 ILE N N 69 119.100 116.344 2.756 1
1 696 . 2 1 1 A 70 70 GLN H H 70 7.570 8.585 -1.015 1
1 697 . 2 1 1 A 70 70 GLN HA H 70 4.410 4.923 -0.513 1
1 702 . 2 1 1 A 70 70 GLN CA C 70 53.500 53.972 -0.472 1
1 703 . 2 1 1 A 70 70 GLN CB C 70 31.500 30.836 0.664 1
1 705 . 2 1 1 A 70 70 GLN N N 70 124.800 120.818 3.982 1
1 706 . 2 1 1 A 71 71 LYS H H 71 8.370 8.304 0.066 1
1 707 . 2 1 1 A 71 71 LYS HA H 71 3.870 4.342 -0.472 1
1 716 . 2 1 1 A 71 71 LYS CA C 71 58.000 55.293 2.707 1
1 717 . 2 1 1 A 71 71 LYS CB C 71 32.500 32.518 -0.018 1
1 720 . 2 1 1 A 71 71 LYS N N 71 120.200 119.550 0.650 1
1 721 . 2 1 1 A 72 72 GLU H H 72 9.230 8.060 1.170 1
1 722 . 2 1 1 A 72 72 GLU HA H 72 3.240 4.182 -0.942 1
1 727 . 2 1 1 A 72 72 GLU CA C 72 58.300 56.705 1.595 1
1 728 . 2 1 1 A 72 72 GLU CB C 72 26.000 28.869 -2.869 1
1 730 . 2 1 1 A 72 72 GLU N N 72 115.100 119.675 -4.575 1
1 731 . 2 1 1 A 73 73 SER H H 73 7.690 8.452 -0.762 1
1 732 . 2 1 1 A 73 73 SER HA H 73 4.520 4.803 -0.283 1
1 735 . 2 1 1 A 73 73 SER CA C 73 61.100 58.878 2.222 1
1 736 . 2 1 1 A 73 73 SER CB C 73 64.800 65.265 -0.465 1
1 737 . 2 1 1 A 73 73 SER N N 73 115.300 114.370 0.930 1
1 738 . 2 1 1 A 74 74 THR H H 74 8.620 7.871 0.749 1
1 739 . 2 1 1 A 74 74 THR HA H 74 5.200 5.174 0.026 1
1 744 . 2 1 1 A 74 74 THR CA C 74 62.400 61.796 0.604 1
1 745 . 2 1 1 A 74 74 THR CB C 74 70.200 70.889 -0.689 1
1 747 . 2 1 1 A 74 74 THR N N 74 117.500 111.026 6.474 1
1 748 . 2 1 1 A 75 75 LEU H H 75 9.350 9.178 0.172 1
1 749 . 2 1 1 A 75 75 LEU HA H 75 4.990 5.047 -0.057 1
1 759 . 2 1 1 A 75 75 LEU CA C 75 53.800 53.626 0.174 1
1 760 . 2 1 1 A 75 75 LEU CB C 75 44.400 46.209 -1.809 1
1 764 . 2 1 1 A 75 75 LEU N N 75 128.000 127.915 0.085 1
1 765 . 2 1 1 A 76 76 HIS H H 76 9.140 8.297 0.843 1
1 766 . 2 1 1 A 76 76 HIS HA H 76 5.040 5.164 -0.124 1
1 769 . 2 1 1 A 76 76 HIS CA C 76 56.200 54.146 2.054 1
1 770 . 2 1 1 A 76 76 HIS CB C 76 32.500 31.490 1.010 1
1 771 . 2 1 1 A 76 76 HIS N N 76 119.600 123.064 -3.464 1
1 772 . 2 1 1 A 77 77 LEU H H 77 8.240 8.959 -0.719 1
1 773 . 2 1 1 A 77 77 LEU HA H 77 5.080 5.451 -0.371 1
1 783 . 2 1 1 A 77 77 LEU CA C 77 53.600 53.803 -0.203 1
1 784 . 2 1 1 A 77 77 LEU CB C 77 44.100 43.444 0.656 1
1 788 . 2 1 1 A 77 77 LEU N N 77 123.800 121.518 2.282 1
1 789 . 2 1 1 A 78 78 VAL H H 78 9.110 8.845 0.265 1
1 790 . 2 1 1 A 78 78 VAL HA H 78 4.260 4.688 -0.428 1
1 798 . 2 1 1 A 78 78 VAL CA C 78 60.400 60.759 -0.359 1
1 799 . 2 1 1 A 78 78 VAL CB C 78 34.700 36.038 -1.338 1
1 802 . 2 1 1 A 78 78 VAL N N 78 127.100 124.209 2.891 1
1 803 . 2 1 1 A 79 79 LEU H H 79 8.050 8.893 -0.843 1
1 804 . 2 1 1 A 79 79 LEU HA H 79 4.950 4.933 0.017 1
1 813 . 2 1 1 A 79 79 LEU CA C 79 53.800 53.141 0.659 1
1 814 . 2 1 1 A 79 79 LEU CB C 79 42.700 44.387 -1.687 1
1 818 . 2 1 1 A 79 79 LEU N N 79 123.400 128.604 -5.204 1
1 819 . 2 1 1 A 80 80 ARG H H 80 8.540 9.084 -0.544 1
1 820 . 2 1 1 A 80 80 ARG HA H 80 4.170 3.948 0.222 1
1 827 . 2 1 1 A 80 80 ARG CA C 80 55.800 56.959 -1.159 1
1 828 . 2 1 1 A 80 80 ARG CB C 80 31.100 28.798 2.302 1
1 830 . 2 1 1 A 80 80 ARG N N 80 123.500 126.410 -2.910 1
1 831 . 2 1 1 A 81 81 LEU H H 81 8.250 7.757 0.493 1
1 832 . 2 1 1 A 81 81 LEU HA H 81 4.270 4.317 -0.047 1
1 842 . 2 1 1 A 81 81 LEU CA C 81 55.000 54.788 0.212 1
1 843 . 2 1 1 A 81 81 LEU CB C 81 42.200 43.128 -0.928 1
1 847 . 2 1 1 A 81 81 LEU N N 81 124.100 118.118 5.982 1
1 848 . 2 1 1 A 82 82 ARG H H 82 8.310 8.952 -0.642 1
1 849 . 2 1 1 A 82 82 ARG HA H 82 4.200 5.005 -0.805 1
1 852 . 2 1 1 A 82 82 ARG CA C 82 56.300 54.397 1.903 1
1 853 . 2 1 1 A 82 82 ARG CB C 82 30.700 34.111 -3.411 1
1 855 . 2 1 1 A 82 82 ARG N N 82 121.500 116.599 4.901 1
1 856 . 2 1 1 A 83 83 GLY H H 83 8.410 8.742 -0.332 1
1 857 . 2 1 1 A 83 83 GLY HA2 H 83 3.750 3.889 -0.139 1
1 858 . 2 1 1 A 83 83 GLY HA3 H 83 3.754 3.937 -0.183 1
1 859 . 2 1 1 A 83 83 GLY CA C 83 45.100 45.791 -0.691 1
1 860 . 2 1 1 A 83 83 GLY N N 83 110.200 107.487 2.713 1
1 861 . 2 1 1 A 84 84 TYR H H 84 7.950 8.560 -0.610 1
1 862 . 2 1 1 A 84 84 TYR HA H 84 4.400 5.324 -0.924 1
1 865 . 2 1 1 A 84 84 TYR CA C 84 58.100 56.977 1.123 1
1 866 . 2 1 1 A 84 84 TYR CB C 84 38.800 40.980 -2.180 1
1 867 . 2 1 1 A 84 84 TYR N N 84 119.900 123.194 -3.294 1
1 868 . 2 1 1 A 85 85 ALA H H 85 8.150 8.889 -0.739 1
1 869 . 2 1 1 A 85 85 ALA HA H 85 4.150 4.835 -0.685 1
1 873 . 2 1 1 A 85 85 ALA CA C 85 52.600 51.855 0.745 1
1 874 . 2 1 1 A 85 85 ALA CB C 85 19.200 18.963 0.237 1
1 875 . 2 1 1 A 85 85 ALA N N 85 124.800 122.041 2.759 1
1 876 . 2 1 1 A 86 86 ASP H H 86 8.020 8.777 -0.757 1
1 877 . 2 1 1 A 86 86 ASP HA H 86 4.450 5.196 -0.746 1
1 880 . 2 1 1 A 86 86 ASP CA C 86 54.100 53.352 0.748 1
1 881 . 2 1 1 A 86 86 ASP CB C 86 41.100 44.693 -3.593 1
1 882 . 2 1 1 A 86 86 ASP N N 86 118.900 119.817 -0.917 1
1 883 . 2 1 1 A 87 87 LEU H H 87 8.010 8.646 -0.636 1
1 884 . 2 1 1 A 87 87 LEU HA H 87 4.210 4.423 -0.213 1
1 893 . 2 1 1 A 87 87 LEU CA C 87 55.300 54.966 0.334 1
1 894 . 2 1 1 A 87 87 LEU CB C 87 42.000 42.735 -0.735 1
1 898 . 2 1 1 A 87 87 LEU N N 87 122.400 124.880 -2.480 1
1 899 . 2 1 1 A 88 88 ARG H H 88 8.170 8.026 0.144 1
1 900 . 2 1 1 A 88 88 ARG HA H 88 4.210 4.486 -0.276 1
1 903 . 2 1 1 A 88 88 ARG CA C 88 56.300 57.045 -0.745 1
1 904 . 2 1 1 A 88 88 ARG CB C 88 30.600 31.512 -0.912 1
1 905 . 2 1 1 A 88 88 ARG N N 88 121.200 113.956 7.244 1
1 906 . 2 1 1 A 91 91 PRO HA H 91 4.290 4.747 -0.457 1
1 911 . 2 1 1 A 91 91 PRO CA C 91 63.800 62.774 1.026 1
1 912 . 2 1 1 A 91 91 PRO CB C 91 32.100 32.393 -0.293 1
1 915 . 2 1 1 A 92 92 ASP H H 92 8.280 8.905 -0.625 1
1 916 . 2 1 1 A 92 92 ASP HA H 92 4.540 5.025 -0.485 1
1 919 . 2 1 1 A 92 92 ASP CA C 92 54.600 54.074 0.526 1
1 920 . 2 1 1 A 92 92 ASP CB C 92 41.000 43.595 -2.595 1
1 921 . 2 1 1 A 92 92 ASP N N 92 118.700 122.499 -3.799 1
1 922 . 2 1 1 A 93 93 ARG H H 93 7.780 8.875 -1.095 1
1 923 . 2 1 1 A 93 93 ARG HA H 93 4.190 4.559 -0.369 1
1 930 . 2 1 1 A 93 93 ARG CA C 93 56.300 57.072 -0.772 1
1 931 . 2 1 1 A 93 93 ARG CB C 93 30.700 31.918 -1.218 1
1 934 . 2 1 1 A 93 93 ARG N N 93 120.700 122.558 -1.858 1
1 935 . 2 1 1 A 94 94 GLN H H 94 8.280 7.784 0.496 1
1 936 . 2 1 1 A 94 94 GLN HA H 94 4.210 4.727 -0.517 1
1 941 . 2 1 1 A 94 94 GLN CA C 94 55.800 54.735 1.065 1
1 942 . 2 1 1 A 94 94 GLN CB C 94 29.300 30.662 -1.362 1
1 944 . 2 1 1 A 94 94 GLN N N 94 121.000 112.967 8.033 1
1 945 . 2 1 1 A 95 95 ASP H H 95 8.270 8.826 -0.556 1
1 946 . 2 1 1 A 95 95 ASP HA H 95 4.450 5.291 -0.841 1
1 949 . 2 1 1 A 95 95 ASP CA C 95 54.300 53.081 1.219 1
1 950 . 2 1 1 A 95 95 ASP CB C 95 41.000 43.940 -2.940 1
1 951 . 2 1 1 A 95 95 ASP N N 95 121.000 118.332 2.668 1
1 952 . 2 1 1 A 96 96 HIS H H 96 8.090 8.864 -0.774 1
1 953 . 2 1 1 A 96 96 HIS HA H 96 4.470 5.379 -0.909 1
1 956 . 2 1 1 A 96 96 HIS CA C 96 55.900 54.427 1.473 1
1 957 . 2 1 1 A 96 96 HIS CB C 96 30.500 32.971 -2.471 1
1 958 . 2 1 1 A 96 96 HIS N N 96 119.300 120.475 -1.175 1
1 959 . 2 1 1 A 97 97 HIS H H 97 8.240 8.664 -0.424 1
1 960 . 2 1 1 A 97 97 HIS HA H 97 4.470 4.939 -0.469 1
1 963 . 2 1 1 A 97 97 HIS CA C 97 56.200 53.923 2.277 1
1 964 . 2 1 1 A 97 97 HIS CB C 97 30.400 32.026 -1.626 1
1 965 . 2 1 1 A 97 97 HIS N N 97 121.300 124.334 -3.034 1
1 966 . 2 1 1 A 98 98 PRO HA H 98 4.340 4.557 -0.217 1
1 973 . 2 1 1 A 98 98 PRO CA C 98 63.700 62.382 1.318 1
1 974 . 2 1 1 A 98 98 PRO CB C 98 31.900 32.844 -0.944 1
1 977 . 2 1 1 A 99 99 GLY H H 99 8.660 8.282 0.378 1
1 978 . 2 1 1 A 99 99 GLY HA2 H 99 3.920 4.283 -0.363 1
1 979 . 2 1 1 A 99 99 GLY HA3 H 99 3.920 4.288 -0.368 1
1 980 . 2 1 1 A 99 99 GLY CA C 99 45.200 44.662 0.538 1
1 981 . 2 1 1 A 99 99 GLY N N 99 110.000 107.237 2.763 1
1 982 . 2 1 1 A 100 100 SER H H 100 8.170 8.568 -0.398 1
1 983 . 2 1 1 A 100 100 SER HA H 100 4.360 5.492 -1.132 1
1 986 . 2 1 1 A 100 100 SER CA C 100 58.500 56.547 1.953 1
1 987 . 2 1 1 A 100 100 SER CB C 100 64.000 66.652 -2.652 1
1 988 . 2 1 1 A 100 100 SER N N 100 115.600 114.904 0.696 1
1 989 . 2 1 1 A 101 101 GLY H H 101 8.420 8.511 -0.091 1
1 990 . 2 1 1 A 101 101 GLY HA2 H 101 3.890 4.126 -0.236 1
1 991 . 2 1 1 A 101 101 GLY HA3 H 101 3.920 4.127 -0.207 1
1 992 . 2 1 1 A 101 101 GLY CA C 101 45.200 43.941 1.259 1
1 993 . 2 1 1 A 101 101 GLY N N 101 111.000 107.463 3.537 1
1 994 . 2 1 1 A 102 102 ALA H H 102 8.030 8.670 -0.640 1
1 995 . 2 1 1 A 102 102 ALA HA H 102 4.250 4.992 -0.742 1
1 999 . 2 1 1 A 102 102 ALA CA C 102 52.500 51.624 0.876 1
1 1000 . 2 1 1 A 102 102 ALA CB C 102 19.200 22.617 -3.417 1
1 4 . 3 1 1 A 2 2 SER H H 2 8.160 8.853 -0.693 1
1 5 . 3 1 1 A 2 2 SER HA H 2 4.370 4.645 -0.275 1
1 9 . 3 1 1 A 2 2 SER CA C 2 58.300 57.011 1.289 1
1 10 . 3 1 1 A 2 2 SER CB C 2 63.900 62.326 1.574 1
1 11 . 3 1 1 A 2 2 SER N N 2 115.600 120.803 -5.203 1
1 12 . 3 1 1 A 3 3 LEU H H 3 8.250 7.996 0.254 1
1 13 . 3 1 1 A 3 3 LEU HA H 3 4.280 4.582 -0.302 1
1 17 . 3 1 1 A 3 3 LEU CA C 3 55.200 53.464 1.736 1
1 18 . 3 1 1 A 3 3 LEU CB C 3 42.100 43.493 -1.393 1
1 19 . 3 1 1 A 3 3 LEU N N 3 124.100 121.210 2.890 1
1 20 . 3 1 1 A 4 4 VAL H H 4 7.950 8.277 -0.327 1
1 21 . 3 1 1 A 4 4 VAL HA H 4 4.680 4.217 0.463 1
1 26 . 3 1 1 A 4 4 VAL CA C 4 59.800 60.297 -0.497 1
1 27 . 3 1 1 A 4 4 VAL CB C 4 32.500 32.768 -0.268 1
1 28 . 3 1 1 A 4 4 VAL N N 4 122.600 121.364 1.236 1
1 29 . 3 1 1 A 5 5 PRO CA C 5 63.100 62.129 0.971 1
1 30 . 3 1 1 A 5 5 PRO CB C 5 32.000 32.911 -0.911 1
1 32 . 3 1 1 A 6 6 ARG H H 6 8.360 8.402 -0.042 1
1 33 . 3 1 1 A 6 6 ARG HA H 6 4.250 4.308 -0.058 1
1 36 . 3 1 1 A 6 6 ARG CA C 6 56.000 55.713 0.287 1
1 37 . 3 1 1 A 6 6 ARG CB C 6 30.900 30.516 0.384 1
1 38 . 3 1 1 A 6 6 ARG N N 6 121.800 119.880 1.920 1
1 39 . 3 1 1 A 7 7 GLY H H 7 8.460 8.353 0.107 1
1 40 . 3 1 1 A 7 7 GLY HA2 H 7 3.940 4.135 -0.195 1
1 41 . 3 1 1 A 7 7 GLY HA3 H 7 3.760 4.135 -0.375 1
1 42 . 3 1 1 A 7 7 GLY CA C 7 45.000 44.736 0.264 1
1 43 . 3 1 1 A 7 7 GLY N N 7 110.700 108.004 2.696 1
1 44 . 3 1 1 A 8 8 SER H H 8 7.990 8.176 -0.186 1
1 45 . 3 1 1 A 8 8 SER HA H 8 4.450 4.552 -0.102 1
1 48 . 3 1 1 A 8 8 SER CA C 8 58.900 59.879 -0.979 1
1 49 . 3 1 1 A 8 8 SER CB C 8 64.200 64.385 -0.185 1
1 50 . 3 1 1 A 8 8 SER N N 8 115.500 119.254 -3.754 1
1 51 . 3 1 1 A 9 9 MET H H 9 9.040 7.570 1.470 1
1 52 . 3 1 1 A 9 9 MET HA H 9 4.610 5.115 -0.505 1
1 60 . 3 1 1 A 9 9 MET CA C 9 54.400 53.487 0.913 1
1 61 . 3 1 1 A 9 9 MET CB C 9 35.400 33.908 1.492 1
1 64 . 3 1 1 A 9 9 MET N N 9 120.500 119.549 0.951 1
1 65 . 3 1 1 A 10 10 GLN H H 10 8.270 8.939 -0.669 1
1 66 . 3 1 1 A 10 10 GLN HA H 10 5.270 5.337 -0.067 1
1 71 . 3 1 1 A 10 10 GLN CA C 10 54.200 54.371 -0.171 1
1 72 . 3 1 1 A 10 10 GLN CB C 10 30.500 32.281 -1.781 1
1 74 . 3 1 1 A 10 10 GLN N N 10 121.000 122.413 -1.413 1
1 75 . 3 1 1 A 11 11 ILE H H 11 8.270 8.820 -0.550 1
1 76 . 3 1 1 A 11 11 ILE HA H 11 4.100 4.844 -0.744 1
1 86 . 3 1 1 A 11 11 ILE CA C 11 59.400 59.245 0.155 1
1 87 . 3 1 1 A 11 11 ILE CB C 11 41.800 40.828 0.972 1
1 91 . 3 1 1 A 11 11 ILE N N 11 114.600 121.467 -6.867 1
1 92 . 3 1 1 A 12 12 PHE H H 12 8.520 8.816 -0.296 1
1 93 . 3 1 1 A 12 12 PHE HA H 12 5.540 5.334 0.206 1
1 96 . 3 1 1 A 12 12 PHE CA C 12 55.000 56.970 -1.970 1
1 97 . 3 1 1 A 12 12 PHE CB C 12 41.200 40.761 0.439 1
1 98 . 3 1 1 A 12 12 PHE N N 12 118.600 123.246 -4.646 1
1 99 . 3 1 1 A 13 13 VAL H H 13 9.230 8.918 0.312 1
1 100 . 3 1 1 A 13 13 VAL HA H 13 4.740 5.083 -0.343 1
1 108 . 3 1 1 A 13 13 VAL CA C 13 60.300 60.552 -0.252 1
1 109 . 3 1 1 A 13 13 VAL CB C 13 34.100 35.100 -1.000 1
1 112 . 3 1 1 A 13 13 VAL N N 13 121.400 122.142 -0.742 1
1 113 . 3 1 1 A 14 14 LYS H H 14 8.910 8.285 0.625 1
1 114 . 3 1 1 A 14 14 LYS HA H 14 5.190 4.748 0.442 1
1 122 . 3 1 1 A 14 14 LYS CA C 14 54.600 54.783 -0.183 1
1 123 . 3 1 1 A 14 14 LYS CB C 14 34.300 34.354 -0.054 1
1 126 . 3 1 1 A 14 14 LYS N N 14 128.000 126.563 1.437 1
1 127 . 3 1 1 A 15 15 THR H H 15 8.650 8.812 -0.162 1
1 128 . 3 1 1 A 15 15 THR HA H 15 4.870 4.661 0.209 1
1 133 . 3 1 1 A 15 15 THR CA C 15 60.300 60.833 -0.533 1
1 134 . 3 1 1 A 15 15 THR CB C 15 70.600 71.295 -0.695 1
1 136 . 3 1 1 A 15 15 THR N N 15 115.300 117.859 -2.559 1
1 137 . 3 1 1 A 16 16 LEU H H 16 9.070 8.750 0.320 1
1 138 . 3 1 1 A 16 16 LEU HA H 16 4.210 4.083 0.127 1
1 148 . 3 1 1 A 16 16 LEU CA C 16 57.400 57.347 0.053 1
1 149 . 3 1 1 A 16 16 LEU CB C 16 41.800 41.584 0.216 1
1 153 . 3 1 1 A 16 16 LEU N N 16 121.400 119.251 2.149 1
1 154 . 3 1 1 A 17 17 THR H H 17 7.560 7.828 -0.268 1
1 155 . 3 1 1 A 17 17 THR HA H 17 4.330 4.322 0.008 1
1 160 . 3 1 1 A 17 17 THR CA C 17 61.400 63.402 -2.002 1
1 161 . 3 1 1 A 17 17 THR CB C 17 68.900 69.658 -0.758 1
1 163 . 3 1 1 A 17 17 THR N N 17 105.900 113.806 -7.906 1
1 164 . 3 1 1 A 18 18 GLY H H 18 7.750 7.809 -0.059 1
1 165 . 3 1 1 A 18 18 GLY HA2 H 18 4.250 4.016 0.234 1
1 166 . 3 1 1 A 18 18 GLY HA3 H 18 3.520 4.028 -0.508 1
1 167 . 3 1 1 A 18 18 GLY CA C 18 45.300 45.081 0.219 1
1 168 . 3 1 1 A 18 18 GLY N N 18 109.300 109.313 -0.013 1
1 169 . 3 1 1 A 19 19 LYS H H 19 7.210 7.755 -0.545 1
1 170 . 3 1 1 A 19 19 LYS HA H 19 4.260 4.241 0.019 1
1 175 . 3 1 1 A 19 19 LYS CA C 19 56.300 56.721 -0.421 1
1 176 . 3 1 1 A 19 19 LYS CB C 19 33.200 34.123 -0.923 1
1 179 . 3 1 1 A 19 19 LYS N N 19 122.000 121.733 0.267 1
1 180 . 3 1 1 A 20 20 THR H H 20 8.570 8.663 -0.093 1
1 181 . 3 1 1 A 20 20 THR HA H 20 4.950 5.522 -0.572 1
1 186 . 3 1 1 A 20 20 THR CA C 20 62.200 60.256 1.944 1
1 187 . 3 1 1 A 20 20 THR CB C 20 69.700 70.794 -1.094 1
1 189 . 3 1 1 A 20 20 THR N N 20 120.700 113.323 7.377 1
1 190 . 3 1 1 A 21 21 ILE H H 21 9.510 8.831 0.679 1
1 191 . 3 1 1 A 21 21 ILE HA H 21 4.390 4.846 -0.456 1
1 201 . 3 1 1 A 21 21 ILE CA C 21 60.000 58.969 1.031 1
1 202 . 3 1 1 A 21 21 ILE CB C 21 40.700 41.499 -0.799 1
1 206 . 3 1 1 A 21 21 ILE N N 21 128.200 122.916 5.284 1
1 207 . 3 1 1 A 22 22 THR H H 22 8.700 8.714 -0.014 1
1 208 . 3 1 1 A 22 22 THR HA H 22 4.860 4.579 0.281 1
1 213 . 3 1 1 A 22 22 THR CA C 22 62.100 62.686 -0.586 1
1 214 . 3 1 1 A 22 22 THR CB C 22 69.500 69.527 -0.027 1
1 216 . 3 1 1 A 22 22 THR N N 22 122.300 121.223 1.077 1
1 217 . 3 1 1 A 23 23 LEU H H 23 8.720 8.768 -0.048 1
1 218 . 3 1 1 A 23 23 LEU HA H 23 4.690 5.002 -0.312 1
1 228 . 3 1 1 A 23 23 LEU CA C 23 52.700 53.745 -1.045 1
1 229 . 3 1 1 A 23 23 LEU CB C 23 46.600 45.736 0.864 1
1 233 . 3 1 1 A 23 23 LEU N N 23 125.400 126.416 -1.016 1
1 234 . 3 1 1 A 24 24 GLU H H 24 8.080 8.633 -0.553 1
1 235 . 3 1 1 A 24 24 GLU HA H 24 4.800 4.665 0.135 1
1 238 . 3 1 1 A 24 24 GLU CA C 24 55.400 56.006 -0.606 1
1 239 . 3 1 1 A 24 24 GLU CB C 24 30.100 30.968 -0.868 1
1 241 . 3 1 1 A 24 24 GLU N N 24 121.800 121.388 0.412 1
1 242 . 3 1 1 A 25 25 VAL H H 25 8.800 8.619 0.181 1
1 243 . 3 1 1 A 25 25 VAL HA H 25 4.640 4.941 -0.301 1
1 251 . 3 1 1 A 25 25 VAL CA C 25 58.600 60.463 -1.863 1
1 252 . 3 1 1 A 25 25 VAL CB C 25 36.300 35.036 1.264 1
1 255 . 3 1 1 A 25 25 VAL N N 25 116.700 125.752 -9.052 1
1 256 . 3 1 1 A 26 26 GLU H H 26 8.500 8.428 0.072 1
1 257 . 3 1 1 A 26 26 GLU HA H 26 4.900 4.601 0.299 1
1 260 . 3 1 1 A 26 26 GLU CA C 26 53.000 54.470 -1.470 1
1 261 . 3 1 1 A 26 26 GLU CB C 26 31.200 33.990 -2.790 1
1 262 . 3 1 1 A 26 26 GLU N N 26 117.900 124.849 -6.949 1
1 263 . 3 1 1 A 27 27 PRO HA H 27 4.040 4.379 -0.339 1
1 270 . 3 1 1 A 27 27 PRO CA C 27 65.400 64.846 0.554 1
1 271 . 3 1 1 A 27 27 PRO CB C 27 31.700 32.078 -0.378 1
1 274 . 3 1 1 A 28 28 SER H H 28 7.010 7.653 -0.643 1
1 275 . 3 1 1 A 28 28 SER HA H 28 4.280 4.435 -0.155 1
1 278 . 3 1 1 A 28 28 SER CA C 28 57.400 58.421 -1.021 1
1 279 . 3 1 1 A 28 28 SER CB C 28 63.400 63.889 -0.489 1
1 280 . 3 1 1 A 28 28 SER N N 28 103.800 110.166 -6.366 1
1 281 . 3 1 1 A 29 29 ASP H H 29 7.960 7.723 0.237 1
1 282 . 3 1 1 A 29 29 ASP HA H 29 4.600 4.870 -0.270 1
1 285 . 3 1 1 A 29 29 ASP CA C 29 55.900 53.532 2.368 1
1 286 . 3 1 1 A 29 29 ASP CB C 29 41.000 41.002 -0.002 1
1 287 . 3 1 1 A 29 29 ASP N N 29 123.700 122.573 1.127 1
1 288 . 3 1 1 A 30 30 THR H H 30 7.780 8.828 -1.048 1
1 289 . 3 1 1 A 30 30 THR HA H 30 4.850 4.595 0.255 1
1 294 . 3 1 1 A 30 30 THR CA C 30 59.400 61.036 -1.636 1
1 295 . 3 1 1 A 30 30 THR CB C 30 71.100 70.319 0.781 1
1 297 . 3 1 1 A 30 30 THR N N 30 108.800 118.559 -9.759 1
1 298 . 3 1 1 A 31 31 ILE H H 31 8.320 8.910 -0.590 1
1 299 . 3 1 1 A 31 31 ILE HA H 31 3.580 3.734 -0.154 1
1 309 . 3 1 1 A 31 31 ILE CA C 31 62.200 64.691 -2.491 1
1 310 . 3 1 1 A 31 31 ILE CB C 31 34.300 37.908 -3.608 1
1 314 . 3 1 1 A 31 31 ILE N N 31 121.300 126.921 -5.621 1
1 315 . 3 1 1 A 32 32 GLU H H 32 9.850 8.353 1.497 1
1 316 . 3 1 1 A 32 32 GLU HA H 32 3.780 4.003 -0.223 1
1 321 . 3 1 1 A 32 32 GLU CA C 32 60.500 59.671 0.829 1
1 322 . 3 1 1 A 32 32 GLU CB C 32 28.800 29.340 -0.540 1
1 324 . 3 1 1 A 32 32 GLU N N 32 121.600 121.698 -0.098 1
1 325 . 3 1 1 A 33 33 ASN H H 33 7.810 7.792 0.018 1
1 326 . 3 1 1 A 33 33 ASN HA H 33 4.440 4.704 -0.264 1
1 329 . 3 1 1 A 33 33 ASN CA C 33 55.800 55.540 0.260 1
1 330 . 3 1 1 A 33 33 ASN CB C 33 38.100 38.765 -0.665 1
1 331 . 3 1 1 A 33 33 ASN N N 33 121.000 118.775 2.225 1
1 332 . 3 1 1 A 34 34 VAL H H 34 8.000 7.770 0.230 1
1 333 . 3 1 1 A 34 34 VAL HA H 34 3.300 3.787 -0.487 1
1 341 . 3 1 1 A 34 34 VAL CA C 34 67.600 65.476 2.124 1
1 342 . 3 1 1 A 34 34 VAL CB C 34 30.700 31.373 -0.673 1
1 345 . 3 1 1 A 34 34 VAL N N 34 122.200 116.455 5.745 1
1 346 . 3 1 1 A 35 35 LYS H H 35 8.490 8.236 0.254 1
1 347 . 3 1 1 A 35 35 LYS HA H 35 4.500 4.086 0.414 1
1 352 . 3 1 1 A 35 35 LYS CA C 35 59.300 58.620 0.680 1
1 353 . 3 1 1 A 35 35 LYS CB C 35 33.500 31.820 1.680 1
1 354 . 3 1 1 A 35 35 LYS N N 35 119.200 121.006 -1.806 1
1 355 . 3 1 1 A 36 36 ALA H H 36 7.880 8.230 -0.350 1
1 356 . 3 1 1 A 36 36 ALA HA H 36 4.060 4.123 -0.063 1
1 360 . 3 1 1 A 36 36 ALA CA C 36 55.300 55.000 0.300 1
1 361 . 3 1 1 A 36 36 ALA CB C 36 17.600 18.236 -0.636 1
1 362 . 3 1 1 A 36 36 ALA N N 36 123.300 122.089 1.211 1
1 363 . 3 1 1 A 37 37 LYS H H 37 7.790 7.758 0.032 1
1 364 . 3 1 1 A 37 37 LYS HA H 37 4.110 4.115 -0.005 1
1 373 . 3 1 1 A 37 37 LYS CA C 37 59.700 59.471 0.229 1
1 374 . 3 1 1 A 37 37 LYS CB C 37 33.100 32.661 0.439 1
1 378 . 3 1 1 A 37 37 LYS N N 37 120.400 117.747 2.653 1
1 379 . 3 1 1 A 38 38 ILE H H 38 8.240 7.968 0.272 1
1 380 . 3 1 1 A 38 38 ILE HA H 38 3.410 4.041 -0.631 1
1 390 . 3 1 1 A 38 38 ILE CA C 38 66.200 62.093 4.107 1
1 391 . 3 1 1 A 38 38 ILE CB C 38 36.800 37.751 -0.951 1
1 395 . 3 1 1 A 38 38 ILE N N 38 121.400 119.640 1.760 1
1 396 . 3 1 1 A 39 39 GLN H H 39 8.460 7.935 0.525 1
1 397 . 3 1 1 A 39 39 GLN HA H 39 3.730 3.976 -0.246 1
1 402 . 3 1 1 A 39 39 GLN CA C 39 60.000 58.700 1.300 1
1 403 . 3 1 1 A 39 39 GLN CB C 39 27.600 28.599 -0.999 1
1 405 . 3 1 1 A 39 39 GLN N N 39 123.500 121.354 2.146 1
1 406 . 3 1 1 A 40 40 ASP H H 40 7.970 8.190 -0.220 1
1 407 . 3 1 1 A 40 40 ASP HA H 40 4.240 4.356 -0.116 1
1 410 . 3 1 1 A 40 40 ASP CA C 40 57.400 56.604 0.796 1
1 411 . 3 1 1 A 40 40 ASP CB C 40 41.000 40.805 0.195 1
1 412 . 3 1 1 A 40 40 ASP N N 40 119.900 119.317 0.583 1
1 413 . 3 1 1 A 41 41 LYS H H 41 7.420 7.495 -0.075 1
1 414 . 3 1 1 A 41 41 LYS HA H 41 4.200 4.123 0.077 1
1 423 . 3 1 1 A 41 41 LYS CA C 41 58.200 59.022 -0.822 1
1 424 . 3 1 1 A 41 41 LYS CB C 41 33.900 32.938 0.962 1
1 427 . 3 1 1 A 41 41 LYS N N 41 115.700 118.803 -3.103 1
1 428 . 3 1 1 A 42 42 GLU H H 42 8.650 7.729 0.921 1
1 429 . 3 1 1 A 42 42 GLU HA H 42 4.470 4.504 -0.034 1
1 434 . 3 1 1 A 42 42 GLU CA C 42 55.300 55.821 -0.521 1
1 435 . 3 1 1 A 42 42 GLU CB C 42 33.200 32.037 1.163 1
1 437 . 3 1 1 A 42 42 GLU N N 42 114.200 113.757 0.443 1
1 438 . 3 1 1 A 43 43 GLY H H 43 8.400 7.868 0.532 1
1 439 . 3 1 1 A 43 43 GLY HA2 H 43 4.040 3.956 0.084 1
1 440 . 3 1 1 A 43 43 GLY HA3 H 43 3.820 3.963 -0.143 1
1 441 . 3 1 1 A 43 43 GLY CA C 43 45.900 45.361 0.539 1
1 442 . 3 1 1 A 43 43 GLY N N 43 109.000 109.597 -0.597 1
1 443 . 3 1 1 A 44 44 ILE H H 44 6.080 7.828 -1.748 1
1 444 . 3 1 1 A 44 44 ILE HA H 44 4.290 4.240 0.050 1
1 446 . 3 1 1 A 44 44 ILE CA C 44 57.700 58.356 -0.656 1
1 447 . 3 1 1 A 44 44 ILE CB C 44 40.400 38.564 1.836 1
1 448 . 3 1 1 A 44 44 ILE N N 44 120.500 122.015 -1.515 1
1 449 . 3 1 1 A 46 46 PRO HA H 46 4.030 4.212 -0.182 1
1 454 . 3 1 1 A 46 46 PRO CA C 46 66.100 65.272 0.828 1
1 455 . 3 1 1 A 46 46 PRO CB C 46 32.600 32.076 0.524 1
1 458 . 3 1 1 A 47 47 ASP H H 47 8.470 8.679 -0.209 1
1 459 . 3 1 1 A 47 47 ASP HA H 47 4.310 4.401 -0.091 1
1 462 . 3 1 1 A 47 47 ASP CA C 47 55.700 56.545 -0.845 1
1 463 . 3 1 1 A 47 47 ASP CB C 47 39.700 40.010 -0.310 1
1 464 . 3 1 1 A 47 47 ASP N N 47 113.700 117.480 -3.780 1
1 465 . 3 1 1 A 48 48 GLN H H 48 7.720 7.582 0.138 1
1 466 . 3 1 1 A 48 48 GLN HA H 48 4.340 4.453 -0.113 1
1 471 . 3 1 1 A 48 48 GLN CA C 48 55.500 55.199 0.301 1
1 472 . 3 1 1 A 48 48 GLN CB C 48 29.900 29.513 0.387 1
1 474 . 3 1 1 A 48 48 GLN N N 48 116.900 115.661 1.239 1
1 475 . 3 1 1 A 49 49 GLN H H 49 7.410 7.597 -0.187 1
1 476 . 3 1 1 A 49 49 GLN HA H 49 4.110 4.954 -0.844 1
1 481 . 3 1 1 A 49 49 GLN CA C 49 56.600 54.333 2.267 1
1 482 . 3 1 1 A 49 49 GLN CB C 49 31.300 31.829 -0.529 1
1 484 . 3 1 1 A 49 49 GLN N N 49 118.000 121.270 -3.270 1
1 485 . 3 1 1 A 50 50 ARG H H 50 8.400 8.727 -0.327 1
1 486 . 3 1 1 A 50 50 ARG HA H 50 4.380 4.871 -0.491 1
1 491 . 3 1 1 A 50 50 ARG CA C 50 55.100 54.824 0.276 1
1 492 . 3 1 1 A 50 50 ARG CB C 50 31.600 31.761 -0.161 1
1 494 . 3 1 1 A 50 50 ARG N N 50 123.100 123.450 -0.350 1
1 495 . 3 1 1 A 51 51 LEU H H 51 8.710 8.536 0.174 1
1 496 . 3 1 1 A 51 51 LEU HA H 51 5.300 5.150 0.150 1
1 506 . 3 1 1 A 51 51 LEU CA C 51 52.900 53.447 -0.547 1
1 507 . 3 1 1 A 51 51 LEU CB C 51 45.700 45.722 -0.022 1
1 511 . 3 1 1 A 51 51 LEU N N 51 124.400 120.357 4.043 1
1 512 . 3 1 1 A 52 52 ILE H H 52 9.060 8.908 0.152 1
1 513 . 3 1 1 A 52 52 ILE HA H 52 4.840 5.252 -0.412 1
1 523 . 3 1 1 A 52 52 ILE CA C 52 58.900 60.300 -1.400 1
1 524 . 3 1 1 A 52 52 ILE CB C 52 41.200 40.870 0.330 1
1 528 . 3 1 1 A 52 52 ILE N N 52 122.500 123.412 -0.912 1
1 529 . 3 1 1 A 53 53 PHE H H 53 8.730 9.499 -0.769 1
1 530 . 3 1 1 A 53 53 PHE HA H 53 5.100 4.752 0.348 1
1 535 . 3 1 1 A 53 53 PHE CA C 53 56.300 57.328 -1.028 1
1 536 . 3 1 1 A 53 53 PHE CB C 53 43.500 41.661 1.839 1
1 537 . 3 1 1 A 53 53 PHE N N 53 124.800 127.845 -3.045 1
1 538 . 3 1 1 A 54 54 ALA H H 54 8.940 9.051 -0.111 1
1 539 . 3 1 1 A 54 54 ALA HA H 54 3.610 3.852 -0.242 1
1 543 . 3 1 1 A 54 54 ALA CA C 54 52.500 52.976 -0.476 1
1 544 . 3 1 1 A 54 54 ALA CB C 54 16.300 17.384 -1.084 1
1 545 . 3 1 1 A 54 54 ALA N N 54 133.100 130.226 2.874 1
1 546 . 3 1 1 A 55 55 GLY H H 55 8.070 8.500 -0.430 1
1 547 . 3 1 1 A 55 55 GLY HA2 H 55 4.000 3.819 0.181 1
1 548 . 3 1 1 A 55 55 GLY HA3 H 55 3.340 3.850 -0.510 1
1 549 . 3 1 1 A 55 55 GLY CA C 55 45.200 45.706 -0.506 1
1 550 . 3 1 1 A 55 55 GLY N N 55 102.500 102.707 -0.207 1
1 551 . 3 1 1 A 56 56 LYS H H 56 7.860 7.609 0.251 1
1 552 . 3 1 1 A 56 56 LYS HA H 56 4.510 4.708 -0.198 1
1 558 . 3 1 1 A 56 56 LYS CA C 56 54.500 54.739 -0.239 1
1 559 . 3 1 1 A 56 56 LYS CB C 56 34.400 35.354 -0.954 1
1 561 . 3 1 1 A 56 56 LYS N N 56 121.800 120.607 1.193 1
1 562 . 3 1 1 A 57 57 GLN H H 57 8.600 8.706 -0.106 1
1 563 . 3 1 1 A 57 57 GLN HA H 57 4.410 5.149 -0.739 1
1 568 . 3 1 1 A 57 57 GLN CA C 57 55.900 55.335 0.565 1
1 569 . 3 1 1 A 57 57 GLN CB C 57 28.800 30.182 -1.382 1
1 571 . 3 1 1 A 57 57 GLN N N 57 123.200 127.724 -4.524 1
1 572 . 3 1 1 A 58 58 LEU H H 58 8.480 8.757 -0.277 1
1 573 . 3 1 1 A 58 58 LEU HA H 58 4.060 5.003 -0.943 1
1 583 . 3 1 1 A 58 58 LEU CA C 58 54.100 53.205 0.895 1
1 584 . 3 1 1 A 58 58 LEU CB C 58 41.500 45.208 -3.708 1
1 588 . 3 1 1 A 58 58 LEU N N 58 125.900 126.645 -0.745 1
1 589 . 3 1 1 A 59 59 GLU H H 59 8.400 8.777 -0.377 1
1 590 . 3 1 1 A 59 59 GLU HA H 59 4.400 4.514 -0.114 1
1 595 . 3 1 1 A 59 59 GLU CA C 59 55.900 57.864 -1.964 1
1 596 . 3 1 1 A 59 59 GLU CB C 59 31.900 32.572 -0.672 1
1 598 . 3 1 1 A 59 59 GLU N N 59 123.100 120.975 2.125 1
1 599 . 3 1 1 A 60 60 ASP H H 60 8.110 7.830 0.280 1
1 600 . 3 1 1 A 60 60 ASP HA H 60 4.270 4.495 -0.225 1
1 603 . 3 1 1 A 60 60 ASP CA C 60 57.100 54.911 2.189 1
1 604 . 3 1 1 A 60 60 ASP CB C 60 40.800 41.831 -1.031 1
1 605 . 3 1 1 A 60 60 ASP N N 60 120.300 120.304 -0.004 1
1 606 . 3 1 1 A 61 61 GLY HA2 H 61 4.000 4.143 -0.143 1
1 607 . 3 1 1 A 61 61 GLY HA3 H 61 3.830 4.159 -0.329 1
1 608 . 3 1 1 A 61 61 GLY CA C 61 45.000 45.778 -0.778 1
1 609 . 3 1 1 A 62 62 ARG H H 62 7.350 8.677 -1.327 1
1 610 . 3 1 1 A 62 62 ARG HA H 62 4.640 4.974 -0.334 1
1 615 . 3 1 1 A 62 62 ARG CA C 62 54.400 53.877 0.523 1
1 616 . 3 1 1 A 62 62 ARG CB C 62 32.600 34.381 -1.781 1
1 618 . 3 1 1 A 62 62 ARG N N 62 119.300 124.553 -5.253 1
1 619 . 3 1 1 A 63 63 THR H H 63 8.460 8.778 -0.318 1
1 620 . 3 1 1 A 63 63 THR HA H 63 5.060 4.624 0.436 1
1 625 . 3 1 1 A 63 63 THR CA C 63 59.700 60.808 -1.108 1
1 626 . 3 1 1 A 63 63 THR CB C 63 72.000 71.234 0.766 1
1 628 . 3 1 1 A 63 63 THR N N 63 109.100 112.697 -3.597 1
1 629 . 3 1 1 A 64 64 LEU H H 64 8.190 8.722 -0.532 1
1 630 . 3 1 1 A 64 64 LEU HA H 64 3.920 3.930 -0.010 1
1 640 . 3 1 1 A 64 64 LEU CA C 64 58.400 57.944 0.456 1
1 641 . 3 1 1 A 64 64 LEU CB C 64 40.200 41.312 -1.112 1
1 645 . 3 1 1 A 64 64 LEU N N 64 118.100 122.750 -4.650 1
1 646 . 3 1 1 A 65 65 SER H H 65 8.370 7.771 0.599 1
1 647 . 3 1 1 A 65 65 SER HA H 65 4.150 4.186 -0.036 1
1 650 . 3 1 1 A 65 65 SER CA C 65 60.900 60.656 0.244 1
1 651 . 3 1 1 A 65 65 SER CB C 65 62.500 63.131 -0.631 1
1 652 . 3 1 1 A 65 65 SER N N 65 112.200 114.526 -2.326 1
1 653 . 3 1 1 A 66 66 GLU H H 66 7.780 7.733 0.047 1
1 654 . 3 1 1 A 66 66 GLU HA H 66 3.890 4.127 -0.237 1
1 659 . 3 1 1 A 66 66 GLU CA C 66 59.200 58.880 0.320 1
1 660 . 3 1 1 A 66 66 GLU CB C 66 29.400 29.515 -0.115 1
1 662 . 3 1 1 A 66 66 GLU N N 66 123.600 121.884 1.716 1
1 663 . 3 1 1 A 67 67 TYR H H 67 7.290 7.631 -0.341 1
1 664 . 3 1 1 A 67 67 TYR HA H 67 4.590 4.511 0.079 1
1 669 . 3 1 1 A 67 67 TYR CA C 67 58.400 59.112 -0.712 1
1 670 . 3 1 1 A 67 67 TYR CB C 67 39.800 39.150 0.650 1
1 671 . 3 1 1 A 67 67 TYR N N 67 116.400 119.955 -3.555 1
1 672 . 3 1 1 A 68 68 ASN H H 68 8.040 7.960 0.080 1
1 673 . 3 1 1 A 68 68 ASN HA H 68 4.240 4.326 -0.086 1
1 676 . 3 1 1 A 68 68 ASN CA C 68 54.100 54.204 -0.104 1
1 677 . 3 1 1 A 68 68 ASN CB C 68 37.200 37.153 0.047 1
1 678 . 3 1 1 A 68 68 ASN N N 68 115.600 118.261 -2.661 1
1 679 . 3 1 1 A 69 69 ILE H H 69 7.200 7.298 -0.098 1
1 680 . 3 1 1 A 69 69 ILE HA H 69 3.280 4.311 -1.031 1
1 690 . 3 1 1 A 69 69 ILE CA C 69 59.800 59.423 0.377 1
1 691 . 3 1 1 A 69 69 ILE CB C 69 36.600 38.878 -2.278 1
1 695 . 3 1 1 A 69 69 ILE N N 69 119.100 114.914 4.186 1
1 696 . 3 1 1 A 70 70 GLN H H 70 7.570 8.318 -0.748 1
1 697 . 3 1 1 A 70 70 GLN HA H 70 4.410 4.468 -0.058 1
1 702 . 3 1 1 A 70 70 GLN CA C 70 53.500 54.316 -0.816 1
1 703 . 3 1 1 A 70 70 GLN CB C 70 31.500 27.905 3.595 1
1 705 . 3 1 1 A 70 70 GLN N N 70 124.800 121.530 3.270 1
1 706 . 3 1 1 A 71 71 LYS H H 71 8.370 8.763 -0.393 1
1 707 . 3 1 1 A 71 71 LYS HA H 71 3.870 4.428 -0.558 1
1 716 . 3 1 1 A 71 71 LYS CA C 71 58.000 56.606 1.394 1
1 717 . 3 1 1 A 71 71 LYS CB C 71 32.500 33.348 -0.848 1
1 720 . 3 1 1 A 71 71 LYS N N 71 120.200 125.146 -4.946 1
1 721 . 3 1 1 A 72 72 GLU H H 72 9.230 8.076 1.154 1
1 722 . 3 1 1 A 72 72 GLU HA H 72 3.240 4.271 -1.031 1
1 727 . 3 1 1 A 72 72 GLU CA C 72 58.300 56.652 1.648 1
1 728 . 3 1 1 A 72 72 GLU CB C 72 26.000 29.397 -3.397 1
1 730 . 3 1 1 A 72 72 GLU N N 72 115.100 116.550 -1.450 1
1 731 . 3 1 1 A 73 73 SER H H 73 7.690 8.004 -0.314 1
1 732 . 3 1 1 A 73 73 SER HA H 73 4.520 4.794 -0.274 1
1 735 . 3 1 1 A 73 73 SER CA C 73 61.100 58.692 2.408 1
1 736 . 3 1 1 A 73 73 SER CB C 73 64.800 65.067 -0.267 1
1 737 . 3 1 1 A 73 73 SER N N 73 115.300 114.798 0.502 1
1 738 . 3 1 1 A 74 74 THR H H 74 8.620 7.894 0.726 1
1 739 . 3 1 1 A 74 74 THR HA H 74 5.200 5.078 0.122 1
1 744 . 3 1 1 A 74 74 THR CA C 74 62.400 61.781 0.619 1
1 745 . 3 1 1 A 74 74 THR CB C 74 70.200 70.831 -0.631 1
1 747 . 3 1 1 A 74 74 THR N N 74 117.500 111.062 6.438 1
1 748 . 3 1 1 A 75 75 LEU H H 75 9.350 9.123 0.227 1
1 749 . 3 1 1 A 75 75 LEU HA H 75 4.990 4.967 0.023 1
1 759 . 3 1 1 A 75 75 LEU CA C 75 53.800 53.447 0.353 1
1 760 . 3 1 1 A 75 75 LEU CB C 75 44.400 46.397 -1.997 1
1 764 . 3 1 1 A 75 75 LEU N N 75 128.000 128.113 -0.113 1
1 765 . 3 1 1 A 76 76 HIS H H 76 9.140 8.163 0.977 1
1 766 . 3 1 1 A 76 76 HIS HA H 76 5.040 5.111 -0.071 1
1 769 . 3 1 1 A 76 76 HIS CA C 76 56.200 54.324 1.876 1
1 770 . 3 1 1 A 76 76 HIS CB C 76 32.500 31.826 0.674 1
1 771 . 3 1 1 A 76 76 HIS N N 76 119.600 122.358 -2.758 1
1 772 . 3 1 1 A 77 77 LEU H H 77 8.240 8.958 -0.718 1
1 773 . 3 1 1 A 77 77 LEU HA H 77 5.080 5.129 -0.049 1
1 783 . 3 1 1 A 77 77 LEU CA C 77 53.600 53.769 -0.169 1
1 784 . 3 1 1 A 77 77 LEU CB C 77 44.100 43.360 0.740 1
1 788 . 3 1 1 A 77 77 LEU N N 77 123.800 121.851 1.949 1
1 789 . 3 1 1 A 78 78 VAL H H 78 9.110 8.745 0.365 1
1 790 . 3 1 1 A 78 78 VAL HA H 78 4.260 4.638 -0.378 1
1 798 . 3 1 1 A 78 78 VAL CA C 78 60.400 61.159 -0.759 1
1 799 . 3 1 1 A 78 78 VAL CB C 78 34.700 35.457 -0.757 1
1 802 . 3 1 1 A 78 78 VAL N N 78 127.100 123.944 3.156 1
1 803 . 3 1 1 A 79 79 LEU H H 79 8.050 8.864 -0.814 1
1 804 . 3 1 1 A 79 79 LEU HA H 79 4.950 4.907 0.043 1
1 813 . 3 1 1 A 79 79 LEU CA C 79 53.800 53.123 0.677 1
1 814 . 3 1 1 A 79 79 LEU CB C 79 42.700 44.529 -1.829 1
1 818 . 3 1 1 A 79 79 LEU N N 79 123.400 128.961 -5.561 1
1 819 . 3 1 1 A 80 80 ARG H H 80 8.540 9.067 -0.527 1
1 820 . 3 1 1 A 80 80 ARG HA H 80 4.170 3.936 0.234 1
1 827 . 3 1 1 A 80 80 ARG CA C 80 55.800 56.933 -1.133 1
1 828 . 3 1 1 A 80 80 ARG CB C 80 31.100 28.849 2.251 1
1 830 . 3 1 1 A 80 80 ARG N N 80 123.500 126.375 -2.875 1
1 831 . 3 1 1 A 81 81 LEU H H 81 8.250 7.774 0.476 1
1 832 . 3 1 1 A 81 81 LEU HA H 81 4.270 4.313 -0.043 1
1 842 . 3 1 1 A 81 81 LEU CA C 81 55.000 54.882 0.118 1
1 843 . 3 1 1 A 81 81 LEU CB C 81 42.200 43.293 -1.093 1
1 847 . 3 1 1 A 81 81 LEU N N 81 124.100 118.575 5.525 1
1 848 . 3 1 1 A 82 82 ARG H H 82 8.310 8.574 -0.264 1
1 849 . 3 1 1 A 82 82 ARG HA H 82 4.200 4.713 -0.513 1
1 852 . 3 1 1 A 82 82 ARG CA C 82 56.300 55.950 0.350 1
1 853 . 3 1 1 A 82 82 ARG CB C 82 30.700 32.954 -2.254 1
1 855 . 3 1 1 A 82 82 ARG N N 82 121.500 119.422 2.078 1
1 856 . 3 1 1 A 83 83 GLY H H 83 8.410 8.453 -0.043 1
1 857 . 3 1 1 A 83 83 GLY HA2 H 83 3.750 4.083 -0.333 1
1 858 . 3 1 1 A 83 83 GLY HA3 H 83 3.754 4.164 -0.410 1
1 859 . 3 1 1 A 83 83 GLY CA C 83 45.100 44.303 0.797 1
1 860 . 3 1 1 A 83 83 GLY N N 83 110.200 111.286 -1.086 1
1 861 . 3 1 1 A 84 84 TYR H H 84 7.950 7.963 -0.013 1
1 862 . 3 1 1 A 84 84 TYR HA H 84 4.400 5.451 -1.051 1
1 865 . 3 1 1 A 84 84 TYR CA C 84 58.100 55.331 2.769 1
1 866 . 3 1 1 A 84 84 TYR CB C 84 38.800 41.468 -2.668 1
1 867 . 3 1 1 A 84 84 TYR N N 84 119.900 115.369 4.531 1
1 868 . 3 1 1 A 85 85 ALA H H 85 8.150 8.485 -0.335 1
1 869 . 3 1 1 A 85 85 ALA HA H 85 4.150 4.630 -0.480 1
1 873 . 3 1 1 A 85 85 ALA CA C 85 52.600 51.677 0.923 1
1 874 . 3 1 1 A 85 85 ALA CB C 85 19.200 19.993 -0.793 1
1 875 . 3 1 1 A 85 85 ALA N N 85 124.800 121.867 2.933 1
1 876 . 3 1 1 A 86 86 ASP H H 86 8.020 8.510 -0.490 1
1 877 . 3 1 1 A 86 86 ASP HA H 86 4.450 4.998 -0.548 1
1 880 . 3 1 1 A 86 86 ASP CA C 86 54.100 53.873 0.227 1
1 881 . 3 1 1 A 86 86 ASP CB C 86 41.100 44.561 -3.461 1
1 882 . 3 1 1 A 86 86 ASP N N 86 118.900 122.700 -3.800 1
1 883 . 3 1 1 A 87 87 LEU H H 87 8.010 8.507 -0.497 1
1 884 . 3 1 1 A 87 87 LEU HA H 87 4.210 4.199 0.011 1
1 893 . 3 1 1 A 87 87 LEU CA C 87 55.300 54.998 0.302 1
1 894 . 3 1 1 A 87 87 LEU CB C 87 42.000 43.078 -1.078 1
1 898 . 3 1 1 A 87 87 LEU N N 87 122.400 122.975 -0.575 1
1 899 . 3 1 1 A 88 88 ARG H H 88 8.170 8.551 -0.381 1
1 900 . 3 1 1 A 88 88 ARG HA H 88 4.210 4.679 -0.469 1
1 903 . 3 1 1 A 88 88 ARG CA C 88 56.300 55.500 0.800 1
1 904 . 3 1 1 A 88 88 ARG CB C 88 30.600 34.129 -3.529 1
1 905 . 3 1 1 A 88 88 ARG N N 88 121.200 120.627 0.573 1
1 906 . 3 1 1 A 91 91 PRO HA H 91 4.290 4.740 -0.450 1
1 911 . 3 1 1 A 91 91 PRO CA C 91 63.800 62.369 1.431 1
1 912 . 3 1 1 A 91 91 PRO CB C 91 32.100 29.422 2.678 1
1 915 . 3 1 1 A 92 92 ASP H H 92 8.280 8.294 -0.014 1
1 916 . 3 1 1 A 92 92 ASP HA H 92 4.540 5.128 -0.588 1
1 919 . 3 1 1 A 92 92 ASP CA C 92 54.600 53.084 1.516 1
1 920 . 3 1 1 A 92 92 ASP CB C 92 41.000 43.994 -2.994 1
1 921 . 3 1 1 A 92 92 ASP N N 92 118.700 118.279 0.421 1
1 922 . 3 1 1 A 93 93 ARG H H 93 7.780 8.453 -0.673 1
1 923 . 3 1 1 A 93 93 ARG HA H 93 4.190 4.598 -0.408 1
1 930 . 3 1 1 A 93 93 ARG CA C 93 56.300 54.747 1.553 1
1 931 . 3 1 1 A 93 93 ARG CB C 93 30.700 32.129 -1.429 1
1 934 . 3 1 1 A 93 93 ARG N N 93 120.700 122.584 -1.884 1
1 935 . 3 1 1 A 94 94 GLN H H 94 8.280 8.421 -0.141 1
1 936 . 3 1 1 A 94 94 GLN HA H 94 4.210 4.462 -0.252 1
1 941 . 3 1 1 A 94 94 GLN CA C 94 55.800 55.666 0.134 1
1 942 . 3 1 1 A 94 94 GLN CB C 94 29.300 29.622 -0.322 1
1 944 . 3 1 1 A 94 94 GLN N N 94 121.000 120.247 0.753 1
1 945 . 3 1 1 A 95 95 ASP H H 95 8.270 8.745 -0.475 1
1 946 . 3 1 1 A 95 95 ASP HA H 95 4.450 5.214 -0.764 1
1 949 . 3 1 1 A 95 95 ASP CA C 95 54.300 53.330 0.970 1
1 950 . 3 1 1 A 95 95 ASP CB C 95 41.000 45.315 -4.315 1
1 951 . 3 1 1 A 95 95 ASP N N 95 121.000 119.723 1.277 1
1 952 . 3 1 1 A 96 96 HIS H H 96 8.090 8.828 -0.738 1
1 953 . 3 1 1 A 96 96 HIS HA H 96 4.470 5.222 -0.752 1
1 956 . 3 1 1 A 96 96 HIS CA C 96 55.900 54.751 1.149 1
1 957 . 3 1 1 A 96 96 HIS CB C 96 30.500 31.720 -1.220 1
1 958 . 3 1 1 A 96 96 HIS N N 96 119.300 116.047 3.253 1
1 959 . 3 1 1 A 97 97 HIS H H 97 8.240 8.888 -0.648 1
1 960 . 3 1 1 A 97 97 HIS HA H 97 4.470 4.710 -0.240 1
1 963 . 3 1 1 A 97 97 HIS CA C 97 56.200 54.822 1.378 1
1 964 . 3 1 1 A 97 97 HIS CB C 97 30.400 30.319 0.081 1
1 965 . 3 1 1 A 97 97 HIS N N 97 121.300 118.732 2.568 1
1 966 . 3 1 1 A 98 98 PRO HA H 98 4.340 4.541 -0.201 1
1 973 . 3 1 1 A 98 98 PRO CA C 98 63.700 62.448 1.252 1
1 974 . 3 1 1 A 98 98 PRO CB C 98 31.900 33.458 -1.558 1
1 977 . 3 1 1 A 99 99 GLY H H 99 8.660 8.388 0.272 1
1 978 . 3 1 1 A 99 99 GLY HA2 H 99 3.920 4.362 -0.442 1
1 979 . 3 1 1 A 99 99 GLY HA3 H 99 3.920 4.364 -0.444 1
1 980 . 3 1 1 A 99 99 GLY CA C 99 45.200 45.473 -0.273 1
1 981 . 3 1 1 A 99 99 GLY N N 99 110.000 107.201 2.799 1
1 982 . 3 1 1 A 100 100 SER H H 100 8.170 8.495 -0.325 1
1 983 . 3 1 1 A 100 100 SER HA H 100 4.360 4.962 -0.602 1
1 986 . 3 1 1 A 100 100 SER CA C 100 58.500 57.796 0.704 1
1 987 . 3 1 1 A 100 100 SER CB C 100 64.000 66.018 -2.018 1
1 988 . 3 1 1 A 100 100 SER N N 100 115.600 113.867 1.733 1
1 989 . 3 1 1 A 101 101 GLY H H 101 8.420 9.058 -0.638 1
1 990 . 3 1 1 A 101 101 GLY HA2 H 101 3.890 4.162 -0.272 1
1 991 . 3 1 1 A 101 101 GLY HA3 H 101 3.920 4.163 -0.243 1
1 992 . 3 1 1 A 101 101 GLY CA C 101 45.200 43.962 1.238 1
1 993 . 3 1 1 A 101 101 GLY N N 101 111.000 110.493 0.507 1
1 994 . 3 1 1 A 102 102 ALA H H 102 8.030 8.444 -0.414 1
1 995 . 3 1 1 A 102 102 ALA HA H 102 4.250 4.847 -0.597 1
1 999 . 3 1 1 A 102 102 ALA CA C 102 52.500 51.424 1.076 1
1 1000 . 3 1 1 A 102 102 ALA CB C 102 19.200 22.286 -3.086 1
1 4 . 4 1 1 A 2 2 SER H H 2 8.160 8.616 -0.456 1
1 5 . 4 1 1 A 2 2 SER HA H 2 4.370 4.608 -0.238 1
1 9 . 4 1 1 A 2 2 SER CA C 2 58.300 60.048 -1.748 1
1 10 . 4 1 1 A 2 2 SER CB C 2 63.900 64.518 -0.618 1
1 11 . 4 1 1 A 2 2 SER N N 2 115.600 116.682 -1.082 1
1 12 . 4 1 1 A 3 3 LEU H H 3 8.250 7.766 0.484 1
1 13 . 4 1 1 A 3 3 LEU HA H 3 4.280 5.005 -0.725 1
1 17 . 4 1 1 A 3 3 LEU CA C 3 55.200 52.805 2.395 1
1 18 . 4 1 1 A 3 3 LEU CB C 3 42.100 45.788 -3.688 1
1 19 . 4 1 1 A 3 3 LEU N N 3 124.100 116.726 7.374 1
1 20 . 4 1 1 A 4 4 VAL H H 4 7.950 8.513 -0.563 1
1 21 . 4 1 1 A 4 4 VAL HA H 4 4.680 4.753 -0.073 1
1 26 . 4 1 1 A 4 4 VAL CA C 4 59.800 57.865 1.935 1
1 27 . 4 1 1 A 4 4 VAL CB C 4 32.500 33.424 -0.924 1
1 28 . 4 1 1 A 4 4 VAL N N 4 122.600 115.704 6.896 1
1 29 . 4 1 1 A 5 5 PRO CA C 5 63.100 65.462 -2.362 1
1 30 . 4 1 1 A 5 5 PRO CB C 5 32.000 31.731 0.269 1
1 32 . 4 1 1 A 6 6 ARG H H 6 8.360 8.031 0.329 1
1 33 . 4 1 1 A 6 6 ARG HA H 6 4.250 3.959 0.291 1
1 36 . 4 1 1 A 6 6 ARG CA C 6 56.000 56.938 -0.938 1
1 37 . 4 1 1 A 6 6 ARG CB C 6 30.900 28.848 2.052 1
1 38 . 4 1 1 A 6 6 ARG N N 6 121.800 118.118 3.682 1
1 39 . 4 1 1 A 7 7 GLY H H 7 8.460 8.105 0.355 1
1 40 . 4 1 1 A 7 7 GLY HA2 H 7 3.940 4.213 -0.273 1
1 41 . 4 1 1 A 7 7 GLY HA3 H 7 3.760 4.214 -0.454 1
1 42 . 4 1 1 A 7 7 GLY CA C 7 45.000 44.966 0.034 1
1 43 . 4 1 1 A 7 7 GLY N N 7 110.700 105.678 5.022 1
1 44 . 4 1 1 A 8 8 SER H H 8 7.990 8.836 -0.846 1
1 45 . 4 1 1 A 8 8 SER HA H 8 4.450 4.605 -0.155 1
1 48 . 4 1 1 A 8 8 SER CA C 8 58.900 59.021 -0.121 1
1 49 . 4 1 1 A 8 8 SER CB C 8 64.200 64.853 -0.653 1
1 50 . 4 1 1 A 8 8 SER N N 8 115.500 114.532 0.968 1
1 51 . 4 1 1 A 9 9 MET H H 9 9.040 7.649 1.391 1
1 52 . 4 1 1 A 9 9 MET HA H 9 4.610 5.066 -0.456 1
1 60 . 4 1 1 A 9 9 MET CA C 9 54.400 53.442 0.958 1
1 61 . 4 1 1 A 9 9 MET CB C 9 35.400 33.471 1.929 1
1 64 . 4 1 1 A 9 9 MET N N 9 120.500 119.526 0.974 1
1 65 . 4 1 1 A 10 10 GLN H H 10 8.270 8.938 -0.668 1
1 66 . 4 1 1 A 10 10 GLN HA H 10 5.270 5.343 -0.073 1
1 71 . 4 1 1 A 10 10 GLN CA C 10 54.200 54.246 -0.046 1
1 72 . 4 1 1 A 10 10 GLN CB C 10 30.500 32.562 -2.062 1
1 74 . 4 1 1 A 10 10 GLN N N 10 121.000 122.587 -1.587 1
1 75 . 4 1 1 A 11 11 ILE H H 11 8.270 8.791 -0.521 1
1 76 . 4 1 1 A 11 11 ILE HA H 11 4.100 4.801 -0.701 1
1 86 . 4 1 1 A 11 11 ILE CA C 11 59.400 59.320 0.080 1
1 87 . 4 1 1 A 11 11 ILE CB C 11 41.800 40.278 1.522 1
1 91 . 4 1 1 A 11 11 ILE N N 11 114.600 121.413 -6.813 1
1 92 . 4 1 1 A 12 12 PHE H H 12 8.520 8.787 -0.267 1
1 93 . 4 1 1 A 12 12 PHE HA H 12 5.540 5.371 0.169 1
1 96 . 4 1 1 A 12 12 PHE CA C 12 55.000 56.289 -1.289 1
1 97 . 4 1 1 A 12 12 PHE CB C 12 41.200 41.140 0.060 1
1 98 . 4 1 1 A 12 12 PHE N N 12 118.600 123.382 -4.782 1
1 99 . 4 1 1 A 13 13 VAL H H 13 9.230 8.806 0.424 1
1 100 . 4 1 1 A 13 13 VAL HA H 13 4.740 4.843 -0.103 1
1 108 . 4 1 1 A 13 13 VAL CA C 13 60.300 60.734 -0.434 1
1 109 . 4 1 1 A 13 13 VAL CB C 13 34.100 34.889 -0.789 1
1 112 . 4 1 1 A 13 13 VAL N N 13 121.400 125.368 -3.968 1
1 113 . 4 1 1 A 14 14 LYS H H 14 8.910 8.795 0.115 1
1 114 . 4 1 1 A 14 14 LYS HA H 14 5.190 4.724 0.466 1
1 122 . 4 1 1 A 14 14 LYS CA C 14 54.600 54.862 -0.262 1
1 123 . 4 1 1 A 14 14 LYS CB C 14 34.300 34.566 -0.266 1
1 126 . 4 1 1 A 14 14 LYS N N 14 128.000 126.937 1.063 1
1 127 . 4 1 1 A 15 15 THR H H 15 8.650 8.829 -0.179 1
1 128 . 4 1 1 A 15 15 THR HA H 15 4.870 4.676 0.194 1
1 133 . 4 1 1 A 15 15 THR CA C 15 60.300 60.800 -0.500 1
1 134 . 4 1 1 A 15 15 THR CB C 15 70.600 71.207 -0.607 1
1 136 . 4 1 1 A 15 15 THR N N 15 115.300 117.773 -2.473 1
1 137 . 4 1 1 A 16 16 LEU H H 16 9.070 8.827 0.243 1
1 138 . 4 1 1 A 16 16 LEU HA H 16 4.210 4.066 0.144 1
1 148 . 4 1 1 A 16 16 LEU CA C 16 57.400 57.600 -0.200 1
1 149 . 4 1 1 A 16 16 LEU CB C 16 41.800 41.546 0.254 1
1 153 . 4 1 1 A 16 16 LEU N N 16 121.400 119.251 2.149 1
1 154 . 4 1 1 A 17 17 THR H H 17 7.560 7.791 -0.231 1
1 155 . 4 1 1 A 17 17 THR HA H 17 4.330 4.314 0.016 1
1 160 . 4 1 1 A 17 17 THR CA C 17 61.400 63.409 -2.009 1
1 161 . 4 1 1 A 17 17 THR CB C 17 68.900 69.555 -0.655 1
1 163 . 4 1 1 A 17 17 THR N N 17 105.900 113.855 -7.955 1
1 164 . 4 1 1 A 18 18 GLY H H 18 7.750 7.574 0.176 1
1 165 . 4 1 1 A 18 18 GLY HA2 H 18 4.250 4.035 0.215 1
1 166 . 4 1 1 A 18 18 GLY HA3 H 18 3.520 4.054 -0.534 1
1 167 . 4 1 1 A 18 18 GLY CA C 18 45.300 44.927 0.373 1
1 168 . 4 1 1 A 18 18 GLY N N 18 109.300 109.313 -0.013 1
1 169 . 4 1 1 A 19 19 LYS H H 19 7.210 7.568 -0.358 1
1 170 . 4 1 1 A 19 19 LYS HA H 19 4.260 4.288 -0.028 1
1 175 . 4 1 1 A 19 19 LYS CA C 19 56.300 56.769 -0.469 1
1 176 . 4 1 1 A 19 19 LYS CB C 19 33.200 33.943 -0.743 1
1 179 . 4 1 1 A 19 19 LYS N N 19 122.000 120.604 1.396 1
1 180 . 4 1 1 A 20 20 THR H H 20 8.570 8.587 -0.017 1
1 181 . 4 1 1 A 20 20 THR HA H 20 4.950 5.141 -0.191 1
1 186 . 4 1 1 A 20 20 THR CA C 20 62.200 61.871 0.329 1
1 187 . 4 1 1 A 20 20 THR CB C 20 69.700 70.597 -0.897 1
1 189 . 4 1 1 A 20 20 THR N N 20 120.700 117.174 3.526 1
1 190 . 4 1 1 A 21 21 ILE H H 21 9.510 8.415 1.095 1
1 191 . 4 1 1 A 21 21 ILE HA H 21 4.390 4.855 -0.465 1
1 201 . 4 1 1 A 21 21 ILE CA C 21 60.000 59.070 0.930 1
1 202 . 4 1 1 A 21 21 ILE CB C 21 40.700 41.702 -1.002 1
1 206 . 4 1 1 A 21 21 ILE N N 21 128.200 122.615 5.585 1
1 207 . 4 1 1 A 22 22 THR H H 22 8.700 8.694 0.006 1
1 208 . 4 1 1 A 22 22 THR HA H 22 4.860 4.480 0.380 1
1 213 . 4 1 1 A 22 22 THR CA C 22 62.100 62.822 -0.722 1
1 214 . 4 1 1 A 22 22 THR CB C 22 69.500 68.951 0.549 1
1 216 . 4 1 1 A 22 22 THR N N 22 122.300 120.891 1.409 1
1 217 . 4 1 1 A 23 23 LEU H H 23 8.720 8.898 -0.178 1
1 218 . 4 1 1 A 23 23 LEU HA H 23 4.690 5.090 -0.400 1
1 228 . 4 1 1 A 23 23 LEU CA C 23 52.700 53.357 -0.657 1
1 229 . 4 1 1 A 23 23 LEU CB C 23 46.600 45.068 1.532 1
1 233 . 4 1 1 A 23 23 LEU N N 23 125.400 127.380 -1.980 1
1 234 . 4 1 1 A 24 24 GLU H H 24 8.080 8.560 -0.480 1
1 235 . 4 1 1 A 24 24 GLU HA H 24 4.800 4.882 -0.082 1
1 238 . 4 1 1 A 24 24 GLU CA C 24 55.400 55.697 -0.297 1
1 239 . 4 1 1 A 24 24 GLU CB C 24 30.100 31.102 -1.002 1
1 241 . 4 1 1 A 24 24 GLU N N 24 121.800 120.672 1.128 1
1 242 . 4 1 1 A 25 25 VAL H H 25 8.800 8.536 0.264 1
1 243 . 4 1 1 A 25 25 VAL HA H 25 4.640 4.908 -0.268 1
1 251 . 4 1 1 A 25 25 VAL CA C 25 58.600 59.422 -0.822 1
1 252 . 4 1 1 A 25 25 VAL CB C 25 36.300 35.659 0.641 1
1 255 . 4 1 1 A 25 25 VAL N N 25 116.700 119.750 -3.050 1
1 256 . 4 1 1 A 26 26 GLU H H 26 8.500 8.408 0.092 1
1 257 . 4 1 1 A 26 26 GLU HA H 26 4.900 4.661 0.239 1
1 260 . 4 1 1 A 26 26 GLU CA C 26 53.000 54.228 -1.228 1
1 261 . 4 1 1 A 26 26 GLU CB C 26 31.200 33.990 -2.790 1
1 262 . 4 1 1 A 26 26 GLU N N 26 117.900 126.712 -8.812 1
1 263 . 4 1 1 A 27 27 PRO HA H 27 4.040 4.447 -0.407 1
1 270 . 4 1 1 A 27 27 PRO CA C 27 65.400 64.292 1.108 1
1 271 . 4 1 1 A 27 27 PRO CB C 27 31.700 31.806 -0.106 1
1 274 . 4 1 1 A 28 28 SER H H 28 7.010 8.225 -1.215 1
1 275 . 4 1 1 A 28 28 SER HA H 28 4.280 4.631 -0.351 1
1 278 . 4 1 1 A 28 28 SER CA C 28 57.400 58.604 -1.204 1
1 279 . 4 1 1 A 28 28 SER CB C 28 63.400 64.326 -0.926 1
1 280 . 4 1 1 A 28 28 SER N N 28 103.800 111.633 -7.833 1
1 281 . 4 1 1 A 29 29 ASP H H 29 7.960 7.652 0.308 1
1 282 . 4 1 1 A 29 29 ASP HA H 29 4.600 5.202 -0.602 1
1 285 . 4 1 1 A 29 29 ASP CA C 29 55.900 52.770 3.130 1
1 286 . 4 1 1 A 29 29 ASP CB C 29 41.000 44.249 -3.249 1
1 287 . 4 1 1 A 29 29 ASP N N 29 123.700 122.032 1.668 1
1 288 . 4 1 1 A 30 30 THR H H 30 7.780 8.870 -1.090 1
1 289 . 4 1 1 A 30 30 THR HA H 30 4.850 4.737 0.113 1
1 294 . 4 1 1 A 30 30 THR CA C 30 59.400 60.400 -1.000 1
1 295 . 4 1 1 A 30 30 THR CB C 30 71.100 71.621 -0.521 1
1 297 . 4 1 1 A 30 30 THR N N 30 108.800 116.259 -7.459 1
1 298 . 4 1 1 A 31 31 ILE H H 31 8.320 8.966 -0.646 1
1 299 . 4 1 1 A 31 31 ILE HA H 31 3.580 3.724 -0.144 1
1 309 . 4 1 1 A 31 31 ILE CA C 31 62.200 64.628 -2.428 1
1 310 . 4 1 1 A 31 31 ILE CB C 31 34.300 37.439 -3.139 1
1 314 . 4 1 1 A 31 31 ILE N N 31 121.300 122.399 -1.099 1
1 315 . 4 1 1 A 32 32 GLU H H 32 9.850 8.108 1.742 1
1 316 . 4 1 1 A 32 32 GLU HA H 32 3.780 3.906 -0.126 1
1 321 . 4 1 1 A 32 32 GLU CA C 32 60.500 60.017 0.483 1
1 322 . 4 1 1 A 32 32 GLU CB C 32 28.800 29.389 -0.589 1
1 324 . 4 1 1 A 32 32 GLU N N 32 121.600 122.534 -0.934 1
1 325 . 4 1 1 A 33 33 ASN H H 33 7.810 7.566 0.244 1
1 326 . 4 1 1 A 33 33 ASN HA H 33 4.440 4.482 -0.042 1
1 329 . 4 1 1 A 33 33 ASN CA C 33 55.800 55.922 -0.122 1
1 330 . 4 1 1 A 33 33 ASN CB C 33 38.100 38.209 -0.109 1
1 331 . 4 1 1 A 33 33 ASN N N 33 121.000 118.927 2.073 1
1 332 . 4 1 1 A 34 34 VAL H H 34 8.000 7.738 0.262 1
1 333 . 4 1 1 A 34 34 VAL HA H 34 3.300 3.514 -0.214 1
1 341 . 4 1 1 A 34 34 VAL CA C 34 67.600 67.172 0.428 1
1 342 . 4 1 1 A 34 34 VAL CB C 34 30.700 31.512 -0.812 1
1 345 . 4 1 1 A 34 34 VAL N N 34 122.200 119.889 2.311 1
1 346 . 4 1 1 A 35 35 LYS H H 35 8.490 8.330 0.160 1
1 347 . 4 1 1 A 35 35 LYS HA H 35 4.500 4.069 0.431 1
1 352 . 4 1 1 A 35 35 LYS CA C 35 59.300 58.679 0.621 1
1 353 . 4 1 1 A 35 35 LYS CB C 35 33.500 31.903 1.597 1
1 354 . 4 1 1 A 35 35 LYS N N 35 119.200 120.352 -1.152 1
1 355 . 4 1 1 A 36 36 ALA H H 36 7.880 8.211 -0.331 1
1 356 . 4 1 1 A 36 36 ALA HA H 36 4.060 4.042 0.018 1
1 360 . 4 1 1 A 36 36 ALA CA C 36 55.300 54.831 0.469 1
1 361 . 4 1 1 A 36 36 ALA CB C 36 17.600 18.071 -0.471 1
1 362 . 4 1 1 A 36 36 ALA N N 36 123.300 121.998 1.302 1
1 363 . 4 1 1 A 37 37 LYS H H 37 7.790 8.034 -0.244 1
1 364 . 4 1 1 A 37 37 LYS HA H 37 4.110 4.095 0.015 1
1 373 . 4 1 1 A 37 37 LYS CA C 37 59.700 59.317 0.383 1
1 374 . 4 1 1 A 37 37 LYS CB C 37 33.100 32.446 0.654 1
1 378 . 4 1 1 A 37 37 LYS N N 37 120.400 117.210 3.190 1
1 379 . 4 1 1 A 38 38 ILE H H 38 8.240 7.800 0.440 1
1 380 . 4 1 1 A 38 38 ILE HA H 38 3.410 3.958 -0.548 1
1 390 . 4 1 1 A 38 38 ILE CA C 38 66.200 62.695 3.505 1
1 391 . 4 1 1 A 38 38 ILE CB C 38 36.800 37.700 -0.900 1
1 395 . 4 1 1 A 38 38 ILE N N 38 121.400 120.442 0.958 1
1 396 . 4 1 1 A 39 39 GLN H H 39 8.460 8.653 -0.193 1
1 397 . 4 1 1 A 39 39 GLN HA H 39 3.730 3.948 -0.218 1
1 402 . 4 1 1 A 39 39 GLN CA C 39 60.000 58.978 1.022 1
1 403 . 4 1 1 A 39 39 GLN CB C 39 27.600 28.017 -0.417 1
1 405 . 4 1 1 A 39 39 GLN N N 39 123.500 120.947 2.553 1
1 406 . 4 1 1 A 40 40 ASP H H 40 7.970 8.118 -0.148 1
1 407 . 4 1 1 A 40 40 ASP HA H 40 4.240 4.379 -0.139 1
1 410 . 4 1 1 A 40 40 ASP CA C 40 57.400 56.711 0.689 1
1 411 . 4 1 1 A 40 40 ASP CB C 40 41.000 40.696 0.304 1
1 412 . 4 1 1 A 40 40 ASP N N 40 119.900 119.267 0.633 1
1 413 . 4 1 1 A 41 41 LYS H H 41 7.420 7.843 -0.423 1
1 414 . 4 1 1 A 41 41 LYS HA H 41 4.200 4.142 0.058 1
1 423 . 4 1 1 A 41 41 LYS CA C 41 58.200 59.073 -0.873 1
1 424 . 4 1 1 A 41 41 LYS CB C 41 33.900 32.822 1.078 1
1 427 . 4 1 1 A 41 41 LYS N N 41 115.700 119.049 -3.349 1
1 428 . 4 1 1 A 42 42 GLU H H 42 8.650 8.177 0.473 1
1 429 . 4 1 1 A 42 42 GLU HA H 42 4.470 4.529 -0.059 1
1 434 . 4 1 1 A 42 42 GLU CA C 42 55.300 56.081 -0.781 1
1 435 . 4 1 1 A 42 42 GLU CB C 42 33.200 32.035 1.165 1
1 437 . 4 1 1 A 42 42 GLU N N 42 114.200 115.475 -1.275 1
1 438 . 4 1 1 A 43 43 GLY H H 43 8.400 8.183 0.217 1
1 439 . 4 1 1 A 43 43 GLY HA2 H 43 4.040 4.000 0.040 1
1 440 . 4 1 1 A 43 43 GLY HA3 H 43 3.820 4.003 -0.183 1
1 441 . 4 1 1 A 43 43 GLY CA C 43 45.900 45.268 0.632 1
1 442 . 4 1 1 A 43 43 GLY N N 43 109.000 108.578 0.422 1
1 443 . 4 1 1 A 44 44 ILE H H 44 6.080 7.884 -1.804 1
1 444 . 4 1 1 A 44 44 ILE HA H 44 4.290 4.297 -0.007 1
1 446 . 4 1 1 A 44 44 ILE CA C 44 57.700 58.079 -0.379 1
1 447 . 4 1 1 A 44 44 ILE CB C 44 40.400 38.627 1.773 1
1 448 . 4 1 1 A 44 44 ILE N N 44 120.500 122.142 -1.642 1
1 449 . 4 1 1 A 46 46 PRO HA H 46 4.030 4.223 -0.193 1
1 454 . 4 1 1 A 46 46 PRO CA C 46 66.100 65.317 0.783 1
1 455 . 4 1 1 A 46 46 PRO CB C 46 32.600 32.034 0.566 1
1 458 . 4 1 1 A 47 47 ASP H H 47 8.470 8.639 -0.169 1
1 459 . 4 1 1 A 47 47 ASP HA H 47 4.310 4.458 -0.148 1
1 462 . 4 1 1 A 47 47 ASP CA C 47 55.700 56.061 -0.361 1
1 463 . 4 1 1 A 47 47 ASP CB C 47 39.700 40.157 -0.457 1
1 464 . 4 1 1 A 47 47 ASP N N 47 113.700 117.236 -3.536 1
1 465 . 4 1 1 A 48 48 GLN H H 48 7.720 7.794 -0.074 1
1 466 . 4 1 1 A 48 48 GLN HA H 48 4.340 4.484 -0.144 1
1 471 . 4 1 1 A 48 48 GLN CA C 48 55.500 55.591 -0.091 1
1 472 . 4 1 1 A 48 48 GLN CB C 48 29.900 30.000 -0.100 1
1 474 . 4 1 1 A 48 48 GLN N N 48 116.900 116.456 0.444 1
1 475 . 4 1 1 A 49 49 GLN H H 49 7.410 7.863 -0.453 1
1 476 . 4 1 1 A 49 49 GLN HA H 49 4.110 4.573 -0.463 1
1 481 . 4 1 1 A 49 49 GLN CA C 49 56.600 54.643 1.957 1
1 482 . 4 1 1 A 49 49 GLN CB C 49 31.300 30.212 1.088 1
1 484 . 4 1 1 A 49 49 GLN N N 49 118.000 116.292 1.708 1
1 485 . 4 1 1 A 50 50 ARG H H 50 8.400 8.652 -0.252 1
1 486 . 4 1 1 A 50 50 ARG HA H 50 4.380 5.055 -0.675 1
1 491 . 4 1 1 A 50 50 ARG CA C 50 55.100 54.051 1.049 1
1 492 . 4 1 1 A 50 50 ARG CB C 50 31.600 34.181 -2.581 1
1 494 . 4 1 1 A 50 50 ARG N N 50 123.100 117.559 5.541 1
1 495 . 4 1 1 A 51 51 LEU H H 51 8.710 8.604 0.106 1
1 496 . 4 1 1 A 51 51 LEU HA H 51 5.300 5.061 0.239 1
1 506 . 4 1 1 A 51 51 LEU CA C 51 52.900 53.379 -0.479 1
1 507 . 4 1 1 A 51 51 LEU CB C 51 45.700 44.075 1.625 1
1 511 . 4 1 1 A 51 51 LEU N N 51 124.400 121.617 2.783 1
1 512 . 4 1 1 A 52 52 ILE H H 52 9.060 8.883 0.177 1
1 513 . 4 1 1 A 52 52 ILE HA H 52 4.840 5.083 -0.243 1
1 523 . 4 1 1 A 52 52 ILE CA C 52 58.900 59.998 -1.098 1
1 524 . 4 1 1 A 52 52 ILE CB C 52 41.200 40.657 0.543 1
1 528 . 4 1 1 A 52 52 ILE N N 52 122.500 124.290 -1.790 1
1 529 . 4 1 1 A 53 53 PHE H H 53 8.730 9.439 -0.709 1
1 530 . 4 1 1 A 53 53 PHE HA H 53 5.100 4.871 0.229 1
1 535 . 4 1 1 A 53 53 PHE CA C 53 56.300 57.560 -1.260 1
1 536 . 4 1 1 A 53 53 PHE CB C 53 43.500 41.886 1.614 1
1 537 . 4 1 1 A 53 53 PHE N N 53 124.800 127.817 -3.017 1
1 538 . 4 1 1 A 54 54 ALA H H 54 8.940 9.162 -0.222 1
1 539 . 4 1 1 A 54 54 ALA HA H 54 3.610 3.927 -0.317 1
1 543 . 4 1 1 A 54 54 ALA CA C 54 52.500 53.060 -0.560 1
1 544 . 4 1 1 A 54 54 ALA CB C 54 16.300 17.439 -1.139 1
1 545 . 4 1 1 A 54 54 ALA N N 54 133.100 130.317 2.783 1
1 546 . 4 1 1 A 55 55 GLY H H 55 8.070 8.372 -0.302 1
1 547 . 4 1 1 A 55 55 GLY HA2 H 55 4.000 3.808 0.192 1
1 548 . 4 1 1 A 55 55 GLY HA3 H 55 3.340 3.840 -0.500 1
1 549 . 4 1 1 A 55 55 GLY CA C 55 45.200 45.189 0.011 1
1 550 . 4 1 1 A 55 55 GLY N N 55 102.500 102.680 -0.180 1
1 551 . 4 1 1 A 56 56 LYS H H 56 7.860 8.039 -0.179 1
1 552 . 4 1 1 A 56 56 LYS HA H 56 4.510 4.578 -0.068 1
1 558 . 4 1 1 A 56 56 LYS CA C 56 54.500 54.692 -0.192 1
1 559 . 4 1 1 A 56 56 LYS CB C 56 34.400 33.895 0.505 1
1 561 . 4 1 1 A 56 56 LYS N N 56 121.800 121.917 -0.117 1
1 562 . 4 1 1 A 57 57 GLN H H 57 8.600 8.760 -0.160 1
1 563 . 4 1 1 A 57 57 GLN HA H 57 4.410 5.046 -0.636 1
1 568 . 4 1 1 A 57 57 GLN CA C 57 55.900 56.137 -0.237 1
1 569 . 4 1 1 A 57 57 GLN CB C 57 28.800 29.793 -0.993 1
1 571 . 4 1 1 A 57 57 GLN N N 57 123.200 128.357 -5.157 1
1 572 . 4 1 1 A 58 58 LEU H H 58 8.480 8.626 -0.146 1
1 573 . 4 1 1 A 58 58 LEU HA H 58 4.060 4.921 -0.861 1
1 583 . 4 1 1 A 58 58 LEU CA C 58 54.100 53.183 0.917 1
1 584 . 4 1 1 A 58 58 LEU CB C 58 41.500 44.841 -3.341 1
1 588 . 4 1 1 A 58 58 LEU N N 58 125.900 124.280 1.620 1
1 589 . 4 1 1 A 59 59 GLU H H 59 8.400 8.661 -0.261 1
1 590 . 4 1 1 A 59 59 GLU HA H 59 4.400 5.117 -0.717 1
1 595 . 4 1 1 A 59 59 GLU CA C 59 55.900 54.041 1.859 1
1 596 . 4 1 1 A 59 59 GLU CB C 59 31.900 33.051 -1.151 1
1 598 . 4 1 1 A 59 59 GLU N N 59 123.100 117.287 5.813 1
1 599 . 4 1 1 A 60 60 ASP H H 60 8.110 8.463 -0.353 1
1 600 . 4 1 1 A 60 60 ASP HA H 60 4.270 5.329 -1.059 1
1 603 . 4 1 1 A 60 60 ASP CA C 60 57.100 52.581 4.519 1
1 604 . 4 1 1 A 60 60 ASP CB C 60 40.800 44.221 -3.421 1
1 605 . 4 1 1 A 60 60 ASP N N 60 120.300 119.485 0.815 1
1 606 . 4 1 1 A 61 61 GLY HA2 H 61 4.000 4.062 -0.062 1
1 607 . 4 1 1 A 61 61 GLY HA3 H 61 3.830 4.085 -0.255 1
1 608 . 4 1 1 A 61 61 GLY CA C 61 45.000 45.837 -0.837 1
1 609 . 4 1 1 A 62 62 ARG H H 62 7.350 8.065 -0.715 1
1 610 . 4 1 1 A 62 62 ARG HA H 62 4.640 4.624 0.016 1
1 615 . 4 1 1 A 62 62 ARG CA C 62 54.400 55.271 -0.871 1
1 616 . 4 1 1 A 62 62 ARG CB C 62 32.600 31.982 0.618 1
1 618 . 4 1 1 A 62 62 ARG N N 62 119.300 121.488 -2.188 1
1 619 . 4 1 1 A 63 63 THR H H 63 8.460 8.477 -0.017 1
1 620 . 4 1 1 A 63 63 THR HA H 63 5.060 4.649 0.411 1
1 625 . 4 1 1 A 63 63 THR CA C 63 59.700 60.831 -1.131 1
1 626 . 4 1 1 A 63 63 THR CB C 63 72.000 71.122 0.878 1
1 628 . 4 1 1 A 63 63 THR N N 63 109.100 112.653 -3.553 1
1 629 . 4 1 1 A 64 64 LEU H H 64 8.190 8.841 -0.651 1
1 630 . 4 1 1 A 64 64 LEU HA H 64 3.920 3.995 -0.075 1
1 640 . 4 1 1 A 64 64 LEU CA C 64 58.400 58.071 0.329 1
1 641 . 4 1 1 A 64 64 LEU CB C 64 40.200 41.417 -1.217 1
1 645 . 4 1 1 A 64 64 LEU N N 64 118.100 123.043 -4.943 1
1 646 . 4 1 1 A 65 65 SER H H 65 8.370 7.720 0.650 1
1 647 . 4 1 1 A 65 65 SER HA H 65 4.150 4.160 -0.010 1
1 650 . 4 1 1 A 65 65 SER CA C 65 60.900 61.105 -0.205 1
1 651 . 4 1 1 A 65 65 SER CB C 65 62.500 63.138 -0.638 1
1 652 . 4 1 1 A 65 65 SER N N 65 112.200 114.070 -1.870 1
1 653 . 4 1 1 A 66 66 GLU H H 66 7.780 7.649 0.131 1
1 654 . 4 1 1 A 66 66 GLU HA H 66 3.890 4.135 -0.245 1
1 659 . 4 1 1 A 66 66 GLU CA C 66 59.200 58.790 0.410 1
1 660 . 4 1 1 A 66 66 GLU CB C 66 29.400 29.648 -0.248 1
1 662 . 4 1 1 A 66 66 GLU N N 66 123.600 121.619 1.981 1
1 663 . 4 1 1 A 67 67 TYR H H 67 7.290 7.763 -0.473 1
1 664 . 4 1 1 A 67 67 TYR HA H 67 4.590 4.536 0.054 1
1 669 . 4 1 1 A 67 67 TYR CA C 67 58.400 60.300 -1.900 1
1 670 . 4 1 1 A 67 67 TYR CB C 67 39.800 39.187 0.613 1
1 671 . 4 1 1 A 67 67 TYR N N 67 116.400 121.244 -4.844 1
1 672 . 4 1 1 A 68 68 ASN H H 68 8.040 7.885 0.155 1
1 673 . 4 1 1 A 68 68 ASN HA H 68 4.240 4.379 -0.139 1
1 676 . 4 1 1 A 68 68 ASN CA C 68 54.100 54.480 -0.380 1
1 677 . 4 1 1 A 68 68 ASN CB C 68 37.200 37.652 -0.452 1
1 678 . 4 1 1 A 68 68 ASN N N 68 115.600 115.945 -0.345 1
1 679 . 4 1 1 A 69 69 ILE H H 69 7.200 7.666 -0.466 1
1 680 . 4 1 1 A 69 69 ILE HA H 69 3.280 4.588 -1.308 1
1 690 . 4 1 1 A 69 69 ILE CA C 69 59.800 59.465 0.335 1
1 691 . 4 1 1 A 69 69 ILE CB C 69 36.600 39.088 -2.488 1
1 695 . 4 1 1 A 69 69 ILE N N 69 119.100 115.839 3.261 1
1 696 . 4 1 1 A 70 70 GLN H H 70 7.570 8.533 -0.963 1
1 697 . 4 1 1 A 70 70 GLN HA H 70 4.410 4.788 -0.378 1
1 702 . 4 1 1 A 70 70 GLN CA C 70 53.500 54.551 -1.051 1
1 703 . 4 1 1 A 70 70 GLN CB C 70 31.500 29.299 2.201 1
1 705 . 4 1 1 A 70 70 GLN N N 70 124.800 120.315 4.485 1
1 706 . 4 1 1 A 71 71 LYS H H 71 8.370 8.217 0.153 1
1 707 . 4 1 1 A 71 71 LYS HA H 71 3.870 3.976 -0.106 1
1 716 . 4 1 1 A 71 71 LYS CA C 71 58.000 55.777 2.223 1
1 717 . 4 1 1 A 71 71 LYS CB C 71 32.500 31.943 0.557 1
1 720 . 4 1 1 A 71 71 LYS N N 71 120.200 125.694 -5.494 1
1 721 . 4 1 1 A 72 72 GLU H H 72 9.230 7.844 1.386 1
1 722 . 4 1 1 A 72 72 GLU HA H 72 3.240 4.559 -1.319 1
1 727 . 4 1 1 A 72 72 GLU CA C 72 58.300 55.977 2.323 1
1 728 . 4 1 1 A 72 72 GLU CB C 72 26.000 30.054 -4.054 1
1 730 . 4 1 1 A 72 72 GLU N N 72 115.100 119.957 -4.857 1
1 731 . 4 1 1 A 73 73 SER H H 73 7.690 8.078 -0.388 1
1 732 . 4 1 1 A 73 73 SER HA H 73 4.520 4.786 -0.266 1
1 735 . 4 1 1 A 73 73 SER CA C 73 61.100 59.264 1.836 1
1 736 . 4 1 1 A 73 73 SER CB C 73 64.800 64.947 -0.147 1
1 737 . 4 1 1 A 73 73 SER N N 73 115.300 115.944 -0.644 1
1 738 . 4 1 1 A 74 74 THR H H 74 8.620 7.835 0.785 1
1 739 . 4 1 1 A 74 74 THR HA H 74 5.200 5.133 0.067 1
1 744 . 4 1 1 A 74 74 THR CA C 74 62.400 61.835 0.565 1
1 745 . 4 1 1 A 74 74 THR CB C 74 70.200 70.794 -0.594 1
1 747 . 4 1 1 A 74 74 THR N N 74 117.500 110.937 6.563 1
1 748 . 4 1 1 A 75 75 LEU H H 75 9.350 9.234 0.116 1
1 749 . 4 1 1 A 75 75 LEU HA H 75 4.990 5.428 -0.438 1
1 759 . 4 1 1 A 75 75 LEU CA C 75 53.800 53.989 -0.189 1
1 760 . 4 1 1 A 75 75 LEU CB C 75 44.400 45.811 -1.411 1
1 764 . 4 1 1 A 75 75 LEU N N 75 128.000 126.820 1.180 1
1 765 . 4 1 1 A 76 76 HIS H H 76 9.140 8.692 0.448 1
1 766 . 4 1 1 A 76 76 HIS HA H 76 5.040 5.339 -0.299 1
1 769 . 4 1 1 A 76 76 HIS CA C 76 56.200 54.309 1.891 1
1 770 . 4 1 1 A 76 76 HIS CB C 76 32.500 33.093 -0.593 1
1 771 . 4 1 1 A 76 76 HIS N N 76 119.600 124.269 -4.669 1
1 772 . 4 1 1 A 77 77 LEU H H 77 8.240 8.981 -0.741 1
1 773 . 4 1 1 A 77 77 LEU HA H 77 5.080 5.206 -0.126 1
1 783 . 4 1 1 A 77 77 LEU CA C 77 53.600 53.589 0.011 1
1 784 . 4 1 1 A 77 77 LEU CB C 77 44.100 43.260 0.840 1
1 788 . 4 1 1 A 77 77 LEU N N 77 123.800 123.703 0.097 1
1 789 . 4 1 1 A 78 78 VAL H H 78 9.110 8.491 0.619 1
1 790 . 4 1 1 A 78 78 VAL HA H 78 4.260 4.904 -0.644 1
1 798 . 4 1 1 A 78 78 VAL CA C 78 60.400 61.411 -1.011 1
1 799 . 4 1 1 A 78 78 VAL CB C 78 34.700 35.219 -0.519 1
1 802 . 4 1 1 A 78 78 VAL N N 78 127.100 124.545 2.555 1
1 803 . 4 1 1 A 79 79 LEU H H 79 8.050 8.845 -0.795 1
1 804 . 4 1 1 A 79 79 LEU HA H 79 4.950 4.894 0.056 1
1 813 . 4 1 1 A 79 79 LEU CA C 79 53.800 53.189 0.611 1
1 814 . 4 1 1 A 79 79 LEU CB C 79 42.700 44.346 -1.646 1
1 818 . 4 1 1 A 79 79 LEU N N 79 123.400 128.975 -5.575 1
1 819 . 4 1 1 A 80 80 ARG H H 80 8.540 9.082 -0.542 1
1 820 . 4 1 1 A 80 80 ARG HA H 80 4.170 3.957 0.213 1
1 827 . 4 1 1 A 80 80 ARG CA C 80 55.800 56.939 -1.139 1
1 828 . 4 1 1 A 80 80 ARG CB C 80 31.100 28.789 2.311 1
1 830 . 4 1 1 A 80 80 ARG N N 80 123.500 126.366 -2.866 1
1 831 . 4 1 1 A 81 81 LEU H H 81 8.250 7.745 0.505 1
1 832 . 4 1 1 A 81 81 LEU HA H 81 4.270 4.315 -0.045 1
1 842 . 4 1 1 A 81 81 LEU CA C 81 55.000 54.489 0.511 1
1 843 . 4 1 1 A 81 81 LEU CB C 81 42.200 43.244 -1.044 1
1 847 . 4 1 1 A 81 81 LEU N N 81 124.100 118.349 5.751 1
1 848 . 4 1 1 A 82 82 ARG H H 82 8.310 8.678 -0.368 1
1 849 . 4 1 1 A 82 82 ARG HA H 82 4.200 4.725 -0.525 1
1 852 . 4 1 1 A 82 82 ARG CA C 82 56.300 54.026 2.274 1
1 853 . 4 1 1 A 82 82 ARG CB C 82 30.700 33.694 -2.994 1
1 855 . 4 1 1 A 82 82 ARG N N 82 121.500 119.562 1.938 1
1 856 . 4 1 1 A 83 83 GLY H H 83 8.410 8.499 -0.089 1
1 857 . 4 1 1 A 83 83 GLY HA2 H 83 3.750 3.679 0.071 1
1 858 . 4 1 1 A 83 83 GLY HA3 H 83 3.754 3.837 -0.083 1
1 859 . 4 1 1 A 83 83 GLY CA C 83 45.100 47.239 -2.139 1
1 860 . 4 1 1 A 83 83 GLY N N 83 110.200 109.521 0.679 1
1 861 . 4 1 1 A 84 84 TYR H H 84 7.950 7.318 0.632 1
1 862 . 4 1 1 A 84 84 TYR HA H 84 4.400 4.912 -0.512 1
1 865 . 4 1 1 A 84 84 TYR CA C 84 58.100 56.582 1.518 1
1 866 . 4 1 1 A 84 84 TYR CB C 84 38.800 40.012 -1.212 1
1 867 . 4 1 1 A 84 84 TYR N N 84 119.900 112.799 7.101 1
1 868 . 4 1 1 A 85 85 ALA H H 85 8.150 9.068 -0.918 1
1 869 . 4 1 1 A 85 85 ALA HA H 85 4.150 5.147 -0.997 1
1 873 . 4 1 1 A 85 85 ALA CA C 85 52.600 51.188 1.412 1
1 874 . 4 1 1 A 85 85 ALA CB C 85 19.200 24.125 -4.925 1
1 875 . 4 1 1 A 85 85 ALA N N 85 124.800 122.131 2.669 1
1 876 . 4 1 1 A 86 86 ASP H H 86 8.020 8.688 -0.668 1
1 877 . 4 1 1 A 86 86 ASP HA H 86 4.450 5.353 -0.903 1
1 880 . 4 1 1 A 86 86 ASP CA C 86 54.100 52.673 1.427 1
1 881 . 4 1 1 A 86 86 ASP CB C 86 41.100 45.056 -3.956 1
1 882 . 4 1 1 A 86 86 ASP N N 86 118.900 117.286 1.614 1
1 883 . 4 1 1 A 87 87 LEU H H 87 8.010 8.475 -0.465 1
1 884 . 4 1 1 A 87 87 LEU HA H 87 4.210 4.681 -0.471 1
1 893 . 4 1 1 A 87 87 LEU CA C 87 55.300 54.116 1.184 1
1 894 . 4 1 1 A 87 87 LEU CB C 87 42.000 41.982 0.018 1
1 898 . 4 1 1 A 87 87 LEU N N 87 122.400 120.258 2.142 1
1 899 . 4 1 1 A 88 88 ARG H H 88 8.170 8.208 -0.038 1
1 900 . 4 1 1 A 88 88 ARG HA H 88 4.210 4.120 0.090 1
1 903 . 4 1 1 A 88 88 ARG CA C 88 56.300 58.817 -2.517 1
1 904 . 4 1 1 A 88 88 ARG CB C 88 30.600 30.172 0.428 1
1 905 . 4 1 1 A 88 88 ARG N N 88 121.200 120.418 0.782 1
1 906 . 4 1 1 A 91 91 PRO HA H 91 4.290 4.589 -0.299 1
1 911 . 4 1 1 A 91 91 PRO CA C 91 63.800 62.245 1.555 1
1 912 . 4 1 1 A 91 91 PRO CB C 91 32.100 33.203 -1.103 1
1 915 . 4 1 1 A 92 92 ASP H H 92 8.280 8.437 -0.157 1
1 916 . 4 1 1 A 92 92 ASP HA H 92 4.540 4.704 -0.164 1
1 919 . 4 1 1 A 92 92 ASP CA C 92 54.600 53.238 1.362 1
1 920 . 4 1 1 A 92 92 ASP CB C 92 41.000 39.716 1.284 1
1 921 . 4 1 1 A 92 92 ASP N N 92 118.700 120.900 -2.200 1
1 922 . 4 1 1 A 93 93 ARG H H 93 7.780 7.956 -0.176 1
1 923 . 4 1 1 A 93 93 ARG HA H 93 4.190 4.410 -0.220 1
1 930 . 4 1 1 A 93 93 ARG CA C 93 56.300 56.064 0.236 1
1 931 . 4 1 1 A 93 93 ARG CB C 93 30.700 31.418 -0.718 1
1 934 . 4 1 1 A 93 93 ARG N N 93 120.700 123.941 -3.241 1
1 935 . 4 1 1 A 94 94 GLN H H 94 8.280 8.320 -0.040 1
1 936 . 4 1 1 A 94 94 GLN HA H 94 4.210 4.666 -0.456 1
1 941 . 4 1 1 A 94 94 GLN CA C 94 55.800 53.925 1.875 1
1 942 . 4 1 1 A 94 94 GLN CB C 94 29.300 29.685 -0.385 1
1 944 . 4 1 1 A 94 94 GLN N N 94 121.000 118.077 2.923 1
1 945 . 4 1 1 A 95 95 ASP H H 95 8.270 8.360 -0.090 1
1 946 . 4 1 1 A 95 95 ASP HA H 95 4.450 5.122 -0.672 1
1 949 . 4 1 1 A 95 95 ASP CA C 95 54.300 54.160 0.140 1
1 950 . 4 1 1 A 95 95 ASP CB C 95 41.000 43.151 -2.151 1
1 951 . 4 1 1 A 95 95 ASP N N 95 121.000 119.772 1.228 1
1 952 . 4 1 1 A 96 96 HIS H H 96 8.090 8.862 -0.772 1
1 953 . 4 1 1 A 96 96 HIS HA H 96 4.470 4.659 -0.189 1
1 956 . 4 1 1 A 96 96 HIS CA C 96 55.900 54.699 1.201 1
1 957 . 4 1 1 A 96 96 HIS CB C 96 30.500 33.300 -2.800 1
1 958 . 4 1 1 A 96 96 HIS N N 96 119.300 122.886 -3.586 1
1 959 . 4 1 1 A 97 97 HIS H H 97 8.240 8.643 -0.403 1
1 960 . 4 1 1 A 97 97 HIS HA H 97 4.470 4.654 -0.184 1
1 963 . 4 1 1 A 97 97 HIS CA C 97 56.200 54.744 1.456 1
1 964 . 4 1 1 A 97 97 HIS CB C 97 30.400 29.827 0.573 1
1 965 . 4 1 1 A 97 97 HIS N N 97 121.300 121.154 0.146 1
1 966 . 4 1 1 A 98 98 PRO HA H 98 4.340 4.538 -0.198 1
1 973 . 4 1 1 A 98 98 PRO CA C 98 63.700 62.820 0.880 1
1 974 . 4 1 1 A 98 98 PRO CB C 98 31.900 33.528 -1.628 1
1 977 . 4 1 1 A 99 99 GLY H H 99 8.660 8.178 0.482 1
1 978 . 4 1 1 A 99 99 GLY HA2 H 99 3.920 4.214 -0.294 1
1 979 . 4 1 1 A 99 99 GLY HA3 H 99 3.920 4.225 -0.305 1
1 980 . 4 1 1 A 99 99 GLY CA C 99 45.200 45.819 -0.619 1
1 981 . 4 1 1 A 99 99 GLY N N 99 110.000 108.875 1.125 1
1 982 . 4 1 1 A 100 100 SER H H 100 8.170 8.696 -0.526 1
1 983 . 4 1 1 A 100 100 SER HA H 100 4.360 5.237 -0.877 1
1 986 . 4 1 1 A 100 100 SER CA C 100 58.500 57.098 1.402 1
1 987 . 4 1 1 A 100 100 SER CB C 100 64.000 66.598 -2.598 1
1 988 . 4 1 1 A 100 100 SER N N 100 115.600 113.306 2.294 1
1 989 . 4 1 1 A 101 101 GLY H H 101 8.420 8.360 0.060 1
1 990 . 4 1 1 A 101 101 GLY HA2 H 101 3.890 4.292 -0.402 1
1 991 . 4 1 1 A 101 101 GLY HA3 H 101 3.920 4.293 -0.373 1
1 992 . 4 1 1 A 101 101 GLY CA C 101 45.200 45.365 -0.165 1
1 993 . 4 1 1 A 101 101 GLY N N 101 111.000 107.558 3.442 1
1 994 . 4 1 1 A 102 102 ALA H H 102 8.030 8.463 -0.433 1
1 995 . 4 1 1 A 102 102 ALA HA H 102 4.250 5.171 -0.921 1
1 999 . 4 1 1 A 102 102 ALA CA C 102 52.500 50.522 1.978 1
1 1000 . 4 1 1 A 102 102 ALA CB C 102 19.200 21.234 -2.034 1
1 4 . 5 1 1 A 2 2 SER H H 2 8.160 8.879 -0.719 1
1 5 . 5 1 1 A 2 2 SER HA H 2 4.370 4.792 -0.422 1
1 9 . 5 1 1 A 2 2 SER CA C 2 58.300 57.207 1.093 1
1 10 . 5 1 1 A 2 2 SER CB C 2 63.900 63.585 0.315 1
1 11 . 5 1 1 A 2 2 SER N N 2 115.600 120.376 -4.776 1
1 12 . 5 1 1 A 3 3 LEU H H 3 8.250 7.671 0.579 1
1 13 . 5 1 1 A 3 3 LEU HA H 3 4.280 5.251 -0.971 1
1 17 . 5 1 1 A 3 3 LEU CA C 3 55.200 52.793 2.407 1
1 18 . 5 1 1 A 3 3 LEU CB C 3 42.100 46.306 -4.206 1
1 19 . 5 1 1 A 3 3 LEU N N 3 124.100 118.215 5.885 1
1 20 . 5 1 1 A 4 4 VAL H H 4 7.950 8.830 -0.880 1
1 21 . 5 1 1 A 4 4 VAL HA H 4 4.680 4.915 -0.235 1
1 26 . 5 1 1 A 4 4 VAL CA C 4 59.800 58.078 1.722 1
1 27 . 5 1 1 A 4 4 VAL CB C 4 32.500 33.531 -1.031 1
1 28 . 5 1 1 A 4 4 VAL N N 4 122.600 113.966 8.634 1
1 29 . 5 1 1 A 5 5 PRO CA C 5 63.100 62.718 0.382 1
1 30 . 5 1 1 A 5 5 PRO CB C 5 32.000 33.222 -1.222 1
1 32 . 5 1 1 A 6 6 ARG H H 6 8.360 8.791 -0.431 1
1 33 . 5 1 1 A 6 6 ARG HA H 6 4.250 4.880 -0.630 1
1 36 . 5 1 1 A 6 6 ARG CA C 6 56.000 55.581 0.419 1
1 37 . 5 1 1 A 6 6 ARG CB C 6 30.900 33.128 -2.228 1
1 38 . 5 1 1 A 6 6 ARG N N 6 121.800 123.100 -1.300 1
1 39 . 5 1 1 A 7 7 GLY H H 7 8.460 8.412 0.048 1
1 40 . 5 1 1 A 7 7 GLY HA2 H 7 3.940 4.275 -0.335 1
1 41 . 5 1 1 A 7 7 GLY HA3 H 7 3.760 4.276 -0.516 1
1 42 . 5 1 1 A 7 7 GLY CA C 7 45.000 45.455 -0.455 1
1 43 . 5 1 1 A 7 7 GLY N N 7 110.700 113.913 -3.213 1
1 44 . 5 1 1 A 8 8 SER H H 8 7.990 8.650 -0.660 1
1 45 . 5 1 1 A 8 8 SER HA H 8 4.450 4.615 -0.165 1
1 48 . 5 1 1 A 8 8 SER CA C 8 58.900 59.347 -0.447 1
1 49 . 5 1 1 A 8 8 SER CB C 8 64.200 64.865 -0.665 1
1 50 . 5 1 1 A 8 8 SER N N 8 115.500 114.035 1.465 1
1 51 . 5 1 1 A 9 9 MET H H 9 9.040 7.472 1.568 1
1 52 . 5 1 1 A 9 9 MET HA H 9 4.610 5.100 -0.490 1
1 60 . 5 1 1 A 9 9 MET CA C 9 54.400 53.672 0.728 1
1 61 . 5 1 1 A 9 9 MET CB C 9 35.400 33.984 1.416 1
1 64 . 5 1 1 A 9 9 MET N N 9 120.500 119.588 0.912 1
1 65 . 5 1 1 A 10 10 GLN H H 10 8.270 8.968 -0.698 1
1 66 . 5 1 1 A 10 10 GLN HA H 10 5.270 5.317 -0.047 1
1 71 . 5 1 1 A 10 10 GLN CA C 10 54.200 54.441 -0.241 1
1 72 . 5 1 1 A 10 10 GLN CB C 10 30.500 32.283 -1.783 1
1 74 . 5 1 1 A 10 10 GLN N N 10 121.000 122.124 -1.124 1
1 75 . 5 1 1 A 11 11 ILE H H 11 8.270 8.855 -0.585 1
1 76 . 5 1 1 A 11 11 ILE HA H 11 4.100 4.809 -0.709 1
1 86 . 5 1 1 A 11 11 ILE CA C 11 59.400 59.195 0.205 1
1 87 . 5 1 1 A 11 11 ILE CB C 11 41.800 40.806 0.994 1
1 91 . 5 1 1 A 11 11 ILE N N 11 114.600 121.429 -6.829 1
1 92 . 5 1 1 A 12 12 PHE H H 12 8.520 8.811 -0.291 1
1 93 . 5 1 1 A 12 12 PHE HA H 12 5.540 5.347 0.193 1
1 96 . 5 1 1 A 12 12 PHE CA C 12 55.000 56.937 -1.937 1
1 97 . 5 1 1 A 12 12 PHE CB C 12 41.200 41.038 0.162 1
1 98 . 5 1 1 A 12 12 PHE N N 12 118.600 123.804 -5.204 1
1 99 . 5 1 1 A 13 13 VAL H H 13 9.230 8.916 0.314 1
1 100 . 5 1 1 A 13 13 VAL HA H 13 4.740 5.145 -0.405 1
1 108 . 5 1 1 A 13 13 VAL CA C 13 60.300 60.500 -0.200 1
1 109 . 5 1 1 A 13 13 VAL CB C 13 34.100 35.201 -1.101 1
1 112 . 5 1 1 A 13 13 VAL N N 13 121.400 122.790 -1.390 1
1 113 . 5 1 1 A 14 14 LYS H H 14 8.910 8.699 0.211 1
1 114 . 5 1 1 A 14 14 LYS HA H 14 5.190 4.834 0.356 1
1 122 . 5 1 1 A 14 14 LYS CA C 14 54.600 54.946 -0.346 1
1 123 . 5 1 1 A 14 14 LYS CB C 14 34.300 35.007 -0.707 1
1 126 . 5 1 1 A 14 14 LYS N N 14 128.000 126.595 1.405 1
1 127 . 5 1 1 A 15 15 THR H H 15 8.650 8.997 -0.347 1
1 128 . 5 1 1 A 15 15 THR HA H 15 4.870 4.686 0.184 1
1 133 . 5 1 1 A 15 15 THR CA C 15 60.300 60.817 -0.517 1
1 134 . 5 1 1 A 15 15 THR CB C 15 70.600 71.281 -0.681 1
1 136 . 5 1 1 A 15 15 THR N N 15 115.300 117.169 -1.869 1
1 137 . 5 1 1 A 16 16 LEU H H 16 9.070 8.796 0.274 1
1 138 . 5 1 1 A 16 16 LEU HA H 16 4.210 4.026 0.184 1
1 148 . 5 1 1 A 16 16 LEU CA C 16 57.400 57.470 -0.070 1
1 149 . 5 1 1 A 16 16 LEU CB C 16 41.800 41.650 0.150 1
1 153 . 5 1 1 A 16 16 LEU N N 16 121.400 122.264 -0.864 1
1 154 . 5 1 1 A 17 17 THR H H 17 7.560 7.792 -0.232 1
1 155 . 5 1 1 A 17 17 THR HA H 17 4.330 4.276 0.054 1
1 160 . 5 1 1 A 17 17 THR CA C 17 61.400 63.748 -2.348 1
1 161 . 5 1 1 A 17 17 THR CB C 17 68.900 69.898 -0.998 1
1 163 . 5 1 1 A 17 17 THR N N 17 105.900 112.727 -6.827 1
1 164 . 5 1 1 A 18 18 GLY H H 18 7.750 7.851 -0.101 1
1 165 . 5 1 1 A 18 18 GLY HA2 H 18 4.250 4.000 0.250 1
1 166 . 5 1 1 A 18 18 GLY HA3 H 18 3.520 4.009 -0.489 1
1 167 . 5 1 1 A 18 18 GLY CA C 18 45.300 45.162 0.138 1
1 168 . 5 1 1 A 18 18 GLY N N 18 109.300 109.344 -0.044 1
1 169 . 5 1 1 A 19 19 LYS H H 19 7.210 7.657 -0.447 1
1 170 . 5 1 1 A 19 19 LYS HA H 19 4.260 4.241 0.019 1
1 175 . 5 1 1 A 19 19 LYS CA C 19 56.300 56.799 -0.499 1
1 176 . 5 1 1 A 19 19 LYS CB C 19 33.200 33.750 -0.550 1
1 179 . 5 1 1 A 19 19 LYS N N 19 122.000 120.596 1.404 1
1 180 . 5 1 1 A 20 20 THR H H 20 8.570 8.499 0.071 1
1 181 . 5 1 1 A 20 20 THR HA H 20 4.950 5.287 -0.337 1
1 186 . 5 1 1 A 20 20 THR CA C 20 62.200 61.968 0.232 1
1 187 . 5 1 1 A 20 20 THR CB C 20 69.700 70.446 -0.746 1
1 189 . 5 1 1 A 20 20 THR N N 20 120.700 116.726 3.974 1
1 190 . 5 1 1 A 21 21 ILE H H 21 9.510 8.996 0.514 1
1 191 . 5 1 1 A 21 21 ILE HA H 21 4.390 4.870 -0.480 1
1 201 . 5 1 1 A 21 21 ILE CA C 21 60.000 58.999 1.001 1
1 202 . 5 1 1 A 21 21 ILE CB C 21 40.700 41.357 -0.657 1
1 206 . 5 1 1 A 21 21 ILE N N 21 128.200 122.636 5.564 1
1 207 . 5 1 1 A 22 22 THR H H 22 8.700 8.770 -0.070 1
1 208 . 5 1 1 A 22 22 THR HA H 22 4.860 4.485 0.375 1
1 213 . 5 1 1 A 22 22 THR CA C 22 62.100 63.154 -1.054 1
1 214 . 5 1 1 A 22 22 THR CB C 22 69.500 69.074 0.426 1
1 216 . 5 1 1 A 22 22 THR N N 22 122.300 121.109 1.191 1
1 217 . 5 1 1 A 23 23 LEU H H 23 8.720 8.974 -0.254 1
1 218 . 5 1 1 A 23 23 LEU HA H 23 4.690 4.997 -0.307 1
1 228 . 5 1 1 A 23 23 LEU CA C 23 52.700 53.377 -0.677 1
1 229 . 5 1 1 A 23 23 LEU CB C 23 46.600 45.109 1.491 1
1 233 . 5 1 1 A 23 23 LEU N N 23 125.400 127.728 -2.328 1
1 234 . 5 1 1 A 24 24 GLU H H 24 8.080 8.847 -0.767 1
1 235 . 5 1 1 A 24 24 GLU HA H 24 4.800 5.075 -0.275 1
1 238 . 5 1 1 A 24 24 GLU CA C 24 55.400 55.303 0.097 1
1 239 . 5 1 1 A 24 24 GLU CB C 24 30.100 31.880 -1.780 1
1 241 . 5 1 1 A 24 24 GLU N N 24 121.800 121.862 -0.062 1
1 242 . 5 1 1 A 25 25 VAL H H 25 8.800 8.654 0.146 1
1 243 . 5 1 1 A 25 25 VAL HA H 25 4.640 4.912 -0.272 1
1 251 . 5 1 1 A 25 25 VAL CA C 25 58.600 60.045 -1.445 1
1 252 . 5 1 1 A 25 25 VAL CB C 25 36.300 35.775 0.525 1
1 255 . 5 1 1 A 25 25 VAL N N 25 116.700 125.519 -8.819 1
1 256 . 5 1 1 A 26 26 GLU H H 26 8.500 8.436 0.064 1
1 257 . 5 1 1 A 26 26 GLU HA H 26 4.900 4.559 0.341 1
1 260 . 5 1 1 A 26 26 GLU CA C 26 53.000 54.348 -1.348 1
1 261 . 5 1 1 A 26 26 GLU CB C 26 31.200 34.104 -2.904 1
1 262 . 5 1 1 A 26 26 GLU N N 26 117.900 124.955 -7.055 1
1 263 . 5 1 1 A 27 27 PRO HA H 27 4.040 4.382 -0.342 1
1 270 . 5 1 1 A 27 27 PRO CA C 27 65.400 64.835 0.565 1
1 271 . 5 1 1 A 27 27 PRO CB C 27 31.700 32.029 -0.329 1
1 274 . 5 1 1 A 28 28 SER H H 28 7.010 8.258 -1.248 1
1 275 . 5 1 1 A 28 28 SER HA H 28 4.280 4.519 -0.239 1
1 278 . 5 1 1 A 28 28 SER CA C 28 57.400 59.039 -1.639 1
1 279 . 5 1 1 A 28 28 SER CB C 28 63.400 63.941 -0.541 1
1 280 . 5 1 1 A 28 28 SER N N 28 103.800 112.726 -8.926 1
1 281 . 5 1 1 A 29 29 ASP H H 29 7.960 7.651 0.309 1
1 282 . 5 1 1 A 29 29 ASP HA H 29 4.600 5.159 -0.559 1
1 285 . 5 1 1 A 29 29 ASP CA C 29 55.900 53.343 2.557 1
1 286 . 5 1 1 A 29 29 ASP CB C 29 41.000 43.640 -2.640 1
1 287 . 5 1 1 A 29 29 ASP N N 29 123.700 121.485 2.215 1
1 288 . 5 1 1 A 30 30 THR H H 30 7.780 8.709 -0.929 1
1 289 . 5 1 1 A 30 30 THR HA H 30 4.850 4.630 0.220 1
1 294 . 5 1 1 A 30 30 THR CA C 30 59.400 60.277 -0.877 1
1 295 . 5 1 1 A 30 30 THR CB C 30 71.100 71.005 0.095 1
1 297 . 5 1 1 A 30 30 THR N N 30 108.800 119.662 -10.862 1
1 298 . 5 1 1 A 31 31 ILE H H 31 8.320 9.046 -0.726 1
1 299 . 5 1 1 A 31 31 ILE HA H 31 3.580 3.749 -0.169 1
1 309 . 5 1 1 A 31 31 ILE CA C 31 62.200 64.703 -2.503 1
1 310 . 5 1 1 A 31 31 ILE CB C 31 34.300 37.584 -3.284 1
1 314 . 5 1 1 A 31 31 ILE N N 31 121.300 127.099 -5.799 1
1 315 . 5 1 1 A 32 32 GLU H H 32 9.850 8.369 1.481 1
1 316 . 5 1 1 A 32 32 GLU HA H 32 3.780 3.938 -0.158 1
1 321 . 5 1 1 A 32 32 GLU CA C 32 60.500 59.976 0.524 1
1 322 . 5 1 1 A 32 32 GLU CB C 32 28.800 29.346 -0.546 1
1 324 . 5 1 1 A 32 32 GLU N N 32 121.600 122.309 -0.709 1
1 325 . 5 1 1 A 33 33 ASN H H 33 7.810 7.720 0.090 1
1 326 . 5 1 1 A 33 33 ASN HA H 33 4.440 4.479 -0.039 1
1 329 . 5 1 1 A 33 33 ASN CA C 33 55.800 56.324 -0.524 1
1 330 . 5 1 1 A 33 33 ASN CB C 33 38.100 38.199 -0.099 1
1 331 . 5 1 1 A 33 33 ASN N N 33 121.000 118.872 2.128 1
1 332 . 5 1 1 A 34 34 VAL H H 34 8.000 7.967 0.033 1
1 333 . 5 1 1 A 34 34 VAL HA H 34 3.300 3.642 -0.342 1
1 341 . 5 1 1 A 34 34 VAL CA C 34 67.600 66.534 1.066 1
1 342 . 5 1 1 A 34 34 VAL CB C 34 30.700 31.669 -0.969 1
1 345 . 5 1 1 A 34 34 VAL N N 34 122.200 120.392 1.808 1
1 346 . 5 1 1 A 35 35 LYS H H 35 8.490 8.347 0.143 1
1 347 . 5 1 1 A 35 35 LYS HA H 35 4.500 4.079 0.421 1
1 352 . 5 1 1 A 35 35 LYS CA C 35 59.300 58.636 0.664 1
1 353 . 5 1 1 A 35 35 LYS CB C 35 33.500 31.940 1.560 1
1 354 . 5 1 1 A 35 35 LYS N N 35 119.200 120.270 -1.070 1
1 355 . 5 1 1 A 36 36 ALA H H 36 7.880 8.609 -0.729 1
1 356 . 5 1 1 A 36 36 ALA HA H 36 4.060 4.094 -0.034 1
1 360 . 5 1 1 A 36 36 ALA CA C 36 55.300 54.798 0.502 1
1 361 . 5 1 1 A 36 36 ALA CB C 36 17.600 18.174 -0.574 1
1 362 . 5 1 1 A 36 36 ALA N N 36 123.300 122.028 1.272 1
1 363 . 5 1 1 A 37 37 LYS H H 37 7.790 7.999 -0.209 1
1 364 . 5 1 1 A 37 37 LYS HA H 37 4.110 4.113 -0.003 1
1 373 . 5 1 1 A 37 37 LYS CA C 37 59.700 59.450 0.250 1
1 374 . 5 1 1 A 37 37 LYS CB C 37 33.100 32.392 0.708 1
1 378 . 5 1 1 A 37 37 LYS N N 37 120.400 117.045 3.355 1
1 379 . 5 1 1 A 38 38 ILE H H 38 8.240 7.683 0.557 1
1 380 . 5 1 1 A 38 38 ILE HA H 38 3.410 3.989 -0.579 1
1 390 . 5 1 1 A 38 38 ILE CA C 38 66.200 62.305 3.895 1
1 391 . 5 1 1 A 38 38 ILE CB C 38 36.800 37.620 -0.820 1
1 395 . 5 1 1 A 38 38 ILE N N 38 121.400 119.964 1.436 1
1 396 . 5 1 1 A 39 39 GLN H H 39 8.460 8.680 -0.220 1
1 397 . 5 1 1 A 39 39 GLN HA H 39 3.730 3.896 -0.166 1
1 402 . 5 1 1 A 39 39 GLN CA C 39 60.000 59.324 0.676 1
1 403 . 5 1 1 A 39 39 GLN CB C 39 27.600 28.334 -0.734 1
1 405 . 5 1 1 A 39 39 GLN N N 39 123.500 120.946 2.554 1
1 406 . 5 1 1 A 40 40 ASP H H 40 7.970 8.039 -0.069 1
1 407 . 5 1 1 A 40 40 ASP HA H 40 4.240 4.371 -0.131 1
1 410 . 5 1 1 A 40 40 ASP CA C 40 57.400 56.697 0.703 1
1 411 . 5 1 1 A 40 40 ASP CB C 40 41.000 40.700 0.300 1
1 412 . 5 1 1 A 40 40 ASP N N 40 119.900 119.272 0.628 1
1 413 . 5 1 1 A 41 41 LYS H H 41 7.420 7.911 -0.491 1
1 414 . 5 1 1 A 41 41 LYS HA H 41 4.200 4.161 0.039 1
1 423 . 5 1 1 A 41 41 LYS CA C 41 58.200 59.333 -1.133 1
1 424 . 5 1 1 A 41 41 LYS CB C 41 33.900 32.723 1.177 1
1 427 . 5 1 1 A 41 41 LYS N N 41 115.700 119.059 -3.359 1
1 428 . 5 1 1 A 42 42 GLU H H 42 8.650 8.071 0.579 1
1 429 . 5 1 1 A 42 42 GLU HA H 42 4.470 4.519 -0.049 1
1 434 . 5 1 1 A 42 42 GLU CA C 42 55.300 56.005 -0.705 1
1 435 . 5 1 1 A 42 42 GLU CB C 42 33.200 32.028 1.172 1
1 437 . 5 1 1 A 42 42 GLU N N 42 114.200 115.318 -1.118 1
1 438 . 5 1 1 A 43 43 GLY H H 43 8.400 7.978 0.422 1
1 439 . 5 1 1 A 43 43 GLY HA2 H 43 4.040 3.951 0.089 1
1 440 . 5 1 1 A 43 43 GLY HA3 H 43 3.820 3.952 -0.132 1
1 441 . 5 1 1 A 43 43 GLY CA C 43 45.900 45.769 0.131 1
1 442 . 5 1 1 A 43 43 GLY N N 43 109.000 108.909 0.091 1
1 443 . 5 1 1 A 44 44 ILE H H 44 6.080 8.004 -1.924 1
1 444 . 5 1 1 A 44 44 ILE HA H 44 4.290 4.315 -0.025 1
1 446 . 5 1 1 A 44 44 ILE CA C 44 57.700 57.975 -0.275 1
1 447 . 5 1 1 A 44 44 ILE CB C 44 40.400 38.677 1.723 1
1 448 . 5 1 1 A 44 44 ILE N N 44 120.500 122.058 -1.558 1
1 449 . 5 1 1 A 46 46 PRO HA H 46 4.030 4.289 -0.259 1
1 454 . 5 1 1 A 46 46 PRO CA C 46 66.100 65.165 0.935 1
1 455 . 5 1 1 A 46 46 PRO CB C 46 32.600 32.108 0.492 1
1 458 . 5 1 1 A 47 47 ASP H H 47 8.470 8.613 -0.143 1
1 459 . 5 1 1 A 47 47 ASP HA H 47 4.310 4.462 -0.152 1
1 462 . 5 1 1 A 47 47 ASP CA C 47 55.700 55.647 0.053 1
1 463 . 5 1 1 A 47 47 ASP CB C 47 39.700 40.748 -1.048 1
1 464 . 5 1 1 A 47 47 ASP N N 47 113.700 116.677 -2.977 1
1 465 . 5 1 1 A 48 48 GLN H H 48 7.720 7.737 -0.017 1
1 466 . 5 1 1 A 48 48 GLN HA H 48 4.340 4.445 -0.105 1
1 471 . 5 1 1 A 48 48 GLN CA C 48 55.500 55.350 0.150 1
1 472 . 5 1 1 A 48 48 GLN CB C 48 29.900 29.335 0.565 1
1 474 . 5 1 1 A 48 48 GLN N N 48 116.900 117.524 -0.624 1
1 475 . 5 1 1 A 49 49 GLN H H 49 7.410 7.731 -0.321 1
1 476 . 5 1 1 A 49 49 GLN HA H 49 4.110 4.897 -0.787 1
1 481 . 5 1 1 A 49 49 GLN CA C 49 56.600 53.978 2.622 1
1 482 . 5 1 1 A 49 49 GLN CB C 49 31.300 31.934 -0.634 1
1 484 . 5 1 1 A 49 49 GLN N N 49 118.000 117.132 0.868 1
1 485 . 5 1 1 A 50 50 ARG H H 50 8.400 8.543 -0.143 1
1 486 . 5 1 1 A 50 50 ARG HA H 50 4.380 4.679 -0.299 1
1 491 . 5 1 1 A 50 50 ARG CA C 50 55.100 55.282 -0.182 1
1 492 . 5 1 1 A 50 50 ARG CB C 50 31.600 31.929 -0.329 1
1 494 . 5 1 1 A 50 50 ARG N N 50 123.100 123.277 -0.177 1
1 495 . 5 1 1 A 51 51 LEU H H 51 8.710 8.607 0.103 1
1 496 . 5 1 1 A 51 51 LEU HA H 51 5.300 5.198 0.102 1
1 506 . 5 1 1 A 51 51 LEU CA C 51 52.900 53.449 -0.549 1
1 507 . 5 1 1 A 51 51 LEU CB C 51 45.700 46.049 -0.349 1
1 511 . 5 1 1 A 51 51 LEU N N 51 124.400 121.500 2.900 1
1 512 . 5 1 1 A 52 52 ILE H H 52 9.060 9.067 -0.007 1
1 513 . 5 1 1 A 52 52 ILE HA H 52 4.840 5.028 -0.188 1
1 523 . 5 1 1 A 52 52 ILE CA C 52 58.900 60.208 -1.308 1
1 524 . 5 1 1 A 52 52 ILE CB C 52 41.200 41.111 0.089 1
1 528 . 5 1 1 A 52 52 ILE N N 52 122.500 125.514 -3.014 1
1 529 . 5 1 1 A 53 53 PHE H H 53 8.730 9.458 -0.728 1
1 530 . 5 1 1 A 53 53 PHE HA H 53 5.100 4.819 0.281 1
1 535 . 5 1 1 A 53 53 PHE CA C 53 56.300 57.527 -1.227 1
1 536 . 5 1 1 A 53 53 PHE CB C 53 43.500 42.022 1.478 1
1 537 . 5 1 1 A 53 53 PHE N N 53 124.800 127.746 -2.946 1
1 538 . 5 1 1 A 54 54 ALA H H 54 8.940 9.167 -0.227 1
1 539 . 5 1 1 A 54 54 ALA HA H 54 3.610 3.956 -0.346 1
1 543 . 5 1 1 A 54 54 ALA CA C 54 52.500 53.070 -0.570 1
1 544 . 5 1 1 A 54 54 ALA CB C 54 16.300 17.405 -1.105 1
1 545 . 5 1 1 A 54 54 ALA N N 54 133.100 130.362 2.738 1
1 546 . 5 1 1 A 55 55 GLY H H 55 8.070 8.506 -0.436 1
1 547 . 5 1 1 A 55 55 GLY HA2 H 55 4.000 3.819 0.181 1
1 548 . 5 1 1 A 55 55 GLY HA3 H 55 3.340 3.860 -0.520 1
1 549 . 5 1 1 A 55 55 GLY CA C 55 45.200 45.267 -0.067 1
1 550 . 5 1 1 A 55 55 GLY N N 55 102.500 102.629 -0.129 1
1 551 . 5 1 1 A 56 56 LYS H H 56 7.860 8.053 -0.193 1
1 552 . 5 1 1 A 56 56 LYS HA H 56 4.510 4.579 -0.069 1
1 558 . 5 1 1 A 56 56 LYS CA C 56 54.500 54.689 -0.189 1
1 559 . 5 1 1 A 56 56 LYS CB C 56 34.400 33.890 0.510 1
1 561 . 5 1 1 A 56 56 LYS N N 56 121.800 121.853 -0.053 1
1 562 . 5 1 1 A 57 57 GLN H H 57 8.600 8.392 0.208 1
1 563 . 5 1 1 A 57 57 GLN HA H 57 4.410 4.773 -0.363 1
1 568 . 5 1 1 A 57 57 GLN CA C 57 55.900 55.439 0.461 1
1 569 . 5 1 1 A 57 57 GLN CB C 57 28.800 29.701 -0.901 1
1 571 . 5 1 1 A 57 57 GLN N N 57 123.200 123.956 -0.756 1
1 572 . 5 1 1 A 58 58 LEU H H 58 8.480 8.678 -0.198 1
1 573 . 5 1 1 A 58 58 LEU HA H 58 4.060 4.955 -0.895 1
1 583 . 5 1 1 A 58 58 LEU CA C 58 54.100 53.125 0.975 1
1 584 . 5 1 1 A 58 58 LEU CB C 58 41.500 45.227 -3.727 1
1 588 . 5 1 1 A 58 58 LEU N N 58 125.900 121.648 4.252 1
1 589 . 5 1 1 A 59 59 GLU H H 59 8.400 8.653 -0.253 1
1 590 . 5 1 1 A 59 59 GLU HA H 59 4.400 4.516 -0.116 1
1 595 . 5 1 1 A 59 59 GLU CA C 59 55.900 57.931 -2.031 1
1 596 . 5 1 1 A 59 59 GLU CB C 59 31.900 32.013 -0.113 1
1 598 . 5 1 1 A 59 59 GLU N N 59 123.100 119.868 3.232 1
1 599 . 5 1 1 A 60 60 ASP H H 60 8.110 7.853 0.257 1
1 600 . 5 1 1 A 60 60 ASP HA H 60 4.270 4.507 -0.237 1
1 603 . 5 1 1 A 60 60 ASP CA C 60 57.100 55.561 1.539 1
1 604 . 5 1 1 A 60 60 ASP CB C 60 40.800 41.584 -0.784 1
1 605 . 5 1 1 A 60 60 ASP N N 60 120.300 119.728 0.572 1
1 606 . 5 1 1 A 61 61 GLY HA2 H 61 4.000 4.125 -0.125 1
1 607 . 5 1 1 A 61 61 GLY HA3 H 61 3.830 4.142 -0.312 1
1 608 . 5 1 1 A 61 61 GLY CA C 61 45.000 46.005 -1.005 1
1 609 . 5 1 1 A 62 62 ARG H H 62 7.350 8.679 -1.329 1
1 610 . 5 1 1 A 62 62 ARG HA H 62 4.640 4.964 -0.324 1
1 615 . 5 1 1 A 62 62 ARG CA C 62 54.400 53.868 0.532 1
1 616 . 5 1 1 A 62 62 ARG CB C 62 32.600 34.424 -1.824 1
1 618 . 5 1 1 A 62 62 ARG N N 62 119.300 124.548 -5.248 1
1 619 . 5 1 1 A 63 63 THR H H 63 8.460 8.796 -0.336 1
1 620 . 5 1 1 A 63 63 THR HA H 63 5.060 4.601 0.459 1
1 625 . 5 1 1 A 63 63 THR CA C 63 59.700 60.866 -1.166 1
1 626 . 5 1 1 A 63 63 THR CB C 63 72.000 70.869 1.131 1
1 628 . 5 1 1 A 63 63 THR N N 63 109.100 112.898 -3.798 1
1 629 . 5 1 1 A 64 64 LEU H H 64 8.190 8.725 -0.535 1
1 630 . 5 1 1 A 64 64 LEU HA H 64 3.920 3.964 -0.044 1
1 640 . 5 1 1 A 64 64 LEU CA C 64 58.400 58.316 0.084 1
1 641 . 5 1 1 A 64 64 LEU CB C 64 40.200 41.078 -0.878 1
1 645 . 5 1 1 A 64 64 LEU N N 64 118.100 123.172 -5.072 1
1 646 . 5 1 1 A 65 65 SER H H 65 8.370 8.083 0.287 1
1 647 . 5 1 1 A 65 65 SER HA H 65 4.150 4.177 -0.027 1
1 650 . 5 1 1 A 65 65 SER CA C 65 60.900 60.354 0.546 1
1 651 . 5 1 1 A 65 65 SER CB C 65 62.500 63.429 -0.929 1
1 652 . 5 1 1 A 65 65 SER N N 65 112.200 114.460 -2.260 1
1 653 . 5 1 1 A 66 66 GLU H H 66 7.780 7.833 -0.053 1
1 654 . 5 1 1 A 66 66 GLU HA H 66 3.890 4.125 -0.235 1
1 659 . 5 1 1 A 66 66 GLU CA C 66 59.200 58.885 0.315 1
1 660 . 5 1 1 A 66 66 GLU CB C 66 29.400 29.450 -0.050 1
1 662 . 5 1 1 A 66 66 GLU N N 66 123.600 121.835 1.765 1
1 663 . 5 1 1 A 67 67 TYR H H 67 7.290 7.708 -0.418 1
1 664 . 5 1 1 A 67 67 TYR HA H 67 4.590 4.557 0.033 1
1 669 . 5 1 1 A 67 67 TYR CA C 67 58.400 58.723 -0.323 1
1 670 . 5 1 1 A 67 67 TYR CB C 67 39.800 38.557 1.243 1
1 671 . 5 1 1 A 67 67 TYR N N 67 116.400 119.613 -3.213 1
1 672 . 5 1 1 A 68 68 ASN H H 68 8.040 7.880 0.160 1
1 673 . 5 1 1 A 68 68 ASN HA H 68 4.240 4.254 -0.014 1
1 676 . 5 1 1 A 68 68 ASN CA C 68 54.100 54.302 -0.202 1
1 677 . 5 1 1 A 68 68 ASN CB C 68 37.200 36.700 0.500 1
1 678 . 5 1 1 A 68 68 ASN N N 68 115.600 115.819 -0.219 1
1 679 . 5 1 1 A 69 69 ILE H H 69 7.200 7.457 -0.257 1
1 680 . 5 1 1 A 69 69 ILE HA H 69 3.280 4.876 -1.596 1
1 690 . 5 1 1 A 69 69 ILE CA C 69 59.800 58.632 1.168 1
1 691 . 5 1 1 A 69 69 ILE CB C 69 36.600 40.725 -4.125 1
1 695 . 5 1 1 A 69 69 ILE N N 69 119.100 113.775 5.325 1
1 696 . 5 1 1 A 70 70 GLN H H 70 7.570 8.670 -1.100 1
1 697 . 5 1 1 A 70 70 GLN HA H 70 4.410 4.495 -0.085 1
1 702 . 5 1 1 A 70 70 GLN CA C 70 53.500 55.120 -1.620 1
1 703 . 5 1 1 A 70 70 GLN CB C 70 31.500 27.065 4.435 1
1 705 . 5 1 1 A 70 70 GLN N N 70 124.800 121.313 3.487 1
1 706 . 5 1 1 A 71 71 LYS H H 71 8.370 7.906 0.464 1
1 707 . 5 1 1 A 71 71 LYS HA H 71 3.870 3.928 -0.058 1
1 716 . 5 1 1 A 71 71 LYS CA C 71 58.000 56.158 1.842 1
1 717 . 5 1 1 A 71 71 LYS CB C 71 32.500 32.198 0.302 1
1 720 . 5 1 1 A 71 71 LYS N N 71 120.200 121.359 -1.159 1
1 721 . 5 1 1 A 72 72 GLU H H 72 9.230 8.144 1.086 1
1 722 . 5 1 1 A 72 72 GLU HA H 72 3.240 4.365 -1.125 1
1 727 . 5 1 1 A 72 72 GLU CA C 72 58.300 55.953 2.347 1
1 728 . 5 1 1 A 72 72 GLU CB C 72 26.000 29.150 -3.150 1
1 730 . 5 1 1 A 72 72 GLU N N 72 115.100 118.799 -3.699 1
1 731 . 5 1 1 A 73 73 SER H H 73 7.690 8.291 -0.601 1
1 732 . 5 1 1 A 73 73 SER HA H 73 4.520 4.791 -0.271 1
1 735 . 5 1 1 A 73 73 SER CA C 73 61.100 59.438 1.662 1
1 736 . 5 1 1 A 73 73 SER CB C 73 64.800 64.682 0.118 1
1 737 . 5 1 1 A 73 73 SER N N 73 115.300 113.593 1.707 1
1 738 . 5 1 1 A 74 74 THR H H 74 8.620 7.922 0.698 1
1 739 . 5 1 1 A 74 74 THR HA H 74 5.200 4.995 0.205 1
1 744 . 5 1 1 A 74 74 THR CA C 74 62.400 61.716 0.684 1
1 745 . 5 1 1 A 74 74 THR CB C 74 70.200 70.674 -0.474 1
1 747 . 5 1 1 A 74 74 THR N N 74 117.500 112.966 4.534 1
1 748 . 5 1 1 A 75 75 LEU H H 75 9.350 9.020 0.330 1
1 749 . 5 1 1 A 75 75 LEU HA H 75 4.990 4.881 0.109 1
1 759 . 5 1 1 A 75 75 LEU CA C 75 53.800 53.675 0.125 1
1 760 . 5 1 1 A 75 75 LEU CB C 75 44.400 45.693 -1.293 1
1 764 . 5 1 1 A 75 75 LEU N N 75 128.000 126.484 1.516 1
1 765 . 5 1 1 A 76 76 HIS H H 76 9.140 8.429 0.711 1
1 766 . 5 1 1 A 76 76 HIS HA H 76 5.040 5.098 -0.058 1
1 769 . 5 1 1 A 76 76 HIS CA C 76 56.200 54.534 1.666 1
1 770 . 5 1 1 A 76 76 HIS CB C 76 32.500 31.963 0.537 1
1 771 . 5 1 1 A 76 76 HIS N N 76 119.600 121.260 -1.660 1
1 772 . 5 1 1 A 77 77 LEU H H 77 8.240 8.934 -0.694 1
1 773 . 5 1 1 A 77 77 LEU HA H 77 5.080 5.153 -0.073 1
1 783 . 5 1 1 A 77 77 LEU CA C 77 53.600 53.757 -0.157 1
1 784 . 5 1 1 A 77 77 LEU CB C 77 44.100 43.370 0.730 1
1 788 . 5 1 1 A 77 77 LEU N N 77 123.800 122.365 1.435 1
1 789 . 5 1 1 A 78 78 VAL H H 78 9.110 8.642 0.468 1
1 790 . 5 1 1 A 78 78 VAL HA H 78 4.260 4.740 -0.480 1
1 798 . 5 1 1 A 78 78 VAL CA C 78 60.400 60.086 0.314 1
1 799 . 5 1 1 A 78 78 VAL CB C 78 34.700 35.481 -0.781 1
1 802 . 5 1 1 A 78 78 VAL N N 78 127.100 124.236 2.864 1
1 803 . 5 1 1 A 79 79 LEU H H 79 8.050 8.919 -0.869 1
1 804 . 5 1 1 A 79 79 LEU HA H 79 4.950 4.929 0.021 1
1 813 . 5 1 1 A 79 79 LEU CA C 79 53.800 53.174 0.626 1
1 814 . 5 1 1 A 79 79 LEU CB C 79 42.700 44.354 -1.654 1
1 818 . 5 1 1 A 79 79 LEU N N 79 123.400 130.219 -6.819 1
1 819 . 5 1 1 A 80 80 ARG H H 80 8.540 9.065 -0.525 1
1 820 . 5 1 1 A 80 80 ARG HA H 80 4.170 3.927 0.243 1
1 827 . 5 1 1 A 80 80 ARG CA C 80 55.800 56.920 -1.120 1
1 828 . 5 1 1 A 80 80 ARG CB C 80 31.100 28.785 2.315 1
1 830 . 5 1 1 A 80 80 ARG N N 80 123.500 126.412 -2.912 1
1 831 . 5 1 1 A 81 81 LEU H H 81 8.250 7.751 0.499 1
1 832 . 5 1 1 A 81 81 LEU HA H 81 4.270 4.271 -0.001 1
1 842 . 5 1 1 A 81 81 LEU CA C 81 55.000 54.852 0.148 1
1 843 . 5 1 1 A 81 81 LEU CB C 81 42.200 43.303 -1.103 1
1 847 . 5 1 1 A 81 81 LEU N N 81 124.100 119.937 4.163 1
1 848 . 5 1 1 A 82 82 ARG H H 82 8.310 8.547 -0.237 1
1 849 . 5 1 1 A 82 82 ARG HA H 82 4.200 4.448 -0.248 1
1 852 . 5 1 1 A 82 82 ARG CA C 82 56.300 55.653 0.647 1
1 853 . 5 1 1 A 82 82 ARG CB C 82 30.700 32.928 -2.228 1
1 855 . 5 1 1 A 82 82 ARG N N 82 121.500 119.431 2.069 1
1 856 . 5 1 1 A 83 83 GLY H H 83 8.410 8.384 0.026 1
1 857 . 5 1 1 A 83 83 GLY HA2 H 83 3.750 3.928 -0.178 1
1 858 . 5 1 1 A 83 83 GLY HA3 H 83 3.754 4.015 -0.261 1
1 859 . 5 1 1 A 83 83 GLY CA C 83 45.100 44.851 0.249 1
1 860 . 5 1 1 A 83 83 GLY N N 83 110.200 110.064 0.136 1
1 861 . 5 1 1 A 84 84 TYR H H 84 7.950 8.541 -0.591 1
1 862 . 5 1 1 A 84 84 TYR HA H 84 4.400 4.780 -0.380 1
1 865 . 5 1 1 A 84 84 TYR CA C 84 58.100 57.993 0.107 1
1 866 . 5 1 1 A 84 84 TYR CB C 84 38.800 39.523 -0.723 1
1 867 . 5 1 1 A 84 84 TYR N N 84 119.900 120.294 -0.394 1
1 868 . 5 1 1 A 85 85 ALA H H 85 8.150 8.530 -0.380 1
1 869 . 5 1 1 A 85 85 ALA HA H 85 4.150 4.445 -0.295 1
1 873 . 5 1 1 A 85 85 ALA CA C 85 52.600 52.188 0.412 1
1 874 . 5 1 1 A 85 85 ALA CB C 85 19.200 19.867 -0.667 1
1 875 . 5 1 1 A 85 85 ALA N N 85 124.800 124.160 0.640 1
1 876 . 5 1 1 A 86 86 ASP H H 86 8.020 8.738 -0.718 1
1 877 . 5 1 1 A 86 86 ASP HA H 86 4.450 5.185 -0.735 1
1 880 . 5 1 1 A 86 86 ASP CA C 86 54.100 52.979 1.121 1
1 881 . 5 1 1 A 86 86 ASP CB C 86 41.100 44.205 -3.105 1
1 882 . 5 1 1 A 86 86 ASP N N 86 118.900 117.772 1.128 1
1 883 . 5 1 1 A 87 87 LEU H H 87 8.010 8.548 -0.538 1
1 884 . 5 1 1 A 87 87 LEU HA H 87 4.210 4.476 -0.266 1
1 893 . 5 1 1 A 87 87 LEU CA C 87 55.300 55.420 -0.120 1
1 894 . 5 1 1 A 87 87 LEU CB C 87 42.000 43.163 -1.163 1
1 898 . 5 1 1 A 87 87 LEU N N 87 122.400 121.623 0.777 1
1 899 . 5 1 1 A 88 88 ARG H H 88 8.170 7.629 0.541 1
1 900 . 5 1 1 A 88 88 ARG HA H 88 4.210 4.996 -0.786 1
1 903 . 5 1 1 A 88 88 ARG CA C 88 56.300 54.654 1.646 1
1 904 . 5 1 1 A 88 88 ARG CB C 88 30.600 32.630 -2.030 1
1 905 . 5 1 1 A 88 88 ARG N N 88 121.200 120.557 0.643 1
1 906 . 5 1 1 A 91 91 PRO HA H 91 4.290 4.571 -0.281 1
1 911 . 5 1 1 A 91 91 PRO CA C 91 63.800 64.043 -0.243 1
1 912 . 5 1 1 A 91 91 PRO CB C 91 32.100 32.098 0.002 1
1 915 . 5 1 1 A 92 92 ASP H H 92 8.280 7.480 0.800 1
1 916 . 5 1 1 A 92 92 ASP HA H 92 4.540 5.025 -0.485 1
1 919 . 5 1 1 A 92 92 ASP CA C 92 54.600 53.193 1.407 1
1 920 . 5 1 1 A 92 92 ASP CB C 92 41.000 43.886 -2.886 1
1 921 . 5 1 1 A 92 92 ASP N N 92 118.700 112.827 5.873 1
1 922 . 5 1 1 A 93 93 ARG H H 93 7.780 8.759 -0.979 1
1 923 . 5 1 1 A 93 93 ARG HA H 93 4.190 4.953 -0.763 1
1 930 . 5 1 1 A 93 93 ARG CA C 93 56.300 54.417 1.883 1
1 931 . 5 1 1 A 93 93 ARG CB C 93 30.700 32.575 -1.875 1
1 934 . 5 1 1 A 93 93 ARG N N 93 120.700 120.073 0.627 1
1 935 . 5 1 1 A 94 94 GLN H H 94 8.280 8.394 -0.114 1
1 936 . 5 1 1 A 94 94 GLN HA H 94 4.210 4.442 -0.232 1
1 941 . 5 1 1 A 94 94 GLN CA C 94 55.800 56.718 -0.918 1
1 942 . 5 1 1 A 94 94 GLN CB C 94 29.300 29.452 -0.152 1
1 944 . 5 1 1 A 94 94 GLN N N 94 121.000 119.550 1.450 1
1 945 . 5 1 1 A 95 95 ASP H H 95 8.270 8.563 -0.293 1
1 946 . 5 1 1 A 95 95 ASP HA H 95 4.450 4.954 -0.504 1
1 949 . 5 1 1 A 95 95 ASP CA C 95 54.300 54.249 0.051 1
1 950 . 5 1 1 A 95 95 ASP CB C 95 41.000 42.057 -1.057 1
1 951 . 5 1 1 A 95 95 ASP N N 95 121.000 122.732 -1.732 1
1 952 . 5 1 1 A 96 96 HIS H H 96 8.090 8.457 -0.367 1
1 953 . 5 1 1 A 96 96 HIS HA H 96 4.470 5.301 -0.831 1
1 956 . 5 1 1 A 96 96 HIS CA C 96 55.900 54.343 1.557 1
1 957 . 5 1 1 A 96 96 HIS CB C 96 30.500 32.842 -2.342 1
1 958 . 5 1 1 A 96 96 HIS N N 96 119.300 120.539 -1.239 1
1 959 . 5 1 1 A 97 97 HIS H H 97 8.240 8.908 -0.668 1
1 960 . 5 1 1 A 97 97 HIS HA H 97 4.470 4.962 -0.492 1
1 963 . 5 1 1 A 97 97 HIS CA C 97 56.200 54.496 1.704 1
1 964 . 5 1 1 A 97 97 HIS CB C 97 30.400 30.125 0.275 1
1 965 . 5 1 1 A 97 97 HIS N N 97 121.300 119.819 1.481 1
1 966 . 5 1 1 A 98 98 PRO HA H 98 4.340 4.485 -0.145 1
1 973 . 5 1 1 A 98 98 PRO CA C 98 63.700 62.229 1.471 1
1 974 . 5 1 1 A 98 98 PRO CB C 98 31.900 33.122 -1.222 1
1 977 . 5 1 1 A 99 99 GLY H H 99 8.660 8.263 0.397 1
1 978 . 5 1 1 A 99 99 GLY HA2 H 99 3.920 4.059 -0.139 1
1 979 . 5 1 1 A 99 99 GLY HA3 H 99 3.920 4.082 -0.162 1
1 980 . 5 1 1 A 99 99 GLY CA C 99 45.200 43.800 1.400 1
1 981 . 5 1 1 A 99 99 GLY N N 99 110.000 107.401 2.599 1
1 982 . 5 1 1 A 100 100 SER H H 100 8.170 8.560 -0.390 1
1 983 . 5 1 1 A 100 100 SER HA H 100 4.360 4.725 -0.365 1
1 986 . 5 1 1 A 100 100 SER CA C 100 58.500 56.985 1.515 1
1 987 . 5 1 1 A 100 100 SER CB C 100 64.000 64.184 -0.184 1
1 988 . 5 1 1 A 100 100 SER N N 100 115.600 115.594 0.006 1
1 989 . 5 1 1 A 101 101 GLY H H 101 8.420 8.879 -0.459 1
1 990 . 5 1 1 A 101 101 GLY HA2 H 101 3.890 3.804 0.086 1
1 991 . 5 1 1 A 101 101 GLY HA3 H 101 3.920 3.806 0.114 1
1 992 . 5 1 1 A 101 101 GLY CA C 101 45.200 46.531 -1.331 1
1 993 . 5 1 1 A 101 101 GLY N N 101 111.000 115.878 -4.878 1
1 994 . 5 1 1 A 102 102 ALA H H 102 8.030 8.535 -0.505 1
1 995 . 5 1 1 A 102 102 ALA HA H 102 4.250 4.542 -0.292 1
1 999 . 5 1 1 A 102 102 ALA CA C 102 52.500 53.090 -0.590 1
1 1000 . 5 1 1 A 102 102 ALA CB C 102 19.200 20.588 -1.388 1
1 4 . 6 1 1 A 2 2 SER H H 2 8.160 7.909 0.251 1
1 5 . 6 1 1 A 2 2 SER HA H 2 4.370 4.708 -0.338 1
1 9 . 6 1 1 A 2 2 SER CA C 2 58.300 57.190 1.110 1
1 10 . 6 1 1 A 2 2 SER CB C 2 63.900 65.357 -1.457 1
1 11 . 6 1 1 A 2 2 SER N N 2 115.600 117.024 -1.424 1
1 12 . 6 1 1 A 3 3 LEU H H 3 8.250 8.853 -0.603 1
1 13 . 6 1 1 A 3 3 LEU HA H 3 4.280 5.167 -0.887 1
1 17 . 6 1 1 A 3 3 LEU CA C 3 55.200 53.037 2.163 1
1 18 . 6 1 1 A 3 3 LEU CB C 3 42.100 44.937 -2.837 1
1 19 . 6 1 1 A 3 3 LEU N N 3 124.100 121.294 2.806 1
1 20 . 6 1 1 A 4 4 VAL H H 4 7.950 9.066 -1.116 1
1 21 . 6 1 1 A 4 4 VAL HA H 4 4.680 4.343 0.337 1
1 26 . 6 1 1 A 4 4 VAL CA C 4 59.800 58.701 1.099 1
1 27 . 6 1 1 A 4 4 VAL CB C 4 32.500 34.667 -2.167 1
1 28 . 6 1 1 A 4 4 VAL N N 4 122.600 122.668 -0.068 1
1 29 . 6 1 1 A 5 5 PRO CA C 5 63.100 62.673 0.427 1
1 30 . 6 1 1 A 5 5 PRO CB C 5 32.000 33.292 -1.292 1
1 32 . 6 1 1 A 6 6 ARG H H 6 8.360 8.413 -0.053 1
1 33 . 6 1 1 A 6 6 ARG HA H 6 4.250 4.875 -0.625 1
1 36 . 6 1 1 A 6 6 ARG CA C 6 56.000 54.978 1.022 1
1 37 . 6 1 1 A 6 6 ARG CB C 6 30.900 34.819 -3.919 1
1 38 . 6 1 1 A 6 6 ARG N N 6 121.800 120.179 1.621 1
1 39 . 6 1 1 A 7 7 GLY H H 7 8.460 8.435 0.025 1
1 40 . 6 1 1 A 7 7 GLY HA2 H 7 3.940 4.280 -0.340 1
1 41 . 6 1 1 A 7 7 GLY HA3 H 7 3.760 4.283 -0.523 1
1 42 . 6 1 1 A 7 7 GLY CA C 7 45.000 45.164 -0.164 1
1 43 . 6 1 1 A 7 7 GLY N N 7 110.700 109.170 1.530 1
1 44 . 6 1 1 A 8 8 SER H H 8 7.990 8.719 -0.729 1
1 45 . 6 1 1 A 8 8 SER HA H 8 4.450 4.520 -0.070 1
1 48 . 6 1 1 A 8 8 SER CA C 8 58.900 59.204 -0.304 1
1 49 . 6 1 1 A 8 8 SER CB C 8 64.200 64.462 -0.262 1
1 50 . 6 1 1 A 8 8 SER N N 8 115.500 116.270 -0.770 1
1 51 . 6 1 1 A 9 9 MET H H 9 9.040 7.636 1.404 1
1 52 . 6 1 1 A 9 9 MET HA H 9 4.610 5.072 -0.462 1
1 60 . 6 1 1 A 9 9 MET CA C 9 54.400 53.539 0.861 1
1 61 . 6 1 1 A 9 9 MET CB C 9 35.400 33.328 2.072 1
1 64 . 6 1 1 A 9 9 MET N N 9 120.500 119.362 1.138 1
1 65 . 6 1 1 A 10 10 GLN H H 10 8.270 8.912 -0.642 1
1 66 . 6 1 1 A 10 10 GLN HA H 10 5.270 5.202 0.068 1
1 71 . 6 1 1 A 10 10 GLN CA C 10 54.200 54.385 -0.185 1
1 72 . 6 1 1 A 10 10 GLN CB C 10 30.500 32.207 -1.707 1
1 74 . 6 1 1 A 10 10 GLN N N 10 121.000 122.081 -1.081 1
1 75 . 6 1 1 A 11 11 ILE H H 11 8.270 8.754 -0.484 1
1 76 . 6 1 1 A 11 11 ILE HA H 11 4.100 4.847 -0.747 1
1 86 . 6 1 1 A 11 11 ILE CA C 11 59.400 59.118 0.282 1
1 87 . 6 1 1 A 11 11 ILE CB C 11 41.800 41.004 0.796 1
1 91 . 6 1 1 A 11 11 ILE N N 11 114.600 121.312 -6.712 1
1 92 . 6 1 1 A 12 12 PHE H H 12 8.520 8.863 -0.343 1
1 93 . 6 1 1 A 12 12 PHE HA H 12 5.540 5.371 0.169 1
1 96 . 6 1 1 A 12 12 PHE CA C 12 55.000 56.431 -1.431 1
1 97 . 6 1 1 A 12 12 PHE CB C 12 41.200 41.160 0.040 1
1 98 . 6 1 1 A 12 12 PHE N N 12 118.600 123.737 -5.137 1
1 99 . 6 1 1 A 13 13 VAL H H 13 9.230 9.075 0.155 1
1 100 . 6 1 1 A 13 13 VAL HA H 13 4.740 4.984 -0.244 1
1 108 . 6 1 1 A 13 13 VAL CA C 13 60.300 60.672 -0.372 1
1 109 . 6 1 1 A 13 13 VAL CB C 13 34.100 35.201 -1.101 1
1 112 . 6 1 1 A 13 13 VAL N N 13 121.400 124.970 -3.570 1
1 113 . 6 1 1 A 14 14 LYS H H 14 8.910 8.935 -0.025 1
1 114 . 6 1 1 A 14 14 LYS HA H 14 5.190 4.832 0.358 1
1 122 . 6 1 1 A 14 14 LYS CA C 14 54.600 54.900 -0.300 1
1 123 . 6 1 1 A 14 14 LYS CB C 14 34.300 34.580 -0.280 1
1 126 . 6 1 1 A 14 14 LYS N N 14 128.000 126.839 1.161 1
1 127 . 6 1 1 A 15 15 THR H H 15 8.650 8.723 -0.073 1
1 128 . 6 1 1 A 15 15 THR HA H 15 4.870 4.540 0.330 1
1 133 . 6 1 1 A 15 15 THR CA C 15 60.300 60.867 -0.567 1
1 134 . 6 1 1 A 15 15 THR CB C 15 70.600 71.180 -0.580 1
1 136 . 6 1 1 A 15 15 THR N N 15 115.300 117.856 -2.556 1
1 137 . 6 1 1 A 16 16 LEU H H 16 9.070 8.849 0.221 1
1 138 . 6 1 1 A 16 16 LEU HA H 16 4.210 3.999 0.211 1
1 148 . 6 1 1 A 16 16 LEU CA C 16 57.400 57.767 -0.367 1
1 149 . 6 1 1 A 16 16 LEU CB C 16 41.800 41.543 0.257 1
1 153 . 6 1 1 A 16 16 LEU N N 16 121.400 122.424 -1.024 1
1 154 . 6 1 1 A 17 17 THR H H 17 7.560 7.833 -0.273 1
1 155 . 6 1 1 A 17 17 THR HA H 17 4.330 4.246 0.084 1
1 160 . 6 1 1 A 17 17 THR CA C 17 61.400 64.270 -2.870 1
1 161 . 6 1 1 A 17 17 THR CB C 17 68.900 69.638 -0.738 1
1 163 . 6 1 1 A 17 17 THR N N 17 105.900 112.245 -6.345 1
1 164 . 6 1 1 A 18 18 GLY H H 18 7.750 7.664 0.086 1
1 165 . 6 1 1 A 18 18 GLY HA2 H 18 4.250 4.029 0.221 1
1 166 . 6 1 1 A 18 18 GLY HA3 H 18 3.520 4.044 -0.524 1
1 167 . 6 1 1 A 18 18 GLY CA C 18 45.300 45.129 0.171 1
1 168 . 6 1 1 A 18 18 GLY N N 18 109.300 109.260 0.040 1
1 169 . 6 1 1 A 19 19 LYS H H 19 7.210 7.713 -0.503 1
1 170 . 6 1 1 A 19 19 LYS HA H 19 4.260 4.310 -0.050 1
1 175 . 6 1 1 A 19 19 LYS CA C 19 56.300 56.996 -0.696 1
1 176 . 6 1 1 A 19 19 LYS CB C 19 33.200 34.128 -0.928 1
1 179 . 6 1 1 A 19 19 LYS N N 19 122.000 121.494 0.506 1
1 180 . 6 1 1 A 20 20 THR H H 20 8.570 8.568 0.002 1
1 181 . 6 1 1 A 20 20 THR HA H 20 4.950 5.532 -0.582 1
1 186 . 6 1 1 A 20 20 THR CA C 20 62.200 60.356 1.844 1
1 187 . 6 1 1 A 20 20 THR CB C 20 69.700 70.731 -1.031 1
1 189 . 6 1 1 A 20 20 THR N N 20 120.700 113.666 7.034 1
1 190 . 6 1 1 A 21 21 ILE H H 21 9.510 8.458 1.052 1
1 191 . 6 1 1 A 21 21 ILE HA H 21 4.390 4.876 -0.486 1
1 201 . 6 1 1 A 21 21 ILE CA C 21 60.000 59.091 0.909 1
1 202 . 6 1 1 A 21 21 ILE CB C 21 40.700 41.543 -0.843 1
1 206 . 6 1 1 A 21 21 ILE N N 21 128.200 123.090 5.110 1
1 207 . 6 1 1 A 22 22 THR H H 22 8.700 8.665 0.035 1
1 208 . 6 1 1 A 22 22 THR HA H 22 4.860 4.448 0.412 1
1 213 . 6 1 1 A 22 22 THR CA C 22 62.100 62.718 -0.618 1
1 214 . 6 1 1 A 22 22 THR CB C 22 69.500 68.933 0.567 1
1 216 . 6 1 1 A 22 22 THR N N 22 122.300 121.574 0.726 1
1 217 . 6 1 1 A 23 23 LEU H H 23 8.720 8.959 -0.239 1
1 218 . 6 1 1 A 23 23 LEU HA H 23 4.690 4.968 -0.278 1
1 228 . 6 1 1 A 23 23 LEU CA C 23 52.700 53.391 -0.691 1
1 229 . 6 1 1 A 23 23 LEU CB C 23 46.600 45.227 1.373 1
1 233 . 6 1 1 A 23 23 LEU N N 23 125.400 127.533 -2.133 1
1 234 . 6 1 1 A 24 24 GLU H H 24 8.080 8.880 -0.800 1
1 235 . 6 1 1 A 24 24 GLU HA H 24 4.800 5.087 -0.287 1
1 238 . 6 1 1 A 24 24 GLU CA C 24 55.400 55.236 0.164 1
1 239 . 6 1 1 A 24 24 GLU CB C 24 30.100 32.077 -1.977 1
1 241 . 6 1 1 A 24 24 GLU N N 24 121.800 121.892 -0.092 1
1 242 . 6 1 1 A 25 25 VAL H H 25 8.800 8.863 -0.063 1
1 243 . 6 1 1 A 25 25 VAL HA H 25 4.640 4.917 -0.277 1
1 251 . 6 1 1 A 25 25 VAL CA C 25 58.600 59.538 -0.938 1
1 252 . 6 1 1 A 25 25 VAL CB C 25 36.300 35.938 0.362 1
1 255 . 6 1 1 A 25 25 VAL N N 25 116.700 119.625 -2.925 1
1 256 . 6 1 1 A 26 26 GLU H H 26 8.500 8.322 0.178 1
1 257 . 6 1 1 A 26 26 GLU HA H 26 4.900 4.771 0.129 1
1 260 . 6 1 1 A 26 26 GLU CA C 26 53.000 53.311 -0.311 1
1 261 . 6 1 1 A 26 26 GLU CB C 26 31.200 32.877 -1.677 1
1 262 . 6 1 1 A 26 26 GLU N N 26 117.900 122.230 -4.330 1
1 263 . 6 1 1 A 27 27 PRO HA H 27 4.040 4.393 -0.353 1
1 270 . 6 1 1 A 27 27 PRO CA C 27 65.400 64.862 0.538 1
1 271 . 6 1 1 A 27 27 PRO CB C 27 31.700 32.055 -0.355 1
1 274 . 6 1 1 A 28 28 SER H H 28 7.010 8.084 -1.074 1
1 275 . 6 1 1 A 28 28 SER HA H 28 4.280 4.453 -0.173 1
1 278 . 6 1 1 A 28 28 SER CA C 28 57.400 58.313 -0.913 1
1 279 . 6 1 1 A 28 28 SER CB C 28 63.400 64.216 -0.816 1
1 280 . 6 1 1 A 28 28 SER N N 28 103.800 110.436 -6.636 1
1 281 . 6 1 1 A 29 29 ASP H H 29 7.960 7.799 0.161 1
1 282 . 6 1 1 A 29 29 ASP HA H 29 4.600 5.040 -0.440 1
1 285 . 6 1 1 A 29 29 ASP CA C 29 55.900 53.290 2.610 1
1 286 . 6 1 1 A 29 29 ASP CB C 29 41.000 43.020 -2.020 1
1 287 . 6 1 1 A 29 29 ASP N N 29 123.700 121.824 1.876 1
1 288 . 6 1 1 A 30 30 THR H H 30 7.780 8.689 -0.909 1
1 289 . 6 1 1 A 30 30 THR HA H 30 4.850 4.631 0.219 1
1 294 . 6 1 1 A 30 30 THR CA C 30 59.400 60.447 -1.047 1
1 295 . 6 1 1 A 30 30 THR CB C 30 71.100 70.910 0.190 1
1 297 . 6 1 1 A 30 30 THR N N 30 108.800 119.557 -10.757 1
1 298 . 6 1 1 A 31 31 ILE H H 31 8.320 8.996 -0.676 1
1 299 . 6 1 1 A 31 31 ILE HA H 31 3.580 3.761 -0.181 1
1 309 . 6 1 1 A 31 31 ILE CA C 31 62.200 64.750 -2.550 1
1 310 . 6 1 1 A 31 31 ILE CB C 31 34.300 37.548 -3.248 1
1 314 . 6 1 1 A 31 31 ILE N N 31 121.300 127.105 -5.805 1
1 315 . 6 1 1 A 32 32 GLU H H 32 9.850 8.451 1.399 1
1 316 . 6 1 1 A 32 32 GLU HA H 32 3.780 3.955 -0.175 1
1 321 . 6 1 1 A 32 32 GLU CA C 32 60.500 59.753 0.747 1
1 322 . 6 1 1 A 32 32 GLU CB C 32 28.800 29.077 -0.277 1
1 324 . 6 1 1 A 32 32 GLU N N 32 121.600 121.220 0.380 1
1 325 . 6 1 1 A 33 33 ASN H H 33 7.810 7.711 0.099 1
1 326 . 6 1 1 A 33 33 ASN HA H 33 4.440 4.482 -0.042 1
1 329 . 6 1 1 A 33 33 ASN CA C 33 55.800 55.922 -0.122 1
1 330 . 6 1 1 A 33 33 ASN CB C 33 38.100 38.280 -0.180 1
1 331 . 6 1 1 A 33 33 ASN N N 33 121.000 118.025 2.975 1
1 332 . 6 1 1 A 34 34 VAL H H 34 8.000 7.841 0.159 1
1 333 . 6 1 1 A 34 34 VAL HA H 34 3.300 3.500 -0.200 1
1 341 . 6 1 1 A 34 34 VAL CA C 34 67.600 67.164 0.436 1
1 342 . 6 1 1 A 34 34 VAL CB C 34 30.700 31.366 -0.666 1
1 345 . 6 1 1 A 34 34 VAL N N 34 122.200 119.917 2.283 1
1 346 . 6 1 1 A 35 35 LYS H H 35 8.490 8.406 0.084 1
1 347 . 6 1 1 A 35 35 LYS HA H 35 4.500 4.077 0.423 1
1 352 . 6 1 1 A 35 35 LYS CA C 35 59.300 58.630 0.670 1
1 353 . 6 1 1 A 35 35 LYS CB C 35 33.500 31.956 1.544 1
1 354 . 6 1 1 A 35 35 LYS N N 35 119.200 120.364 -1.164 1
1 355 . 6 1 1 A 36 36 ALA H H 36 7.880 8.169 -0.289 1
1 356 . 6 1 1 A 36 36 ALA HA H 36 4.060 4.102 -0.042 1
1 360 . 6 1 1 A 36 36 ALA CA C 36 55.300 54.804 0.496 1
1 361 . 6 1 1 A 36 36 ALA CB C 36 17.600 18.169 -0.569 1
1 362 . 6 1 1 A 36 36 ALA N N 36 123.300 122.012 1.288 1
1 363 . 6 1 1 A 37 37 LYS H H 37 7.790 7.995 -0.205 1
1 364 . 6 1 1 A 37 37 LYS HA H 37 4.110 4.074 0.036 1
1 373 . 6 1 1 A 37 37 LYS CA C 37 59.700 59.331 0.369 1
1 374 . 6 1 1 A 37 37 LYS CB C 37 33.100 32.275 0.825 1
1 378 . 6 1 1 A 37 37 LYS N N 37 120.400 117.084 3.316 1
1 379 . 6 1 1 A 38 38 ILE H H 38 8.240 7.833 0.407 1
1 380 . 6 1 1 A 38 38 ILE HA H 38 3.410 3.944 -0.534 1
1 390 . 6 1 1 A 38 38 ILE CA C 38 66.200 62.846 3.354 1
1 391 . 6 1 1 A 38 38 ILE CB C 38 36.800 37.530 -0.730 1
1 395 . 6 1 1 A 38 38 ILE N N 38 121.400 120.182 1.218 1
1 396 . 6 1 1 A 39 39 GLN H H 39 8.460 8.240 0.220 1
1 397 . 6 1 1 A 39 39 GLN HA H 39 3.730 4.028 -0.298 1
1 402 . 6 1 1 A 39 39 GLN CA C 39 60.000 58.478 1.522 1
1 403 . 6 1 1 A 39 39 GLN CB C 39 27.600 28.738 -1.138 1
1 405 . 6 1 1 A 39 39 GLN N N 39 123.500 120.854 2.646 1
1 406 . 6 1 1 A 40 40 ASP H H 40 7.970 7.930 0.040 1
1 407 . 6 1 1 A 40 40 ASP HA H 40 4.240 4.371 -0.131 1
1 410 . 6 1 1 A 40 40 ASP CA C 40 57.400 56.633 0.767 1
1 411 . 6 1 1 A 40 40 ASP CB C 40 41.000 40.675 0.325 1
1 412 . 6 1 1 A 40 40 ASP N N 40 119.900 119.343 0.557 1
1 413 . 6 1 1 A 41 41 LYS H H 41 7.420 7.864 -0.444 1
1 414 . 6 1 1 A 41 41 LYS HA H 41 4.200 4.138 0.062 1
1 423 . 6 1 1 A 41 41 LYS CA C 41 58.200 59.058 -0.858 1
1 424 . 6 1 1 A 41 41 LYS CB C 41 33.900 32.825 1.075 1
1 427 . 6 1 1 A 41 41 LYS N N 41 115.700 119.101 -3.401 1
1 428 . 6 1 1 A 42 42 GLU H H 42 8.650 7.866 0.784 1
1 429 . 6 1 1 A 42 42 GLU HA H 42 4.470 4.504 -0.034 1
1 434 . 6 1 1 A 42 42 GLU CA C 42 55.300 56.018 -0.718 1
1 435 . 6 1 1 A 42 42 GLU CB C 42 33.200 31.987 1.213 1
1 437 . 6 1 1 A 42 42 GLU N N 42 114.200 115.470 -1.270 1
1 438 . 6 1 1 A 43 43 GLY H H 43 8.400 7.874 0.526 1
1 439 . 6 1 1 A 43 43 GLY HA2 H 43 4.040 3.992 0.048 1
1 440 . 6 1 1 A 43 43 GLY HA3 H 43 3.820 3.992 -0.172 1
1 441 . 6 1 1 A 43 43 GLY CA C 43 45.900 45.395 0.505 1
1 442 . 6 1 1 A 43 43 GLY N N 43 109.000 108.186 0.814 1
1 443 . 6 1 1 A 44 44 ILE H H 44 6.080 7.834 -1.754 1
1 444 . 6 1 1 A 44 44 ILE HA H 44 4.290 4.229 0.061 1
1 446 . 6 1 1 A 44 44 ILE CA C 44 57.700 58.395 -0.695 1
1 447 . 6 1 1 A 44 44 ILE CB C 44 40.400 38.555 1.845 1
1 448 . 6 1 1 A 44 44 ILE N N 44 120.500 122.425 -1.925 1
1 449 . 6 1 1 A 46 46 PRO HA H 46 4.030 4.282 -0.252 1
1 454 . 6 1 1 A 46 46 PRO CA C 46 66.100 65.080 1.020 1
1 455 . 6 1 1 A 46 46 PRO CB C 46 32.600 31.851 0.749 1
1 458 . 6 1 1 A 47 47 ASP H H 47 8.470 8.527 -0.057 1
1 459 . 6 1 1 A 47 47 ASP HA H 47 4.310 4.358 -0.048 1
1 462 . 6 1 1 A 47 47 ASP CA C 47 55.700 57.164 -1.464 1
1 463 . 6 1 1 A 47 47 ASP CB C 47 39.700 40.216 -0.516 1
1 464 . 6 1 1 A 47 47 ASP N N 47 113.700 117.925 -4.225 1
1 465 . 6 1 1 A 48 48 GLN H H 48 7.720 7.472 0.248 1
1 466 . 6 1 1 A 48 48 GLN HA H 48 4.340 4.401 -0.061 1
1 471 . 6 1 1 A 48 48 GLN CA C 48 55.500 55.696 -0.196 1
1 472 . 6 1 1 A 48 48 GLN CB C 48 29.900 30.572 -0.672 1
1 474 . 6 1 1 A 48 48 GLN N N 48 116.900 115.226 1.674 1
1 475 . 6 1 1 A 49 49 GLN H H 49 7.410 7.798 -0.388 1
1 476 . 6 1 1 A 49 49 GLN HA H 49 4.110 4.144 -0.034 1
1 481 . 6 1 1 A 49 49 GLN CA C 49 56.600 56.077 0.523 1
1 482 . 6 1 1 A 49 49 GLN CB C 49 31.300 29.006 2.294 1
1 484 . 6 1 1 A 49 49 GLN N N 49 118.000 120.537 -2.537 1
1 485 . 6 1 1 A 50 50 ARG H H 50 8.400 8.584 -0.184 1
1 486 . 6 1 1 A 50 50 ARG HA H 50 4.380 4.859 -0.479 1
1 491 . 6 1 1 A 50 50 ARG CA C 50 55.100 54.769 0.331 1
1 492 . 6 1 1 A 50 50 ARG CB C 50 31.600 32.103 -0.503 1
1 494 . 6 1 1 A 50 50 ARG N N 50 123.100 125.581 -2.481 1
1 495 . 6 1 1 A 51 51 LEU H H 51 8.710 8.633 0.077 1
1 496 . 6 1 1 A 51 51 LEU HA H 51 5.300 5.071 0.229 1
1 506 . 6 1 1 A 51 51 LEU CA C 51 52.900 53.316 -0.416 1
1 507 . 6 1 1 A 51 51 LEU CB C 51 45.700 45.587 0.113 1
1 511 . 6 1 1 A 51 51 LEU N N 51 124.400 120.463 3.937 1
1 512 . 6 1 1 A 52 52 ILE H H 52 9.060 8.582 0.478 1
1 513 . 6 1 1 A 52 52 ILE HA H 52 4.840 4.956 -0.116 1
1 523 . 6 1 1 A 52 52 ILE CA C 52 58.900 59.964 -1.064 1
1 524 . 6 1 1 A 52 52 ILE CB C 52 41.200 40.935 0.265 1
1 528 . 6 1 1 A 52 52 ILE N N 52 122.500 122.919 -0.419 1
1 529 . 6 1 1 A 53 53 PHE H H 53 8.730 9.442 -0.712 1
1 530 . 6 1 1 A 53 53 PHE HA H 53 5.100 4.847 0.253 1
1 535 . 6 1 1 A 53 53 PHE CA C 53 56.300 57.494 -1.194 1
1 536 . 6 1 1 A 53 53 PHE CB C 53 43.500 41.851 1.649 1
1 537 . 6 1 1 A 53 53 PHE N N 53 124.800 127.835 -3.035 1
1 538 . 6 1 1 A 54 54 ALA H H 54 8.940 9.184 -0.244 1
1 539 . 6 1 1 A 54 54 ALA HA H 54 3.610 3.900 -0.290 1
1 543 . 6 1 1 A 54 54 ALA CA C 54 52.500 53.020 -0.520 1
1 544 . 6 1 1 A 54 54 ALA CB C 54 16.300 17.375 -1.075 1
1 545 . 6 1 1 A 54 54 ALA N N 54 133.100 130.354 2.746 1
1 546 . 6 1 1 A 55 55 GLY H H 55 8.070 8.374 -0.304 1
1 547 . 6 1 1 A 55 55 GLY HA2 H 55 4.000 3.792 0.208 1
1 548 . 6 1 1 A 55 55 GLY HA3 H 55 3.340 3.829 -0.489 1
1 549 . 6 1 1 A 55 55 GLY CA C 55 45.200 45.214 -0.014 1
1 550 . 6 1 1 A 55 55 GLY N N 55 102.500 102.662 -0.162 1
1 551 . 6 1 1 A 56 56 LYS H H 56 7.860 7.909 -0.049 1
1 552 . 6 1 1 A 56 56 LYS HA H 56 4.510 4.565 -0.055 1
1 558 . 6 1 1 A 56 56 LYS CA C 56 54.500 54.683 -0.183 1
1 559 . 6 1 1 A 56 56 LYS CB C 56 34.400 33.762 0.638 1
1 561 . 6 1 1 A 56 56 LYS N N 56 121.800 121.940 -0.140 1
1 562 . 6 1 1 A 57 57 GLN H H 57 8.600 8.354 0.246 1
1 563 . 6 1 1 A 57 57 GLN HA H 57 4.410 4.681 -0.271 1
1 568 . 6 1 1 A 57 57 GLN CA C 57 55.900 55.350 0.550 1
1 569 . 6 1 1 A 57 57 GLN CB C 57 28.800 29.656 -0.856 1
1 571 . 6 1 1 A 57 57 GLN N N 57 123.200 124.172 -0.972 1
1 572 . 6 1 1 A 58 58 LEU H H 58 8.480 7.840 0.640 1
1 573 . 6 1 1 A 58 58 LEU HA H 58 4.060 4.979 -0.919 1
1 583 . 6 1 1 A 58 58 LEU CA C 58 54.100 53.249 0.851 1
1 584 . 6 1 1 A 58 58 LEU CB C 58 41.500 44.023 -2.523 1
1 588 . 6 1 1 A 58 58 LEU N N 58 125.900 122.524 3.376 1
1 589 . 6 1 1 A 59 59 GLU H H 59 8.400 8.798 -0.398 1
1 590 . 6 1 1 A 59 59 GLU HA H 59 4.400 4.561 -0.161 1
1 595 . 6 1 1 A 59 59 GLU CA C 59 55.900 57.268 -1.368 1
1 596 . 6 1 1 A 59 59 GLU CB C 59 31.900 31.983 -0.083 1
1 598 . 6 1 1 A 59 59 GLU N N 59 123.100 118.334 4.766 1
1 599 . 6 1 1 A 60 60 ASP H H 60 8.110 8.019 0.091 1
1 600 . 6 1 1 A 60 60 ASP HA H 60 4.270 4.716 -0.446 1
1 603 . 6 1 1 A 60 60 ASP CA C 60 57.100 54.953 2.147 1
1 604 . 6 1 1 A 60 60 ASP CB C 60 40.800 41.556 -0.756 1
1 605 . 6 1 1 A 60 60 ASP N N 60 120.300 119.618 0.682 1
1 606 . 6 1 1 A 61 61 GLY HA2 H 61 4.000 4.276 -0.276 1
1 607 . 6 1 1 A 61 61 GLY HA3 H 61 3.830 4.292 -0.462 1
1 608 . 6 1 1 A 61 61 GLY CA C 61 45.000 45.034 -0.034 1
1 609 . 6 1 1 A 62 62 ARG H H 62 7.350 8.941 -1.591 1
1 610 . 6 1 1 A 62 62 ARG HA H 62 4.640 5.043 -0.403 1
1 615 . 6 1 1 A 62 62 ARG CA C 62 54.400 54.016 0.384 1
1 616 . 6 1 1 A 62 62 ARG CB C 62 32.600 34.002 -1.402 1
1 618 . 6 1 1 A 62 62 ARG N N 62 119.300 125.581 -6.281 1
1 619 . 6 1 1 A 63 63 THR H H 63 8.460 8.802 -0.342 1
1 620 . 6 1 1 A 63 63 THR HA H 63 5.060 4.611 0.449 1
1 625 . 6 1 1 A 63 63 THR CA C 63 59.700 60.876 -1.176 1
1 626 . 6 1 1 A 63 63 THR CB C 63 72.000 70.869 1.131 1
1 628 . 6 1 1 A 63 63 THR N N 63 109.100 114.478 -5.378 1
1 629 . 6 1 1 A 64 64 LEU H H 64 8.190 8.713 -0.523 1
1 630 . 6 1 1 A 64 64 LEU HA H 64 3.920 4.021 -0.101 1
1 640 . 6 1 1 A 64 64 LEU CA C 64 58.400 57.710 0.690 1
1 641 . 6 1 1 A 64 64 LEU CB C 64 40.200 41.388 -1.188 1
1 645 . 6 1 1 A 64 64 LEU N N 64 118.100 122.868 -4.768 1
1 646 . 6 1 1 A 65 65 SER H H 65 8.370 7.827 0.543 1
1 647 . 6 1 1 A 65 65 SER HA H 65 4.150 4.194 -0.044 1
1 650 . 6 1 1 A 65 65 SER CA C 65 60.900 61.219 -0.319 1
1 651 . 6 1 1 A 65 65 SER CB C 65 62.500 62.855 -0.355 1
1 652 . 6 1 1 A 65 65 SER N N 65 112.200 114.681 -2.481 1
1 653 . 6 1 1 A 66 66 GLU H H 66 7.780 7.713 0.067 1
1 654 . 6 1 1 A 66 66 GLU HA H 66 3.890 4.121 -0.231 1
1 659 . 6 1 1 A 66 66 GLU CA C 66 59.200 58.836 0.364 1
1 660 . 6 1 1 A 66 66 GLU CB C 66 29.400 29.437 -0.037 1
1 662 . 6 1 1 A 66 66 GLU N N 66 123.600 121.819 1.781 1
1 663 . 6 1 1 A 67 67 TYR H H 67 7.290 7.538 -0.248 1
1 664 . 6 1 1 A 67 67 TYR HA H 67 4.590 4.548 0.042 1
1 669 . 6 1 1 A 67 67 TYR CA C 67 58.400 59.170 -0.770 1
1 670 . 6 1 1 A 67 67 TYR CB C 67 39.800 39.103 0.697 1
1 671 . 6 1 1 A 67 67 TYR N N 67 116.400 119.714 -3.314 1
1 672 . 6 1 1 A 68 68 ASN H H 68 8.040 7.995 0.045 1
1 673 . 6 1 1 A 68 68 ASN HA H 68 4.240 4.343 -0.103 1
1 676 . 6 1 1 A 68 68 ASN CA C 68 54.100 54.248 -0.148 1
1 677 . 6 1 1 A 68 68 ASN CB C 68 37.200 37.506 -0.306 1
1 678 . 6 1 1 A 68 68 ASN N N 68 115.600 116.806 -1.206 1
1 679 . 6 1 1 A 69 69 ILE H H 69 7.200 7.357 -0.157 1
1 680 . 6 1 1 A 69 69 ILE HA H 69 3.280 4.408 -1.128 1
1 690 . 6 1 1 A 69 69 ILE CA C 69 59.800 59.408 0.392 1
1 691 . 6 1 1 A 69 69 ILE CB C 69 36.600 38.927 -2.327 1
1 695 . 6 1 1 A 69 69 ILE N N 69 119.100 114.979 4.121 1
1 696 . 6 1 1 A 70 70 GLN H H 70 7.570 8.158 -0.588 1
1 697 . 6 1 1 A 70 70 GLN HA H 70 4.410 4.524 -0.114 1
1 702 . 6 1 1 A 70 70 GLN CA C 70 53.500 55.132 -1.632 1
1 703 . 6 1 1 A 70 70 GLN CB C 70 31.500 28.028 3.472 1
1 705 . 6 1 1 A 70 70 GLN N N 70 124.800 120.925 3.875 1
1 706 . 6 1 1 A 71 71 LYS H H 71 8.370 8.226 0.144 1
1 707 . 6 1 1 A 71 71 LYS HA H 71 3.870 4.196 -0.326 1
1 716 . 6 1 1 A 71 71 LYS CA C 71 58.000 57.496 0.504 1
1 717 . 6 1 1 A 71 71 LYS CB C 71 32.500 32.577 -0.077 1
1 720 . 6 1 1 A 71 71 LYS N N 71 120.200 122.386 -2.186 1
1 721 . 6 1 1 A 72 72 GLU H H 72 9.230 7.979 1.251 1
1 722 . 6 1 1 A 72 72 GLU HA H 72 3.240 4.427 -1.187 1
1 727 . 6 1 1 A 72 72 GLU CA C 72 58.300 56.529 1.771 1
1 728 . 6 1 1 A 72 72 GLU CB C 72 26.000 29.974 -3.974 1
1 730 . 6 1 1 A 72 72 GLU N N 72 115.100 118.366 -3.266 1
1 731 . 6 1 1 A 73 73 SER H H 73 7.690 8.086 -0.396 1
1 732 . 6 1 1 A 73 73 SER HA H 73 4.520 4.730 -0.210 1
1 735 . 6 1 1 A 73 73 SER CA C 73 61.100 58.318 2.782 1
1 736 . 6 1 1 A 73 73 SER CB C 73 64.800 63.824 0.976 1
1 737 . 6 1 1 A 73 73 SER N N 73 115.300 112.636 2.664 1
1 738 . 6 1 1 A 74 74 THR H H 74 8.620 7.698 0.922 1
1 739 . 6 1 1 A 74 74 THR HA H 74 5.200 5.108 0.092 1
1 744 . 6 1 1 A 74 74 THR CA C 74 62.400 61.797 0.603 1
1 745 . 6 1 1 A 74 74 THR CB C 74 70.200 70.754 -0.554 1
1 747 . 6 1 1 A 74 74 THR N N 74 117.500 112.808 4.692 1
1 748 . 6 1 1 A 75 75 LEU H H 75 9.350 9.143 0.207 1
1 749 . 6 1 1 A 75 75 LEU HA H 75 4.990 5.201 -0.211 1
1 759 . 6 1 1 A 75 75 LEU CA C 75 53.800 54.168 -0.368 1
1 760 . 6 1 1 A 75 75 LEU CB C 75 44.400 46.439 -2.039 1
1 764 . 6 1 1 A 75 75 LEU N N 75 128.000 128.017 -0.017 1
1 765 . 6 1 1 A 76 76 HIS H H 76 9.140 8.576 0.564 1
1 766 . 6 1 1 A 76 76 HIS HA H 76 5.040 5.303 -0.263 1
1 769 . 6 1 1 A 76 76 HIS CA C 76 56.200 54.090 2.110 1
1 770 . 6 1 1 A 76 76 HIS CB C 76 32.500 32.735 -0.235 1
1 771 . 6 1 1 A 76 76 HIS N N 76 119.600 124.927 -5.327 1
1 772 . 6 1 1 A 77 77 LEU H H 77 8.240 8.932 -0.692 1
1 773 . 6 1 1 A 77 77 LEU HA H 77 5.080 5.166 -0.086 1
1 783 . 6 1 1 A 77 77 LEU CA C 77 53.600 53.435 0.165 1
1 784 . 6 1 1 A 77 77 LEU CB C 77 44.100 43.270 0.830 1
1 788 . 6 1 1 A 77 77 LEU N N 77 123.800 124.092 -0.292 1
1 789 . 6 1 1 A 78 78 VAL H H 78 9.110 8.509 0.601 1
1 790 . 6 1 1 A 78 78 VAL HA H 78 4.260 5.028 -0.768 1
1 798 . 6 1 1 A 78 78 VAL CA C 78 60.400 60.431 -0.031 1
1 799 . 6 1 1 A 78 78 VAL CB C 78 34.700 36.313 -1.613 1
1 802 . 6 1 1 A 78 78 VAL N N 78 127.100 124.501 2.599 1
1 803 . 6 1 1 A 79 79 LEU H H 79 8.050 8.599 -0.549 1
1 804 . 6 1 1 A 79 79 LEU HA H 79 4.950 4.871 0.079 1
1 813 . 6 1 1 A 79 79 LEU CA C 79 53.800 53.724 0.076 1
1 814 . 6 1 1 A 79 79 LEU CB C 79 42.700 44.371 -1.671 1
1 818 . 6 1 1 A 79 79 LEU N N 79 123.400 127.570 -4.170 1
1 819 . 6 1 1 A 80 80 ARG H H 80 8.540 8.094 0.446 1
1 820 . 6 1 1 A 80 80 ARG HA H 80 4.170 4.212 -0.042 1
1 827 . 6 1 1 A 80 80 ARG CA C 80 55.800 57.388 -1.588 1
1 828 . 6 1 1 A 80 80 ARG CB C 80 31.100 30.602 0.498 1
1 830 . 6 1 1 A 80 80 ARG N N 80 123.500 127.116 -3.616 1
1 831 . 6 1 1 A 81 81 LEU H H 81 8.250 8.761 -0.511 1
1 832 . 6 1 1 A 81 81 LEU HA H 81 4.270 4.407 -0.137 1
1 842 . 6 1 1 A 81 81 LEU CA C 81 55.000 54.565 0.435 1
1 843 . 6 1 1 A 81 81 LEU CB C 81 42.200 42.214 -0.014 1
1 847 . 6 1 1 A 81 81 LEU N N 81 124.100 128.567 -4.467 1
1 848 . 6 1 1 A 82 82 ARG H H 82 8.310 8.688 -0.378 1
1 849 . 6 1 1 A 82 82 ARG HA H 82 4.200 4.531 -0.331 1
1 852 . 6 1 1 A 82 82 ARG CA C 82 56.300 54.816 1.484 1
1 853 . 6 1 1 A 82 82 ARG CB C 82 30.700 31.367 -0.667 1
1 855 . 6 1 1 A 82 82 ARG N N 82 121.500 119.374 2.126 1
1 856 . 6 1 1 A 83 83 GLY H H 83 8.410 7.432 0.978 1
1 857 . 6 1 1 A 83 83 GLY HA2 H 83 3.750 3.960 -0.210 1
1 858 . 6 1 1 A 83 83 GLY HA3 H 83 3.754 4.064 -0.310 1
1 859 . 6 1 1 A 83 83 GLY CA C 83 45.100 44.130 0.970 1
1 860 . 6 1 1 A 83 83 GLY N N 83 110.200 107.480 2.720 1
1 861 . 6 1 1 A 84 84 TYR H H 84 7.950 8.467 -0.517 1
1 862 . 6 1 1 A 84 84 TYR HA H 84 4.400 4.627 -0.227 1
1 865 . 6 1 1 A 84 84 TYR CA C 84 58.100 57.985 0.115 1
1 866 . 6 1 1 A 84 84 TYR CB C 84 38.800 39.758 -0.958 1
1 867 . 6 1 1 A 84 84 TYR N N 84 119.900 119.409 0.491 1
1 868 . 6 1 1 A 85 85 ALA H H 85 8.150 8.995 -0.845 1
1 869 . 6 1 1 A 85 85 ALA HA H 85 4.150 4.809 -0.659 1
1 873 . 6 1 1 A 85 85 ALA CA C 85 52.600 51.224 1.376 1
1 874 . 6 1 1 A 85 85 ALA CB C 85 19.200 23.212 -4.012 1
1 875 . 6 1 1 A 85 85 ALA N N 85 124.800 121.732 3.068 1
1 876 . 6 1 1 A 86 86 ASP H H 86 8.020 8.901 -0.881 1
1 877 . 6 1 1 A 86 86 ASP HA H 86 4.450 4.973 -0.523 1
1 880 . 6 1 1 A 86 86 ASP CA C 86 54.100 52.416 1.684 1
1 881 . 6 1 1 A 86 86 ASP CB C 86 41.100 43.328 -2.228 1
1 882 . 6 1 1 A 86 86 ASP N N 86 118.900 119.611 -0.711 1
1 883 . 6 1 1 A 87 87 LEU H H 87 8.010 8.479 -0.469 1
1 884 . 6 1 1 A 87 87 LEU HA H 87 4.210 5.058 -0.848 1
1 893 . 6 1 1 A 87 87 LEU CA C 87 55.300 54.264 1.036 1
1 894 . 6 1 1 A 87 87 LEU CB C 87 42.000 41.445 0.555 1
1 898 . 6 1 1 A 87 87 LEU N N 87 122.400 122.814 -0.414 1
1 899 . 6 1 1 A 88 88 ARG H H 88 8.170 8.439 -0.269 1
1 900 . 6 1 1 A 88 88 ARG HA H 88 4.210 4.674 -0.464 1
1 903 . 6 1 1 A 88 88 ARG CA C 88 56.300 54.047 2.253 1
1 904 . 6 1 1 A 88 88 ARG CB C 88 30.600 33.501 -2.901 1
1 905 . 6 1 1 A 88 88 ARG N N 88 121.200 124.147 -2.947 1
1 906 . 6 1 1 A 91 91 PRO HA H 91 4.290 4.739 -0.449 1
1 911 . 6 1 1 A 91 91 PRO CA C 91 63.800 62.373 1.427 1
1 912 . 6 1 1 A 91 91 PRO CB C 91 32.100 29.368 2.732 1
1 915 . 6 1 1 A 92 92 ASP H H 92 8.280 8.557 -0.277 1
1 916 . 6 1 1 A 92 92 ASP HA H 92 4.540 4.959 -0.419 1
1 919 . 6 1 1 A 92 92 ASP CA C 92 54.600 53.504 1.096 1
1 920 . 6 1 1 A 92 92 ASP CB C 92 41.000 44.870 -3.870 1
1 921 . 6 1 1 A 92 92 ASP N N 92 118.700 123.440 -4.740 1
1 922 . 6 1 1 A 93 93 ARG H H 93 7.780 8.439 -0.659 1
1 923 . 6 1 1 A 93 93 ARG HA H 93 4.190 4.319 -0.129 1
1 930 . 6 1 1 A 93 93 ARG CA C 93 56.300 56.792 -0.492 1
1 931 . 6 1 1 A 93 93 ARG CB C 93 30.700 31.304 -0.604 1
1 934 . 6 1 1 A 93 93 ARG N N 93 120.700 123.059 -2.359 1
1 935 . 6 1 1 A 94 94 GLN H H 94 8.280 8.298 -0.018 1
1 936 . 6 1 1 A 94 94 GLN HA H 94 4.210 4.770 -0.560 1
1 941 . 6 1 1 A 94 94 GLN CA C 94 55.800 53.865 1.935 1
1 942 . 6 1 1 A 94 94 GLN CB C 94 29.300 30.020 -0.720 1
1 944 . 6 1 1 A 94 94 GLN N N 94 121.000 118.348 2.652 1
1 945 . 6 1 1 A 95 95 ASP H H 95 8.270 8.326 -0.056 1
1 946 . 6 1 1 A 95 95 ASP HA H 95 4.450 4.932 -0.482 1
1 949 . 6 1 1 A 95 95 ASP CA C 95 54.300 53.153 1.147 1
1 950 . 6 1 1 A 95 95 ASP CB C 95 41.000 44.654 -3.654 1
1 951 . 6 1 1 A 95 95 ASP N N 95 121.000 119.501 1.499 1
1 952 . 6 1 1 A 96 96 HIS H H 96 8.090 8.360 -0.270 1
1 953 . 6 1 1 A 96 96 HIS HA H 96 4.470 5.275 -0.805 1
1 956 . 6 1 1 A 96 96 HIS CA C 96 55.900 54.936 0.964 1
1 957 . 6 1 1 A 96 96 HIS CB C 96 30.500 32.448 -1.948 1
1 958 . 6 1 1 A 96 96 HIS N N 96 119.300 118.969 0.331 1
1 959 . 6 1 1 A 97 97 HIS H H 97 8.240 8.643 -0.403 1
1 960 . 6 1 1 A 97 97 HIS HA H 97 4.470 4.810 -0.340 1
1 963 . 6 1 1 A 97 97 HIS CA C 97 56.200 54.954 1.246 1
1 964 . 6 1 1 A 97 97 HIS CB C 97 30.400 30.428 -0.028 1
1 965 . 6 1 1 A 97 97 HIS N N 97 121.300 122.149 -0.849 1
1 966 . 6 1 1 A 98 98 PRO HA H 98 4.340 4.461 -0.121 1
1 973 . 6 1 1 A 98 98 PRO CA C 98 63.700 62.536 1.164 1
1 974 . 6 1 1 A 98 98 PRO CB C 98 31.900 33.129 -1.229 1
1 977 . 6 1 1 A 99 99 GLY H H 99 8.660 8.188 0.472 1
1 978 . 6 1 1 A 99 99 GLY HA2 H 99 3.920 4.119 -0.199 1
1 979 . 6 1 1 A 99 99 GLY HA3 H 99 3.920 4.122 -0.202 1
1 980 . 6 1 1 A 99 99 GLY CA C 99 45.200 44.660 0.540 1
1 981 . 6 1 1 A 99 99 GLY N N 99 110.000 107.994 2.006 1
1 982 . 6 1 1 A 100 100 SER H H 100 8.170 8.336 -0.166 1
1 983 . 6 1 1 A 100 100 SER HA H 100 4.360 4.500 -0.140 1
1 986 . 6 1 1 A 100 100 SER CA C 100 58.500 59.918 -1.418 1
1 987 . 6 1 1 A 100 100 SER CB C 100 64.000 63.993 0.007 1
1 988 . 6 1 1 A 100 100 SER N N 100 115.600 115.881 -0.281 1
1 989 . 6 1 1 A 101 101 GLY H H 101 8.420 7.581 0.839 1
1 990 . 6 1 1 A 101 101 GLY HA2 H 101 3.890 4.206 -0.316 1
1 991 . 6 1 1 A 101 101 GLY HA3 H 101 3.920 4.211 -0.291 1
1 992 . 6 1 1 A 101 101 GLY CA C 101 45.200 44.930 0.270 1
1 993 . 6 1 1 A 101 101 GLY N N 101 111.000 105.278 5.722 1
1 994 . 6 1 1 A 102 102 ALA H H 102 8.030 8.277 -0.247 1
1 995 . 6 1 1 A 102 102 ALA HA H 102 4.250 4.849 -0.599 1
1 999 . 6 1 1 A 102 102 ALA CA C 102 52.500 51.495 1.005 1
1 1000 . 6 1 1 A 102 102 ALA CB C 102 19.200 22.525 -3.325 1
1 4 . 7 1 1 A 2 2 SER H H 2 8.160 7.969 0.191 1
1 5 . 7 1 1 A 2 2 SER HA H 2 4.370 4.158 0.212 1
1 9 . 7 1 1 A 2 2 SER CA C 2 58.300 58.919 -0.619 1
1 10 . 7 1 1 A 2 2 SER CB C 2 63.900 60.996 2.904 1
1 11 . 7 1 1 A 2 2 SER N N 2 115.600 110.570 5.030 1
1 12 . 7 1 1 A 3 3 LEU H H 3 8.250 7.589 0.661 1
1 13 . 7 1 1 A 3 3 LEU HA H 3 4.280 4.415 -0.135 1
1 17 . 7 1 1 A 3 3 LEU CA C 3 55.200 54.737 0.463 1
1 18 . 7 1 1 A 3 3 LEU CB C 3 42.100 42.838 -0.738 1
1 19 . 7 1 1 A 3 3 LEU N N 3 124.100 118.414 5.686 1
1 20 . 7 1 1 A 4 4 VAL H H 4 7.950 8.787 -0.837 1
1 21 . 7 1 1 A 4 4 VAL HA H 4 4.680 4.847 -0.167 1
1 26 . 7 1 1 A 4 4 VAL CA C 4 59.800 58.093 1.707 1
1 27 . 7 1 1 A 4 4 VAL CB C 4 32.500 33.629 -1.129 1
1 28 . 7 1 1 A 4 4 VAL N N 4 122.600 117.751 4.849 1
1 29 . 7 1 1 A 5 5 PRO CA C 5 63.100 62.668 0.432 1
1 30 . 7 1 1 A 5 5 PRO CB C 5 32.000 32.482 -0.482 1
1 32 . 7 1 1 A 6 6 ARG H H 6 8.360 8.526 -0.166 1
1 33 . 7 1 1 A 6 6 ARG HA H 6 4.250 5.119 -0.869 1
1 36 . 7 1 1 A 6 6 ARG CA C 6 56.000 54.725 1.275 1
1 37 . 7 1 1 A 6 6 ARG CB C 6 30.900 34.140 -3.240 1
1 38 . 7 1 1 A 6 6 ARG N N 6 121.800 121.555 0.245 1
1 39 . 7 1 1 A 7 7 GLY H H 7 8.460 8.523 -0.063 1
1 40 . 7 1 1 A 7 7 GLY HA2 H 7 3.940 4.207 -0.267 1
1 41 . 7 1 1 A 7 7 GLY HA3 H 7 3.760 4.210 -0.450 1
1 42 . 7 1 1 A 7 7 GLY CA C 7 45.000 44.400 0.600 1
1 43 . 7 1 1 A 7 7 GLY N N 7 110.700 109.677 1.023 1
1 44 . 7 1 1 A 8 8 SER H H 8 7.990 8.682 -0.692 1
1 45 . 7 1 1 A 8 8 SER HA H 8 4.450 4.614 -0.164 1
1 48 . 7 1 1 A 8 8 SER CA C 8 58.900 59.029 -0.129 1
1 49 . 7 1 1 A 8 8 SER CB C 8 64.200 64.521 -0.321 1
1 50 . 7 1 1 A 8 8 SER N N 8 115.500 115.727 -0.227 1
1 51 . 7 1 1 A 9 9 MET H H 9 9.040 7.576 1.464 1
1 52 . 7 1 1 A 9 9 MET HA H 9 4.610 5.070 -0.460 1
1 60 . 7 1 1 A 9 9 MET CA C 9 54.400 53.526 0.874 1
1 61 . 7 1 1 A 9 9 MET CB C 9 35.400 33.439 1.961 1
1 64 . 7 1 1 A 9 9 MET N N 9 120.500 119.201 1.299 1
1 65 . 7 1 1 A 10 10 GLN H H 10 8.270 8.961 -0.691 1
1 66 . 7 1 1 A 10 10 GLN HA H 10 5.270 5.301 -0.031 1
1 71 . 7 1 1 A 10 10 GLN CA C 10 54.200 54.445 -0.245 1
1 72 . 7 1 1 A 10 10 GLN CB C 10 30.500 32.261 -1.761 1
1 74 . 7 1 1 A 10 10 GLN N N 10 121.000 122.308 -1.308 1
1 75 . 7 1 1 A 11 11 ILE H H 11 8.270 8.813 -0.543 1
1 76 . 7 1 1 A 11 11 ILE HA H 11 4.100 4.833 -0.733 1
1 86 . 7 1 1 A 11 11 ILE CA C 11 59.400 59.305 0.095 1
1 87 . 7 1 1 A 11 11 ILE CB C 11 41.800 40.580 1.220 1
1 91 . 7 1 1 A 11 11 ILE N N 11 114.600 121.567 -6.967 1
1 92 . 7 1 1 A 12 12 PHE H H 12 8.520 8.823 -0.303 1
1 93 . 7 1 1 A 12 12 PHE HA H 12 5.540 5.314 0.226 1
1 96 . 7 1 1 A 12 12 PHE CA C 12 55.000 56.907 -1.907 1
1 97 . 7 1 1 A 12 12 PHE CB C 12 41.200 40.773 0.427 1
1 98 . 7 1 1 A 12 12 PHE N N 12 118.600 123.264 -4.664 1
1 99 . 7 1 1 A 13 13 VAL H H 13 9.230 8.831 0.399 1
1 100 . 7 1 1 A 13 13 VAL HA H 13 4.740 5.052 -0.312 1
1 108 . 7 1 1 A 13 13 VAL CA C 13 60.300 60.191 0.109 1
1 109 . 7 1 1 A 13 13 VAL CB C 13 34.100 35.536 -1.436 1
1 112 . 7 1 1 A 13 13 VAL N N 13 121.400 122.004 -0.604 1
1 113 . 7 1 1 A 14 14 LYS H H 14 8.910 8.134 0.776 1
1 114 . 7 1 1 A 14 14 LYS HA H 14 5.190 4.756 0.434 1
1 122 . 7 1 1 A 14 14 LYS CA C 14 54.600 54.536 0.064 1
1 123 . 7 1 1 A 14 14 LYS CB C 14 34.300 34.936 -0.636 1
1 126 . 7 1 1 A 14 14 LYS N N 14 128.000 126.099 1.901 1
1 127 . 7 1 1 A 15 15 THR H H 15 8.650 8.546 0.104 1
1 128 . 7 1 1 A 15 15 THR HA H 15 4.870 4.811 0.059 1
1 133 . 7 1 1 A 15 15 THR CA C 15 60.300 60.070 0.230 1
1 134 . 7 1 1 A 15 15 THR CB C 15 70.600 71.133 -0.533 1
1 136 . 7 1 1 A 15 15 THR N N 15 115.300 114.692 0.608 1
1 137 . 7 1 1 A 16 16 LEU H H 16 9.070 8.809 0.261 1
1 138 . 7 1 1 A 16 16 LEU HA H 16 4.210 4.032 0.178 1
1 148 . 7 1 1 A 16 16 LEU CA C 16 57.400 57.589 -0.189 1
1 149 . 7 1 1 A 16 16 LEU CB C 16 41.800 41.670 0.130 1
1 153 . 7 1 1 A 16 16 LEU N N 16 121.400 121.976 -0.576 1
1 154 . 7 1 1 A 17 17 THR H H 17 7.560 7.804 -0.244 1
1 155 . 7 1 1 A 17 17 THR HA H 17 4.330 4.295 0.035 1
1 160 . 7 1 1 A 17 17 THR CA C 17 61.400 63.473 -2.073 1
1 161 . 7 1 1 A 17 17 THR CB C 17 68.900 69.708 -0.808 1
1 163 . 7 1 1 A 17 17 THR N N 17 105.900 112.135 -6.235 1
1 164 . 7 1 1 A 18 18 GLY H H 18 7.750 7.781 -0.031 1
1 165 . 7 1 1 A 18 18 GLY HA2 H 18 4.250 4.004 0.246 1
1 166 . 7 1 1 A 18 18 GLY HA3 H 18 3.520 4.013 -0.493 1
1 167 . 7 1 1 A 18 18 GLY CA C 18 45.300 45.015 0.285 1
1 168 . 7 1 1 A 18 18 GLY N N 18 109.300 109.284 0.016 1
1 169 . 7 1 1 A 19 19 LYS H H 19 7.210 7.668 -0.458 1
1 170 . 7 1 1 A 19 19 LYS HA H 19 4.260 4.208 0.052 1
1 175 . 7 1 1 A 19 19 LYS CA C 19 56.300 56.795 -0.495 1
1 176 . 7 1 1 A 19 19 LYS CB C 19 33.200 33.931 -0.731 1
1 179 . 7 1 1 A 19 19 LYS N N 19 122.000 121.540 0.460 1
1 180 . 7 1 1 A 20 20 THR H H 20 8.570 8.568 0.002 1
1 181 . 7 1 1 A 20 20 THR HA H 20 4.950 5.414 -0.464 1
1 186 . 7 1 1 A 20 20 THR CA C 20 62.200 59.938 2.262 1
1 187 . 7 1 1 A 20 20 THR CB C 20 69.700 70.981 -1.281 1
1 189 . 7 1 1 A 20 20 THR N N 20 120.700 113.410 7.290 1
1 190 . 7 1 1 A 21 21 ILE H H 21 9.510 8.821 0.689 1
1 191 . 7 1 1 A 21 21 ILE HA H 21 4.390 4.833 -0.443 1
1 201 . 7 1 1 A 21 21 ILE CA C 21 60.000 59.056 0.944 1
1 202 . 7 1 1 A 21 21 ILE CB C 21 40.700 41.630 -0.930 1
1 206 . 7 1 1 A 21 21 ILE N N 21 128.200 122.180 6.020 1
1 207 . 7 1 1 A 22 22 THR H H 22 8.700 8.789 -0.089 1
1 208 . 7 1 1 A 22 22 THR HA H 22 4.860 4.453 0.407 1
1 213 . 7 1 1 A 22 22 THR CA C 22 62.100 62.831 -0.731 1
1 214 . 7 1 1 A 22 22 THR CB C 22 69.500 68.992 0.508 1
1 216 . 7 1 1 A 22 22 THR N N 22 122.300 121.575 0.725 1
1 217 . 7 1 1 A 23 23 LEU H H 23 8.720 8.925 -0.205 1
1 218 . 7 1 1 A 23 23 LEU HA H 23 4.690 5.104 -0.414 1
1 228 . 7 1 1 A 23 23 LEU CA C 23 52.700 53.280 -0.580 1
1 229 . 7 1 1 A 23 23 LEU CB C 23 46.600 45.171 1.429 1
1 233 . 7 1 1 A 23 23 LEU N N 23 125.400 127.715 -2.315 1
1 234 . 7 1 1 A 24 24 GLU H H 24 8.080 8.769 -0.689 1
1 235 . 7 1 1 A 24 24 GLU HA H 24 4.800 5.012 -0.212 1
1 238 . 7 1 1 A 24 24 GLU CA C 24 55.400 55.312 0.088 1
1 239 . 7 1 1 A 24 24 GLU CB C 24 30.100 31.880 -1.780 1
1 241 . 7 1 1 A 24 24 GLU N N 24 121.800 122.222 -0.422 1
1 242 . 7 1 1 A 25 25 VAL H H 25 8.800 8.697 0.103 1
1 243 . 7 1 1 A 25 25 VAL HA H 25 4.640 4.972 -0.332 1
1 251 . 7 1 1 A 25 25 VAL CA C 25 58.600 60.404 -1.804 1
1 252 . 7 1 1 A 25 25 VAL CB C 25 36.300 35.172 1.128 1
1 255 . 7 1 1 A 25 25 VAL N N 25 116.700 125.460 -8.760 1
1 256 . 7 1 1 A 26 26 GLU H H 26 8.500 8.283 0.217 1
1 257 . 7 1 1 A 26 26 GLU HA H 26 4.900 4.575 0.325 1
1 260 . 7 1 1 A 26 26 GLU CA C 26 53.000 54.616 -1.616 1
1 261 . 7 1 1 A 26 26 GLU CB C 26 31.200 33.253 -2.053 1
1 262 . 7 1 1 A 26 26 GLU N N 26 117.900 124.884 -6.984 1
1 263 . 7 1 1 A 27 27 PRO HA H 27 4.040 4.433 -0.393 1
1 270 . 7 1 1 A 27 27 PRO CA C 27 65.400 64.388 1.012 1
1 271 . 7 1 1 A 27 27 PRO CB C 27 31.700 31.805 -0.105 1
1 274 . 7 1 1 A 28 28 SER H H 28 7.010 8.097 -1.087 1
1 275 . 7 1 1 A 28 28 SER HA H 28 4.280 4.450 -0.170 1
1 278 . 7 1 1 A 28 28 SER CA C 28 57.400 58.142 -0.742 1
1 279 . 7 1 1 A 28 28 SER CB C 28 63.400 64.467 -1.067 1
1 280 . 7 1 1 A 28 28 SER N N 28 103.800 110.367 -6.567 1
1 281 . 7 1 1 A 29 29 ASP H H 29 7.960 7.915 0.045 1
1 282 . 7 1 1 A 29 29 ASP HA H 29 4.600 5.076 -0.476 1
1 285 . 7 1 1 A 29 29 ASP CA C 29 55.900 53.061 2.839 1
1 286 . 7 1 1 A 29 29 ASP CB C 29 41.000 43.119 -2.119 1
1 287 . 7 1 1 A 29 29 ASP N N 29 123.700 121.539 2.161 1
1 288 . 7 1 1 A 30 30 THR H H 30 7.780 8.650 -0.870 1
1 289 . 7 1 1 A 30 30 THR HA H 30 4.850 4.721 0.129 1
1 294 . 7 1 1 A 30 30 THR CA C 30 59.400 60.135 -0.735 1
1 295 . 7 1 1 A 30 30 THR CB C 30 71.100 71.306 -0.206 1
1 297 . 7 1 1 A 30 30 THR N N 30 108.800 117.264 -8.464 1
1 298 . 7 1 1 A 31 31 ILE H H 31 8.320 9.067 -0.747 1
1 299 . 7 1 1 A 31 31 ILE HA H 31 3.580 3.763 -0.183 1
1 309 . 7 1 1 A 31 31 ILE CA C 31 62.200 64.866 -2.666 1
1 310 . 7 1 1 A 31 31 ILE CB C 31 34.300 37.582 -3.282 1
1 314 . 7 1 1 A 31 31 ILE N N 31 121.300 127.102 -5.802 1
1 315 . 7 1 1 A 32 32 GLU H H 32 9.850 8.483 1.367 1
1 316 . 7 1 1 A 32 32 GLU HA H 32 3.780 3.968 -0.188 1
1 321 . 7 1 1 A 32 32 GLU CA C 32 60.500 59.753 0.747 1
1 322 . 7 1 1 A 32 32 GLU CB C 32 28.800 29.146 -0.346 1
1 324 . 7 1 1 A 32 32 GLU N N 32 121.600 121.592 0.008 1
1 325 . 7 1 1 A 33 33 ASN H H 33 7.810 7.589 0.221 1
1 326 . 7 1 1 A 33 33 ASN HA H 33 4.440 4.646 -0.206 1
1 329 . 7 1 1 A 33 33 ASN CA C 33 55.800 55.981 -0.181 1
1 330 . 7 1 1 A 33 33 ASN CB C 33 38.100 38.788 -0.688 1
1 331 . 7 1 1 A 33 33 ASN N N 33 121.000 118.249 2.751 1
1 332 . 7 1 1 A 34 34 VAL H H 34 8.000 8.152 -0.152 1
1 333 . 7 1 1 A 34 34 VAL HA H 34 3.300 3.582 -0.282 1
1 341 . 7 1 1 A 34 34 VAL CA C 34 67.600 66.650 0.950 1
1 342 . 7 1 1 A 34 34 VAL CB C 34 30.700 31.651 -0.951 1
1 345 . 7 1 1 A 34 34 VAL N N 34 122.200 120.452 1.748 1
1 346 . 7 1 1 A 35 35 LYS H H 35 8.490 8.621 -0.131 1
1 347 . 7 1 1 A 35 35 LYS HA H 35 4.500 4.072 0.428 1
1 352 . 7 1 1 A 35 35 LYS CA C 35 59.300 58.682 0.618 1
1 353 . 7 1 1 A 35 35 LYS CB C 35 33.500 31.970 1.530 1
1 354 . 7 1 1 A 35 35 LYS N N 35 119.200 120.350 -1.150 1
1 355 . 7 1 1 A 36 36 ALA H H 36 7.880 8.358 -0.478 1
1 356 . 7 1 1 A 36 36 ALA HA H 36 4.060 4.044 0.016 1
1 360 . 7 1 1 A 36 36 ALA CA C 36 55.300 54.853 0.447 1
1 361 . 7 1 1 A 36 36 ALA CB C 36 17.600 18.077 -0.477 1
1 362 . 7 1 1 A 36 36 ALA N N 36 123.300 121.788 1.512 1
1 363 . 7 1 1 A 37 37 LYS H H 37 7.790 7.965 -0.175 1
1 364 . 7 1 1 A 37 37 LYS HA H 37 4.110 4.104 0.006 1
1 373 . 7 1 1 A 37 37 LYS CA C 37 59.700 59.293 0.407 1
1 374 . 7 1 1 A 37 37 LYS CB C 37 33.100 32.373 0.727 1
1 378 . 7 1 1 A 37 37 LYS N N 37 120.400 116.879 3.521 1
1 379 . 7 1 1 A 38 38 ILE H H 38 8.240 7.841 0.399 1
1 380 . 7 1 1 A 38 38 ILE HA H 38 3.410 3.937 -0.527 1
1 390 . 7 1 1 A 38 38 ILE CA C 38 66.200 62.871 3.329 1
1 391 . 7 1 1 A 38 38 ILE CB C 38 36.800 37.691 -0.891 1
1 395 . 7 1 1 A 38 38 ILE N N 38 121.400 120.230 1.170 1
1 396 . 7 1 1 A 39 39 GLN H H 39 8.460 8.695 -0.235 1
1 397 . 7 1 1 A 39 39 GLN HA H 39 3.730 3.992 -0.262 1
1 402 . 7 1 1 A 39 39 GLN CA C 39 60.000 58.464 1.536 1
1 403 . 7 1 1 A 39 39 GLN CB C 39 27.600 28.570 -0.970 1
1 405 . 7 1 1 A 39 39 GLN N N 39 123.500 121.095 2.405 1
1 406 . 7 1 1 A 40 40 ASP H H 40 7.970 7.986 -0.016 1
1 407 . 7 1 1 A 40 40 ASP HA H 40 4.240 4.462 -0.222 1
1 410 . 7 1 1 A 40 40 ASP CA C 40 57.400 56.648 0.752 1
1 411 . 7 1 1 A 40 40 ASP CB C 40 41.000 40.406 0.594 1
1 412 . 7 1 1 A 40 40 ASP N N 40 119.900 118.316 1.584 1
1 413 . 7 1 1 A 41 41 LYS H H 41 7.420 7.936 -0.516 1
1 414 . 7 1 1 A 41 41 LYS HA H 41 4.200 4.126 0.074 1
1 423 . 7 1 1 A 41 41 LYS CA C 41 58.200 59.038 -0.838 1
1 424 . 7 1 1 A 41 41 LYS CB C 41 33.900 32.951 0.949 1
1 427 . 7 1 1 A 41 41 LYS N N 41 115.700 120.579 -4.879 1
1 428 . 7 1 1 A 42 42 GLU H H 42 8.650 7.875 0.775 1
1 429 . 7 1 1 A 42 42 GLU HA H 42 4.470 4.474 -0.004 1
1 434 . 7 1 1 A 42 42 GLU CA C 42 55.300 55.994 -0.694 1
1 435 . 7 1 1 A 42 42 GLU CB C 42 33.200 31.998 1.202 1
1 437 . 7 1 1 A 42 42 GLU N N 42 114.200 115.304 -1.104 1
1 438 . 7 1 1 A 43 43 GLY H H 43 8.400 7.841 0.559 1
1 439 . 7 1 1 A 43 43 GLY HA2 H 43 4.040 3.954 0.086 1
1 440 . 7 1 1 A 43 43 GLY HA3 H 43 3.820 3.955 -0.135 1
1 441 . 7 1 1 A 43 43 GLY CA C 43 45.900 45.533 0.367 1
1 442 . 7 1 1 A 43 43 GLY N N 43 109.000 108.487 0.513 1
1 443 . 7 1 1 A 44 44 ILE H H 44 6.080 7.671 -1.591 1
1 444 . 7 1 1 A 44 44 ILE HA H 44 4.290 4.145 0.145 1
1 446 . 7 1 1 A 44 44 ILE CA C 44 57.700 59.247 -1.547 1
1 447 . 7 1 1 A 44 44 ILE CB C 44 40.400 38.601 1.799 1
1 448 . 7 1 1 A 44 44 ILE N N 44 120.500 121.648 -1.148 1
1 449 . 7 1 1 A 46 46 PRO HA H 46 4.030 4.266 -0.236 1
1 454 . 7 1 1 A 46 46 PRO CA C 46 66.100 65.107 0.993 1
1 455 . 7 1 1 A 46 46 PRO CB C 46 32.600 32.025 0.575 1
1 458 . 7 1 1 A 47 47 ASP H H 47 8.470 8.935 -0.465 1
1 459 . 7 1 1 A 47 47 ASP HA H 47 4.310 4.337 -0.027 1
1 462 . 7 1 1 A 47 47 ASP CA C 47 55.700 56.887 -1.187 1
1 463 . 7 1 1 A 47 47 ASP CB C 47 39.700 39.617 0.083 1
1 464 . 7 1 1 A 47 47 ASP N N 47 113.700 116.300 -2.600 1
1 465 . 7 1 1 A 48 48 GLN H H 48 7.720 7.642 0.078 1
1 466 . 7 1 1 A 48 48 GLN HA H 48 4.340 4.501 -0.161 1
1 471 . 7 1 1 A 48 48 GLN CA C 48 55.500 56.392 -0.892 1
1 472 . 7 1 1 A 48 48 GLN CB C 48 29.900 29.536 0.364 1
1 474 . 7 1 1 A 48 48 GLN N N 48 116.900 117.452 -0.552 1
1 475 . 7 1 1 A 49 49 GLN H H 49 7.410 7.695 -0.285 1
1 476 . 7 1 1 A 49 49 GLN HA H 49 4.110 4.091 0.019 1
1 481 . 7 1 1 A 49 49 GLN CA C 49 56.600 56.375 0.225 1
1 482 . 7 1 1 A 49 49 GLN CB C 49 31.300 29.277 2.023 1
1 484 . 7 1 1 A 49 49 GLN N N 49 118.000 120.037 -2.037 1
1 485 . 7 1 1 A 50 50 ARG H H 50 8.400 8.683 -0.283 1
1 486 . 7 1 1 A 50 50 ARG HA H 50 4.380 4.787 -0.407 1
1 491 . 7 1 1 A 50 50 ARG CA C 50 55.100 54.918 0.182 1
1 492 . 7 1 1 A 50 50 ARG CB C 50 31.600 32.625 -1.025 1
1 494 . 7 1 1 A 50 50 ARG N N 50 123.100 125.541 -2.441 1
1 495 . 7 1 1 A 51 51 LEU H H 51 8.710 9.020 -0.310 1
1 496 . 7 1 1 A 51 51 LEU HA H 51 5.300 5.234 0.066 1
1 506 . 7 1 1 A 51 51 LEU CA C 51 52.900 53.494 -0.594 1
1 507 . 7 1 1 A 51 51 LEU CB C 51 45.700 43.368 2.332 1
1 511 . 7 1 1 A 51 51 LEU N N 51 124.400 123.277 1.123 1
1 512 . 7 1 1 A 52 52 ILE H H 52 9.060 9.076 -0.016 1
1 513 . 7 1 1 A 52 52 ILE HA H 52 4.840 5.021 -0.181 1
1 523 . 7 1 1 A 52 52 ILE CA C 52 58.900 60.041 -1.141 1
1 524 . 7 1 1 A 52 52 ILE CB C 52 41.200 40.630 0.570 1
1 528 . 7 1 1 A 52 52 ILE N N 52 122.500 123.085 -0.585 1
1 529 . 7 1 1 A 53 53 PHE H H 53 8.730 9.380 -0.650 1
1 530 . 7 1 1 A 53 53 PHE HA H 53 5.100 4.764 0.336 1
1 535 . 7 1 1 A 53 53 PHE CA C 53 56.300 57.359 -1.059 1
1 536 . 7 1 1 A 53 53 PHE CB C 53 43.500 41.675 1.825 1
1 537 . 7 1 1 A 53 53 PHE N N 53 124.800 127.857 -3.057 1
1 538 . 7 1 1 A 54 54 ALA H H 54 8.940 9.080 -0.140 1
1 539 . 7 1 1 A 54 54 ALA HA H 54 3.610 3.876 -0.266 1
1 543 . 7 1 1 A 54 54 ALA CA C 54 52.500 53.013 -0.513 1
1 544 . 7 1 1 A 54 54 ALA CB C 54 16.300 17.476 -1.176 1
1 545 . 7 1 1 A 54 54 ALA N N 54 133.100 130.243 2.857 1
1 546 . 7 1 1 A 55 55 GLY H H 55 8.070 8.279 -0.209 1
1 547 . 7 1 1 A 55 55 GLY HA2 H 55 4.000 3.793 0.207 1
1 548 . 7 1 1 A 55 55 GLY HA3 H 55 3.340 3.820 -0.480 1
1 549 . 7 1 1 A 55 55 GLY CA C 55 45.200 45.080 0.120 1
1 550 . 7 1 1 A 55 55 GLY N N 55 102.500 102.471 0.029 1
1 551 . 7 1 1 A 56 56 LYS H H 56 7.860 7.925 -0.065 1
1 552 . 7 1 1 A 56 56 LYS HA H 56 4.510 4.563 -0.053 1
1 558 . 7 1 1 A 56 56 LYS CA C 56 54.500 54.683 -0.183 1
1 559 . 7 1 1 A 56 56 LYS CB C 56 34.400 33.871 0.529 1
1 561 . 7 1 1 A 56 56 LYS N N 56 121.800 121.942 -0.142 1
1 562 . 7 1 1 A 57 57 GLN H H 57 8.600 8.380 0.220 1
1 563 . 7 1 1 A 57 57 GLN HA H 57 4.410 4.731 -0.321 1
1 568 . 7 1 1 A 57 57 GLN CA C 57 55.900 55.472 0.428 1
1 569 . 7 1 1 A 57 57 GLN CB C 57 28.800 29.610 -0.810 1
1 571 . 7 1 1 A 57 57 GLN N N 57 123.200 124.296 -1.096 1
1 572 . 7 1 1 A 58 58 LEU H H 58 8.480 8.416 0.064 1
1 573 . 7 1 1 A 58 58 LEU HA H 58 4.060 4.811 -0.751 1
1 583 . 7 1 1 A 58 58 LEU CA C 58 54.100 53.234 0.866 1
1 584 . 7 1 1 A 58 58 LEU CB C 58 41.500 44.497 -2.997 1
1 588 . 7 1 1 A 58 58 LEU N N 58 125.900 122.551 3.349 1
1 589 . 7 1 1 A 59 59 GLU H H 59 8.400 8.383 0.017 1
1 590 . 7 1 1 A 59 59 GLU HA H 59 4.400 4.884 -0.484 1
1 595 . 7 1 1 A 59 59 GLU CA C 59 55.900 55.050 0.850 1
1 596 . 7 1 1 A 59 59 GLU CB C 59 31.900 31.855 0.045 1
1 598 . 7 1 1 A 59 59 GLU N N 59 123.100 119.325 3.775 1
1 599 . 7 1 1 A 60 60 ASP H H 60 8.110 8.748 -0.638 1
1 600 . 7 1 1 A 60 60 ASP HA H 60 4.270 5.179 -0.909 1
1 603 . 7 1 1 A 60 60 ASP CA C 60 57.100 53.479 3.621 1
1 604 . 7 1 1 A 60 60 ASP CB C 60 40.800 44.798 -3.998 1
1 605 . 7 1 1 A 60 60 ASP N N 60 120.300 119.609 0.691 1
1 606 . 7 1 1 A 61 61 GLY HA2 H 61 4.000 4.027 -0.027 1
1 607 . 7 1 1 A 61 61 GLY HA3 H 61 3.830 4.036 -0.206 1
1 608 . 7 1 1 A 61 61 GLY CA C 61 45.000 45.058 -0.058 1
1 609 . 7 1 1 A 62 62 ARG H H 62 7.350 7.766 -0.416 1
1 610 . 7 1 1 A 62 62 ARG HA H 62 4.640 4.947 -0.307 1
1 615 . 7 1 1 A 62 62 ARG CA C 62 54.400 54.240 0.160 1
1 616 . 7 1 1 A 62 62 ARG CB C 62 32.600 33.824 -1.224 1
1 618 . 7 1 1 A 62 62 ARG N N 62 119.300 121.189 -1.889 1
1 619 . 7 1 1 A 63 63 THR H H 63 8.460 8.709 -0.249 1
1 620 . 7 1 1 A 63 63 THR HA H 63 5.060 4.825 0.235 1
1 625 . 7 1 1 A 63 63 THR CA C 63 59.700 60.432 -0.732 1
1 626 . 7 1 1 A 63 63 THR CB C 63 72.000 71.556 0.444 1
1 628 . 7 1 1 A 63 63 THR N N 63 109.100 114.512 -5.412 1
1 629 . 7 1 1 A 64 64 LEU H H 64 8.190 8.790 -0.600 1
1 630 . 7 1 1 A 64 64 LEU HA H 64 3.920 3.964 -0.044 1
1 640 . 7 1 1 A 64 64 LEU CA C 64 58.400 57.976 0.424 1
1 641 . 7 1 1 A 64 64 LEU CB C 64 40.200 41.314 -1.114 1
1 645 . 7 1 1 A 64 64 LEU N N 64 118.100 122.539 -4.439 1
1 646 . 7 1 1 A 65 65 SER H H 65 8.370 7.634 0.736 1
1 647 . 7 1 1 A 65 65 SER HA H 65 4.150 4.170 -0.020 1
1 650 . 7 1 1 A 65 65 SER CA C 65 60.900 60.281 0.619 1
1 651 . 7 1 1 A 65 65 SER CB C 65 62.500 63.601 -1.101 1
1 652 . 7 1 1 A 65 65 SER N N 65 112.200 114.533 -2.333 1
1 653 . 7 1 1 A 66 66 GLU H H 66 7.780 7.682 0.098 1
1 654 . 7 1 1 A 66 66 GLU HA H 66 3.890 4.125 -0.235 1
1 659 . 7 1 1 A 66 66 GLU CA C 66 59.200 58.875 0.325 1
1 660 . 7 1 1 A 66 66 GLU CB C 66 29.400 29.424 -0.024 1
1 662 . 7 1 1 A 66 66 GLU N N 66 123.600 121.980 1.620 1
1 663 . 7 1 1 A 67 67 TYR H H 67 7.290 7.393 -0.103 1
1 664 . 7 1 1 A 67 67 TYR HA H 67 4.590 4.589 0.001 1
1 669 . 7 1 1 A 67 67 TYR CA C 67 58.400 58.445 -0.045 1
1 670 . 7 1 1 A 67 67 TYR CB C 67 39.800 38.671 1.129 1
1 671 . 7 1 1 A 67 67 TYR N N 67 116.400 118.722 -2.322 1
1 672 . 7 1 1 A 68 68 ASN H H 68 8.040 7.882 0.158 1
1 673 . 7 1 1 A 68 68 ASN HA H 68 4.240 4.246 -0.006 1
1 676 . 7 1 1 A 68 68 ASN CA C 68 54.100 54.372 -0.272 1
1 677 . 7 1 1 A 68 68 ASN CB C 68 37.200 36.722 0.478 1
1 678 . 7 1 1 A 68 68 ASN N N 68 115.600 116.233 -0.633 1
1 679 . 7 1 1 A 69 69 ILE H H 69 7.200 7.440 -0.240 1
1 680 . 7 1 1 A 69 69 ILE HA H 69 3.280 4.816 -1.536 1
1 690 . 7 1 1 A 69 69 ILE CA C 69 59.800 58.908 0.892 1
1 691 . 7 1 1 A 69 69 ILE CB C 69 36.600 40.593 -3.993 1
1 695 . 7 1 1 A 69 69 ILE N N 69 119.100 114.022 5.078 1
1 696 . 7 1 1 A 70 70 GLN H H 70 7.570 8.240 -0.670 1
1 697 . 7 1 1 A 70 70 GLN HA H 70 4.410 4.425 -0.015 1
1 702 . 7 1 1 A 70 70 GLN CA C 70 53.500 55.336 -1.836 1
1 703 . 7 1 1 A 70 70 GLN CB C 70 31.500 27.628 3.872 1
1 705 . 7 1 1 A 70 70 GLN N N 70 124.800 121.803 2.997 1
1 706 . 7 1 1 A 71 71 LYS H H 71 8.370 7.649 0.721 1
1 707 . 7 1 1 A 71 71 LYS HA H 71 3.870 4.180 -0.310 1
1 716 . 7 1 1 A 71 71 LYS CA C 71 58.000 57.182 0.818 1
1 717 . 7 1 1 A 71 71 LYS CB C 71 32.500 32.478 0.022 1
1 720 . 7 1 1 A 71 71 LYS N N 71 120.200 121.691 -1.491 1
1 721 . 7 1 1 A 72 72 GLU H H 72 9.230 8.011 1.219 1
1 722 . 7 1 1 A 72 72 GLU HA H 72 3.240 4.462 -1.222 1
1 727 . 7 1 1 A 72 72 GLU CA C 72 58.300 55.634 2.666 1
1 728 . 7 1 1 A 72 72 GLU CB C 72 26.000 29.992 -3.992 1
1 730 . 7 1 1 A 72 72 GLU N N 72 115.100 119.983 -4.883 1
1 731 . 7 1 1 A 73 73 SER H H 73 7.690 7.895 -0.205 1
1 732 . 7 1 1 A 73 73 SER HA H 73 4.520 4.697 -0.177 1
1 735 . 7 1 1 A 73 73 SER CA C 73 61.100 58.991 2.109 1
1 736 . 7 1 1 A 73 73 SER CB C 73 64.800 64.348 0.452 1
1 737 . 7 1 1 A 73 73 SER N N 73 115.300 115.817 -0.517 1
1 738 . 7 1 1 A 74 74 THR H H 74 8.620 7.627 0.993 1
1 739 . 7 1 1 A 74 74 THR HA H 74 5.200 5.100 0.100 1
1 744 . 7 1 1 A 74 74 THR CA C 74 62.400 61.803 0.597 1
1 745 . 7 1 1 A 74 74 THR CB C 74 70.200 70.850 -0.650 1
1 747 . 7 1 1 A 74 74 THR N N 74 117.500 110.987 6.513 1
1 748 . 7 1 1 A 75 75 LEU H H 75 9.350 9.106 0.244 1
1 749 . 7 1 1 A 75 75 LEU HA H 75 4.990 4.994 -0.004 1
1 759 . 7 1 1 A 75 75 LEU CA C 75 53.800 53.463 0.337 1
1 760 . 7 1 1 A 75 75 LEU CB C 75 44.400 45.630 -1.230 1
1 764 . 7 1 1 A 75 75 LEU N N 75 128.000 127.142 0.858 1
1 765 . 7 1 1 A 76 76 HIS H H 76 9.140 8.434 0.706 1
1 766 . 7 1 1 A 76 76 HIS HA H 76 5.040 5.139 -0.099 1
1 769 . 7 1 1 A 76 76 HIS CA C 76 56.200 54.324 1.876 1
1 770 . 7 1 1 A 76 76 HIS CB C 76 32.500 31.064 1.436 1
1 771 . 7 1 1 A 76 76 HIS N N 76 119.600 123.081 -3.481 1
1 772 . 7 1 1 A 77 77 LEU H H 77 8.240 8.983 -0.743 1
1 773 . 7 1 1 A 77 77 LEU HA H 77 5.080 5.399 -0.319 1
1 783 . 7 1 1 A 77 77 LEU CA C 77 53.600 53.755 -0.155 1
1 784 . 7 1 1 A 77 77 LEU CB C 77 44.100 43.563 0.537 1
1 788 . 7 1 1 A 77 77 LEU N N 77 123.800 121.175 2.625 1
1 789 . 7 1 1 A 78 78 VAL H H 78 9.110 8.833 0.277 1
1 790 . 7 1 1 A 78 78 VAL HA H 78 4.260 4.646 -0.386 1
1 798 . 7 1 1 A 78 78 VAL CA C 78 60.400 60.884 -0.484 1
1 799 . 7 1 1 A 78 78 VAL CB C 78 34.700 35.745 -1.045 1
1 802 . 7 1 1 A 78 78 VAL N N 78 127.100 124.172 2.928 1
1 803 . 7 1 1 A 79 79 LEU H H 79 8.050 8.849 -0.799 1
1 804 . 7 1 1 A 79 79 LEU HA H 79 4.950 4.912 0.038 1
1 813 . 7 1 1 A 79 79 LEU CA C 79 53.800 53.197 0.603 1
1 814 . 7 1 1 A 79 79 LEU CB C 79 42.700 44.542 -1.842 1
1 818 . 7 1 1 A 79 79 LEU N N 79 123.400 128.791 -5.391 1
1 819 . 7 1 1 A 80 80 ARG H H 80 8.540 9.057 -0.517 1
1 820 . 7 1 1 A 80 80 ARG HA H 80 4.170 3.933 0.237 1
1 827 . 7 1 1 A 80 80 ARG CA C 80 55.800 56.891 -1.091 1
1 828 . 7 1 1 A 80 80 ARG CB C 80 31.100 28.858 2.242 1
1 830 . 7 1 1 A 80 80 ARG N N 80 123.500 126.411 -2.911 1
1 831 . 7 1 1 A 81 81 LEU H H 81 8.250 7.755 0.495 1
1 832 . 7 1 1 A 81 81 LEU HA H 81 4.270 4.275 -0.005 1
1 842 . 7 1 1 A 81 81 LEU CA C 81 55.000 54.459 0.541 1
1 843 . 7 1 1 A 81 81 LEU CB C 81 42.200 43.032 -0.832 1
1 847 . 7 1 1 A 81 81 LEU N N 81 124.100 120.592 3.508 1
1 848 . 7 1 1 A 82 82 ARG H H 82 8.310 8.276 0.034 1
1 849 . 7 1 1 A 82 82 ARG HA H 82 4.200 4.514 -0.314 1
1 852 . 7 1 1 A 82 82 ARG CA C 82 56.300 55.252 1.048 1
1 853 . 7 1 1 A 82 82 ARG CB C 82 30.700 32.675 -1.975 1
1 855 . 7 1 1 A 82 82 ARG N N 82 121.500 121.148 0.352 1
1 856 . 7 1 1 A 83 83 GLY H H 83 8.410 8.398 0.012 1
1 857 . 7 1 1 A 83 83 GLY HA2 H 83 3.750 3.729 0.021 1
1 858 . 7 1 1 A 83 83 GLY HA3 H 83 3.754 3.834 -0.080 1
1 859 . 7 1 1 A 83 83 GLY CA C 83 45.100 45.772 -0.672 1
1 860 . 7 1 1 A 83 83 GLY N N 83 110.200 113.979 -3.779 1
1 861 . 7 1 1 A 84 84 TYR H H 84 7.950 7.120 0.830 1
1 862 . 7 1 1 A 84 84 TYR HA H 84 4.400 4.561 -0.161 1
1 865 . 7 1 1 A 84 84 TYR CA C 84 58.100 58.193 -0.093 1
1 866 . 7 1 1 A 84 84 TYR CB C 84 38.800 39.538 -0.738 1
1 867 . 7 1 1 A 84 84 TYR N N 84 119.900 120.964 -1.064 1
1 868 . 7 1 1 A 85 85 ALA H H 85 8.150 8.601 -0.451 1
1 869 . 7 1 1 A 85 85 ALA HA H 85 4.150 4.038 0.112 1
1 873 . 7 1 1 A 85 85 ALA CA C 85 52.600 53.034 -0.434 1
1 874 . 7 1 1 A 85 85 ALA CB C 85 19.200 17.979 1.221 1
1 875 . 7 1 1 A 85 85 ALA N N 85 124.800 121.471 3.329 1
1 876 . 7 1 1 A 86 86 ASP H H 86 8.020 8.162 -0.142 1
1 877 . 7 1 1 A 86 86 ASP HA H 86 4.450 4.784 -0.334 1
1 880 . 7 1 1 A 86 86 ASP CA C 86 54.100 53.145 0.955 1
1 881 . 7 1 1 A 86 86 ASP CB C 86 41.100 41.402 -0.302 1
1 882 . 7 1 1 A 86 86 ASP N N 86 118.900 122.456 -3.556 1
1 883 . 7 1 1 A 87 87 LEU H H 87 8.010 8.499 -0.489 1
1 884 . 7 1 1 A 87 87 LEU HA H 87 4.210 4.263 -0.053 1
1 893 . 7 1 1 A 87 87 LEU CA C 87 55.300 55.737 -0.437 1
1 894 . 7 1 1 A 87 87 LEU CB C 87 42.000 42.322 -0.322 1
1 898 . 7 1 1 A 87 87 LEU N N 87 122.400 121.053 1.347 1
1 899 . 7 1 1 A 88 88 ARG H H 88 8.170 8.737 -0.567 1
1 900 . 7 1 1 A 88 88 ARG HA H 88 4.210 4.972 -0.762 1
1 903 . 7 1 1 A 88 88 ARG CA C 88 56.300 53.812 2.488 1
1 904 . 7 1 1 A 88 88 ARG CB C 88 30.600 33.057 -2.457 1
1 905 . 7 1 1 A 88 88 ARG N N 88 121.200 122.122 -0.922 1
1 906 . 7 1 1 A 91 91 PRO HA H 91 4.290 4.743 -0.453 1
1 911 . 7 1 1 A 91 91 PRO CA C 91 63.800 62.399 1.401 1
1 912 . 7 1 1 A 91 91 PRO CB C 91 32.100 29.425 2.675 1
1 915 . 7 1 1 A 92 92 ASP H H 92 8.280 8.457 -0.177 1
1 916 . 7 1 1 A 92 92 ASP HA H 92 4.540 4.921 -0.381 1
1 919 . 7 1 1 A 92 92 ASP CA C 92 54.600 53.651 0.949 1
1 920 . 7 1 1 A 92 92 ASP CB C 92 41.000 44.765 -3.765 1
1 921 . 7 1 1 A 92 92 ASP N N 92 118.700 123.370 -4.670 1
1 922 . 7 1 1 A 93 93 ARG H H 93 7.780 8.423 -0.643 1
1 923 . 7 1 1 A 93 93 ARG HA H 93 4.190 4.322 -0.132 1
1 930 . 7 1 1 A 93 93 ARG CA C 93 56.300 56.213 0.087 1
1 931 . 7 1 1 A 93 93 ARG CB C 93 30.700 31.248 -0.548 1
1 934 . 7 1 1 A 93 93 ARG N N 93 120.700 123.726 -3.026 1
1 935 . 7 1 1 A 94 94 GLN H H 94 8.280 8.527 -0.247 1
1 936 . 7 1 1 A 94 94 GLN HA H 94 4.210 4.258 -0.048 1
1 941 . 7 1 1 A 94 94 GLN CA C 94 55.800 56.534 -0.734 1
1 942 . 7 1 1 A 94 94 GLN CB C 94 29.300 28.908 0.392 1
1 944 . 7 1 1 A 94 94 GLN N N 94 121.000 120.497 0.503 1
1 945 . 7 1 1 A 95 95 ASP H H 95 8.270 8.788 -0.518 1
1 946 . 7 1 1 A 95 95 ASP HA H 95 4.450 5.244 -0.794 1
1 949 . 7 1 1 A 95 95 ASP CA C 95 54.300 54.087 0.213 1
1 950 . 7 1 1 A 95 95 ASP CB C 95 41.000 44.459 -3.459 1
1 951 . 7 1 1 A 95 95 ASP N N 95 121.000 123.438 -2.438 1
1 952 . 7 1 1 A 96 96 HIS H H 96 8.090 8.771 -0.681 1
1 953 . 7 1 1 A 96 96 HIS HA H 96 4.470 5.425 -0.955 1
1 956 . 7 1 1 A 96 96 HIS CA C 96 55.900 53.911 1.989 1
1 957 . 7 1 1 A 96 96 HIS CB C 96 30.500 32.618 -2.118 1
1 958 . 7 1 1 A 96 96 HIS N N 96 119.300 117.784 1.516 1
1 959 . 7 1 1 A 97 97 HIS H H 97 8.240 9.066 -0.826 1
1 960 . 7 1 1 A 97 97 HIS HA H 97 4.470 4.484 -0.014 1
1 963 . 7 1 1 A 97 97 HIS CA C 97 56.200 57.292 -1.092 1
1 964 . 7 1 1 A 97 97 HIS CB C 97 30.400 31.732 -1.332 1
1 965 . 7 1 1 A 97 97 HIS N N 97 121.300 117.781 3.519 1
1 966 . 7 1 1 A 98 98 PRO HA H 98 4.340 4.482 -0.142 1
1 973 . 7 1 1 A 98 98 PRO CA C 98 63.700 63.444 0.256 1
1 974 . 7 1 1 A 98 98 PRO CB C 98 31.900 32.961 -1.061 1
1 977 . 7 1 1 A 99 99 GLY H H 99 8.660 8.294 0.366 1
1 978 . 7 1 1 A 99 99 GLY HA2 H 99 3.920 4.212 -0.292 1
1 979 . 7 1 1 A 99 99 GLY HA3 H 99 3.920 4.222 -0.302 1
1 980 . 7 1 1 A 99 99 GLY CA C 99 45.200 45.520 -0.320 1
1 981 . 7 1 1 A 99 99 GLY N N 99 110.000 110.421 -0.421 1
1 982 . 7 1 1 A 100 100 SER H H 100 8.170 8.496 -0.326 1
1 983 . 7 1 1 A 100 100 SER HA H 100 4.360 4.910 -0.550 1
1 986 . 7 1 1 A 100 100 SER CA C 100 58.500 57.044 1.456 1
1 987 . 7 1 1 A 100 100 SER CB C 100 64.000 66.142 -2.142 1
1 988 . 7 1 1 A 100 100 SER N N 100 115.600 116.576 -0.976 1
1 989 . 7 1 1 A 101 101 GLY H H 101 8.420 8.597 -0.177 1
1 990 . 7 1 1 A 101 101 GLY HA2 H 101 3.890 4.262 -0.372 1
1 991 . 7 1 1 A 101 101 GLY HA3 H 101 3.920 4.263 -0.343 1
1 992 . 7 1 1 A 101 101 GLY CA C 101 45.200 44.230 0.970 1
1 993 . 7 1 1 A 101 101 GLY N N 101 111.000 112.004 -1.004 1
1 994 . 7 1 1 A 102 102 ALA H H 102 8.030 8.412 -0.382 1
1 995 . 7 1 1 A 102 102 ALA HA H 102 4.250 4.986 -0.736 1
1 999 . 7 1 1 A 102 102 ALA CA C 102 52.500 51.429 1.071 1
1 1000 . 7 1 1 A 102 102 ALA CB C 102 19.200 22.629 -3.429 1
1 4 . 8 1 1 A 2 2 SER H H 2 8.160 8.660 -0.500 1
1 5 . 8 1 1 A 2 2 SER HA H 2 4.370 4.574 -0.204 1
1 9 . 8 1 1 A 2 2 SER CA C 2 58.300 60.723 -2.423 1
1 10 . 8 1 1 A 2 2 SER CB C 2 63.900 64.097 -0.197 1
1 11 . 8 1 1 A 2 2 SER N N 2 115.600 116.678 -1.078 1
1 12 . 8 1 1 A 3 3 LEU H H 3 8.250 7.519 0.731 1
1 13 . 8 1 1 A 3 3 LEU HA H 3 4.280 4.770 -0.490 1
1 17 . 8 1 1 A 3 3 LEU CA C 3 55.200 53.044 2.156 1
1 18 . 8 1 1 A 3 3 LEU CB C 3 42.100 44.011 -1.911 1
1 19 . 8 1 1 A 3 3 LEU N N 3 124.100 117.103 6.997 1
1 20 . 8 1 1 A 4 4 VAL H H 4 7.950 8.392 -0.442 1
1 21 . 8 1 1 A 4 4 VAL HA H 4 4.680 4.346 0.334 1
1 26 . 8 1 1 A 4 4 VAL CA C 4 59.800 59.961 -0.161 1
1 27 . 8 1 1 A 4 4 VAL CB C 4 32.500 32.856 -0.356 1
1 28 . 8 1 1 A 4 4 VAL N N 4 122.600 122.062 0.538 1
1 29 . 8 1 1 A 5 5 PRO CA C 5 63.100 62.596 0.504 1
1 30 . 8 1 1 A 5 5 PRO CB C 5 32.000 31.657 0.343 1
1 32 . 8 1 1 A 6 6 ARG H H 6 8.360 8.622 -0.262 1
1 33 . 8 1 1 A 6 6 ARG HA H 6 4.250 4.921 -0.671 1
1 36 . 8 1 1 A 6 6 ARG CA C 6 56.000 54.906 1.094 1
1 37 . 8 1 1 A 6 6 ARG CB C 6 30.900 32.001 -1.101 1
1 38 . 8 1 1 A 6 6 ARG N N 6 121.800 123.954 -2.154 1
1 39 . 8 1 1 A 7 7 GLY H H 7 8.460 8.254 0.206 1
1 40 . 8 1 1 A 7 7 GLY HA2 H 7 3.940 4.287 -0.347 1
1 41 . 8 1 1 A 7 7 GLY HA3 H 7 3.760 4.287 -0.527 1
1 42 . 8 1 1 A 7 7 GLY CA C 7 45.000 45.508 -0.508 1
1 43 . 8 1 1 A 7 7 GLY N N 7 110.700 113.661 -2.961 1
1 44 . 8 1 1 A 8 8 SER H H 8 7.990 8.685 -0.695 1
1 45 . 8 1 1 A 8 8 SER HA H 8 4.450 4.593 -0.143 1
1 48 . 8 1 1 A 8 8 SER CA C 8 58.900 59.225 -0.325 1
1 49 . 8 1 1 A 8 8 SER CB C 8 64.200 64.761 -0.561 1
1 50 . 8 1 1 A 8 8 SER N N 8 115.500 114.792 0.708 1
1 51 . 8 1 1 A 9 9 MET H H 9 9.040 7.573 1.467 1
1 52 . 8 1 1 A 9 9 MET HA H 9 4.610 5.062 -0.452 1
1 60 . 8 1 1 A 9 9 MET CA C 9 54.400 53.459 0.941 1
1 61 . 8 1 1 A 9 9 MET CB C 9 35.400 33.985 1.415 1
1 64 . 8 1 1 A 9 9 MET N N 9 120.500 119.485 1.015 1
1 65 . 8 1 1 A 10 10 GLN H H 10 8.270 8.944 -0.674 1
1 66 . 8 1 1 A 10 10 GLN HA H 10 5.270 5.322 -0.052 1
1 71 . 8 1 1 A 10 10 GLN CA C 10 54.200 54.391 -0.191 1
1 72 . 8 1 1 A 10 10 GLN CB C 10 30.500 32.389 -1.889 1
1 74 . 8 1 1 A 10 10 GLN N N 10 121.000 122.543 -1.543 1
1 75 . 8 1 1 A 11 11 ILE H H 11 8.270 8.779 -0.509 1
1 76 . 8 1 1 A 11 11 ILE HA H 11 4.100 4.787 -0.687 1
1 86 . 8 1 1 A 11 11 ILE CA C 11 59.400 59.306 0.094 1
1 87 . 8 1 1 A 11 11 ILE CB C 11 41.800 40.517 1.283 1
1 91 . 8 1 1 A 11 11 ILE N N 11 114.600 121.393 -6.793 1
1 92 . 8 1 1 A 12 12 PHE H H 12 8.520 8.868 -0.348 1
1 93 . 8 1 1 A 12 12 PHE HA H 12 5.540 5.391 0.149 1
1 96 . 8 1 1 A 12 12 PHE CA C 12 55.000 56.421 -1.421 1
1 97 . 8 1 1 A 12 12 PHE CB C 12 41.200 41.049 0.151 1
1 98 . 8 1 1 A 12 12 PHE N N 12 118.600 123.358 -4.758 1
1 99 . 8 1 1 A 13 13 VAL H H 13 9.230 8.868 0.362 1
1 100 . 8 1 1 A 13 13 VAL HA H 13 4.740 5.101 -0.361 1
1 108 . 8 1 1 A 13 13 VAL CA C 13 60.300 60.566 -0.266 1
1 109 . 8 1 1 A 13 13 VAL CB C 13 34.100 35.083 -0.983 1
1 112 . 8 1 1 A 13 13 VAL N N 13 121.400 124.677 -3.277 1
1 113 . 8 1 1 A 14 14 LYS H H 14 8.910 9.152 -0.242 1
1 114 . 8 1 1 A 14 14 LYS HA H 14 5.190 4.963 0.227 1
1 122 . 8 1 1 A 14 14 LYS CA C 14 54.600 55.089 -0.489 1
1 123 . 8 1 1 A 14 14 LYS CB C 14 34.300 34.939 -0.639 1
1 126 . 8 1 1 A 14 14 LYS N N 14 128.000 126.622 1.378 1
1 127 . 8 1 1 A 15 15 THR H H 15 8.650 8.946 -0.296 1
1 128 . 8 1 1 A 15 15 THR HA H 15 4.870 4.695 0.175 1
1 133 . 8 1 1 A 15 15 THR CA C 15 60.300 60.811 -0.511 1
1 134 . 8 1 1 A 15 15 THR CB C 15 70.600 71.478 -0.878 1
1 136 . 8 1 1 A 15 15 THR N N 15 115.300 117.222 -1.922 1
1 137 . 8 1 1 A 16 16 LEU H H 16 9.070 8.829 0.241 1
1 138 . 8 1 1 A 16 16 LEU HA H 16 4.210 3.990 0.220 1
1 148 . 8 1 1 A 16 16 LEU CA C 16 57.400 57.759 -0.359 1
1 149 . 8 1 1 A 16 16 LEU CB C 16 41.800 41.546 0.254 1
1 153 . 8 1 1 A 16 16 LEU N N 16 121.400 122.341 -0.941 1
1 154 . 8 1 1 A 17 17 THR H H 17 7.560 7.821 -0.261 1
1 155 . 8 1 1 A 17 17 THR HA H 17 4.330 4.352 -0.022 1
1 160 . 8 1 1 A 17 17 THR CA C 17 61.400 62.962 -1.562 1
1 161 . 8 1 1 A 17 17 THR CB C 17 68.900 69.308 -0.408 1
1 163 . 8 1 1 A 17 17 THR N N 17 105.900 111.546 -5.646 1
1 164 . 8 1 1 A 18 18 GLY H H 18 7.750 7.691 0.059 1
1 165 . 8 1 1 A 18 18 GLY HA2 H 18 4.250 4.010 0.240 1
1 166 . 8 1 1 A 18 18 GLY HA3 H 18 3.520 4.014 -0.494 1
1 167 . 8 1 1 A 18 18 GLY CA C 18 45.300 45.033 0.267 1
1 168 . 8 1 1 A 18 18 GLY N N 18 109.300 109.706 -0.406 1
1 169 . 8 1 1 A 19 19 LYS H H 19 7.210 7.875 -0.665 1
1 170 . 8 1 1 A 19 19 LYS HA H 19 4.260 4.388 -0.128 1
1 175 . 8 1 1 A 19 19 LYS CA C 19 56.300 56.318 -0.018 1
1 176 . 8 1 1 A 19 19 LYS CB C 19 33.200 33.859 -0.659 1
1 179 . 8 1 1 A 19 19 LYS N N 19 122.000 120.048 1.952 1
1 180 . 8 1 1 A 20 20 THR H H 20 8.570 8.875 -0.305 1
1 181 . 8 1 1 A 20 20 THR HA H 20 4.950 5.605 -0.655 1
1 186 . 8 1 1 A 20 20 THR CA C 20 62.200 60.411 1.789 1
1 187 . 8 1 1 A 20 20 THR CB C 20 69.700 70.628 -0.928 1
1 189 . 8 1 1 A 20 20 THR N N 20 120.700 113.174 7.526 1
1 190 . 8 1 1 A 21 21 ILE H H 21 9.510 8.428 1.082 1
1 191 . 8 1 1 A 21 21 ILE HA H 21 4.390 4.859 -0.469 1
1 201 . 8 1 1 A 21 21 ILE CA C 21 60.000 59.084 0.916 1
1 202 . 8 1 1 A 21 21 ILE CB C 21 40.700 41.514 -0.814 1
1 206 . 8 1 1 A 21 21 ILE N N 21 128.200 122.968 5.232 1
1 207 . 8 1 1 A 22 22 THR H H 22 8.700 8.712 -0.012 1
1 208 . 8 1 1 A 22 22 THR HA H 22 4.860 4.476 0.384 1
1 213 . 8 1 1 A 22 22 THR CA C 22 62.100 62.736 -0.636 1
1 214 . 8 1 1 A 22 22 THR CB C 22 69.500 68.913 0.587 1
1 216 . 8 1 1 A 22 22 THR N N 22 122.300 121.606 0.694 1
1 217 . 8 1 1 A 23 23 LEU H H 23 8.720 8.960 -0.240 1
1 218 . 8 1 1 A 23 23 LEU HA H 23 4.690 4.951 -0.261 1
1 228 . 8 1 1 A 23 23 LEU CA C 23 52.700 53.457 -0.757 1
1 229 . 8 1 1 A 23 23 LEU CB C 23 46.600 45.434 1.166 1
1 233 . 8 1 1 A 23 23 LEU N N 23 125.400 127.571 -2.171 1
1 234 . 8 1 1 A 24 24 GLU H H 24 8.080 8.599 -0.519 1
1 235 . 8 1 1 A 24 24 GLU HA H 24 4.800 4.980 -0.180 1
1 238 . 8 1 1 A 24 24 GLU CA C 24 55.400 55.285 0.115 1
1 239 . 8 1 1 A 24 24 GLU CB C 24 30.100 31.780 -1.680 1
1 241 . 8 1 1 A 24 24 GLU N N 24 121.800 118.735 3.065 1
1 242 . 8 1 1 A 25 25 VAL H H 25 8.800 8.747 0.053 1
1 243 . 8 1 1 A 25 25 VAL HA H 25 4.640 4.937 -0.297 1
1 251 . 8 1 1 A 25 25 VAL CA C 25 58.600 59.503 -0.903 1
1 252 . 8 1 1 A 25 25 VAL CB C 25 36.300 36.145 0.155 1
1 255 . 8 1 1 A 25 25 VAL N N 25 116.700 117.196 -0.496 1
1 256 . 8 1 1 A 26 26 GLU H H 26 8.500 8.439 0.061 1
1 257 . 8 1 1 A 26 26 GLU HA H 26 4.900 4.556 0.344 1
1 260 . 8 1 1 A 26 26 GLU CA C 26 53.000 53.788 -0.788 1
1 261 . 8 1 1 A 26 26 GLU CB C 26 31.200 33.957 -2.757 1
1 262 . 8 1 1 A 26 26 GLU N N 26 117.900 121.269 -3.369 1
1 263 . 8 1 1 A 27 27 PRO HA H 27 4.040 4.374 -0.334 1
1 270 . 8 1 1 A 27 27 PRO CA C 27 65.400 64.829 0.571 1
1 271 . 8 1 1 A 27 27 PRO CB C 27 31.700 31.985 -0.285 1
1 274 . 8 1 1 A 28 28 SER H H 28 7.010 8.226 -1.216 1
1 275 . 8 1 1 A 28 28 SER HA H 28 4.280 4.628 -0.348 1
1 278 . 8 1 1 A 28 28 SER CA C 28 57.400 58.780 -1.380 1
1 279 . 8 1 1 A 28 28 SER CB C 28 63.400 64.251 -0.851 1
1 280 . 8 1 1 A 28 28 SER N N 28 103.800 110.914 -7.114 1
1 281 . 8 1 1 A 29 29 ASP H H 29 7.960 7.732 0.228 1
1 282 . 8 1 1 A 29 29 ASP HA H 29 4.600 4.808 -0.208 1
1 285 . 8 1 1 A 29 29 ASP CA C 29 55.900 53.153 2.747 1
1 286 . 8 1 1 A 29 29 ASP CB C 29 41.000 41.748 -0.748 1
1 287 . 8 1 1 A 29 29 ASP N N 29 123.700 122.004 1.696 1
1 288 . 8 1 1 A 30 30 THR H H 30 7.780 8.469 -0.689 1
1 289 . 8 1 1 A 30 30 THR HA H 30 4.850 4.588 0.262 1
1 294 . 8 1 1 A 30 30 THR CA C 30 59.400 61.058 -1.658 1
1 295 . 8 1 1 A 30 30 THR CB C 30 71.100 70.449 0.651 1
1 297 . 8 1 1 A 30 30 THR N N 30 108.800 121.355 -12.555 1
1 298 . 8 1 1 A 31 31 ILE H H 31 8.320 8.906 -0.586 1
1 299 . 8 1 1 A 31 31 ILE HA H 31 3.580 3.714 -0.134 1
1 309 . 8 1 1 A 31 31 ILE CA C 31 62.200 64.814 -2.614 1
1 310 . 8 1 1 A 31 31 ILE CB C 31 34.300 37.550 -3.250 1
1 314 . 8 1 1 A 31 31 ILE N N 31 121.300 123.842 -2.542 1
1 315 . 8 1 1 A 32 32 GLU H H 32 9.850 8.347 1.503 1
1 316 . 8 1 1 A 32 32 GLU HA H 32 3.780 3.895 -0.115 1
1 321 . 8 1 1 A 32 32 GLU CA C 32 60.500 59.841 0.659 1
1 322 . 8 1 1 A 32 32 GLU CB C 32 28.800 29.291 -0.491 1
1 324 . 8 1 1 A 32 32 GLU N N 32 121.600 121.919 -0.319 1
1 325 . 8 1 1 A 33 33 ASN H H 33 7.810 7.636 0.174 1
1 326 . 8 1 1 A 33 33 ASN HA H 33 4.440 4.597 -0.157 1
1 329 . 8 1 1 A 33 33 ASN CA C 33 55.800 55.759 0.041 1
1 330 . 8 1 1 A 33 33 ASN CB C 33 38.100 38.635 -0.535 1
1 331 . 8 1 1 A 33 33 ASN N N 33 121.000 117.680 3.320 1
1 332 . 8 1 1 A 34 34 VAL H H 34 8.000 7.932 0.068 1
1 333 . 8 1 1 A 34 34 VAL HA H 34 3.300 3.867 -0.567 1
1 341 . 8 1 1 A 34 34 VAL CA C 34 67.600 66.511 1.089 1
1 342 . 8 1 1 A 34 34 VAL CB C 34 30.700 31.065 -0.365 1
1 345 . 8 1 1 A 34 34 VAL N N 34 122.200 120.658 1.542 1
1 346 . 8 1 1 A 35 35 LYS H H 35 8.490 8.001 0.489 1
1 347 . 8 1 1 A 35 35 LYS HA H 35 4.500 3.987 0.513 1
1 352 . 8 1 1 A 35 35 LYS CA C 35 59.300 59.313 -0.013 1
1 353 . 8 1 1 A 35 35 LYS CB C 35 33.500 32.267 1.233 1
1 354 . 8 1 1 A 35 35 LYS N N 35 119.200 119.781 -0.581 1
1 355 . 8 1 1 A 36 36 ALA H H 36 7.880 7.707 0.173 1
1 356 . 8 1 1 A 36 36 ALA HA H 36 4.060 4.098 -0.038 1
1 360 . 8 1 1 A 36 36 ALA CA C 36 55.300 54.775 0.525 1
1 361 . 8 1 1 A 36 36 ALA CB C 36 17.600 18.320 -0.720 1
1 362 . 8 1 1 A 36 36 ALA N N 36 123.300 122.015 1.285 1
1 363 . 8 1 1 A 37 37 LYS H H 37 7.790 7.616 0.174 1
1 364 . 8 1 1 A 37 37 LYS HA H 37 4.110 4.119 -0.009 1
1 373 . 8 1 1 A 37 37 LYS CA C 37 59.700 59.249 0.451 1
1 374 . 8 1 1 A 37 37 LYS CB C 37 33.100 32.421 0.679 1
1 378 . 8 1 1 A 37 37 LYS N N 37 120.400 117.132 3.268 1
1 379 . 8 1 1 A 38 38 ILE H H 38 8.240 8.501 -0.261 1
1 380 . 8 1 1 A 38 38 ILE HA H 38 3.410 3.824 -0.414 1
1 390 . 8 1 1 A 38 38 ILE CA C 38 66.200 63.488 2.712 1
1 391 . 8 1 1 A 38 38 ILE CB C 38 36.800 37.433 -0.633 1
1 395 . 8 1 1 A 38 38 ILE N N 38 121.400 120.057 1.343 1
1 396 . 8 1 1 A 39 39 GLN H H 39 8.460 8.290 0.170 1
1 397 . 8 1 1 A 39 39 GLN HA H 39 3.730 3.972 -0.242 1
1 402 . 8 1 1 A 39 39 GLN CA C 39 60.000 58.390 1.610 1
1 403 . 8 1 1 A 39 39 GLN CB C 39 27.600 27.825 -0.225 1
1 405 . 8 1 1 A 39 39 GLN N N 39 123.500 119.300 4.200 1
1 406 . 8 1 1 A 40 40 ASP H H 40 7.970 8.287 -0.317 1
1 407 . 8 1 1 A 40 40 ASP HA H 40 4.240 4.356 -0.116 1
1 410 . 8 1 1 A 40 40 ASP CA C 40 57.400 56.679 0.721 1
1 411 . 8 1 1 A 40 40 ASP CB C 40 41.000 41.174 -0.174 1
1 412 . 8 1 1 A 40 40 ASP N N 40 119.900 120.587 -0.687 1
1 413 . 8 1 1 A 41 41 LYS H H 41 7.420 7.570 -0.150 1
1 414 . 8 1 1 A 41 41 LYS HA H 41 4.200 4.083 0.117 1
1 423 . 8 1 1 A 41 41 LYS CA C 41 58.200 58.849 -0.649 1
1 424 . 8 1 1 A 41 41 LYS CB C 41 33.900 33.033 0.867 1
1 427 . 8 1 1 A 41 41 LYS N N 41 115.700 118.740 -3.040 1
1 428 . 8 1 1 A 42 42 GLU H H 42 8.650 7.675 0.975 1
1 429 . 8 1 1 A 42 42 GLU HA H 42 4.470 4.372 0.098 1
1 434 . 8 1 1 A 42 42 GLU CA C 42 55.300 55.943 -0.643 1
1 435 . 8 1 1 A 42 42 GLU CB C 42 33.200 31.970 1.230 1
1 437 . 8 1 1 A 42 42 GLU N N 42 114.200 115.392 -1.192 1
1 438 . 8 1 1 A 43 43 GLY H H 43 8.400 8.178 0.222 1
1 439 . 8 1 1 A 43 43 GLY HA2 H 43 4.040 3.914 0.126 1
1 440 . 8 1 1 A 43 43 GLY HA3 H 43 3.820 3.914 -0.094 1
1 441 . 8 1 1 A 43 43 GLY CA C 43 45.900 45.670 0.230 1
1 442 . 8 1 1 A 43 43 GLY N N 43 109.000 108.431 0.569 1
1 443 . 8 1 1 A 44 44 ILE H H 44 6.080 7.758 -1.678 1
1 444 . 8 1 1 A 44 44 ILE HA H 44 4.290 4.106 0.184 1
1 446 . 8 1 1 A 44 44 ILE CA C 44 57.700 59.515 -1.815 1
1 447 . 8 1 1 A 44 44 ILE CB C 44 40.400 38.589 1.811 1
1 448 . 8 1 1 A 44 44 ILE N N 44 120.500 121.474 -0.974 1
1 449 . 8 1 1 A 46 46 PRO HA H 46 4.030 4.318 -0.288 1
1 454 . 8 1 1 A 46 46 PRO CA C 46 66.100 65.079 1.021 1
1 455 . 8 1 1 A 46 46 PRO CB C 46 32.600 31.851 0.749 1
1 458 . 8 1 1 A 47 47 ASP H H 47 8.470 8.386 0.084 1
1 459 . 8 1 1 A 47 47 ASP HA H 47 4.310 4.423 -0.113 1
1 462 . 8 1 1 A 47 47 ASP CA C 47 55.700 56.800 -1.100 1
1 463 . 8 1 1 A 47 47 ASP CB C 47 39.700 40.579 -0.879 1
1 464 . 8 1 1 A 47 47 ASP N N 47 113.700 117.173 -3.473 1
1 465 . 8 1 1 A 48 48 GLN H H 48 7.720 7.497 0.223 1
1 466 . 8 1 1 A 48 48 GLN HA H 48 4.340 4.404 -0.064 1
1 471 . 8 1 1 A 48 48 GLN CA C 48 55.500 55.736 -0.236 1
1 472 . 8 1 1 A 48 48 GLN CB C 48 29.900 30.362 -0.462 1
1 474 . 8 1 1 A 48 48 GLN N N 48 116.900 115.596 1.304 1
1 475 . 8 1 1 A 49 49 GLN H H 49 7.410 7.868 -0.458 1
1 476 . 8 1 1 A 49 49 GLN HA H 49 4.110 4.076 0.034 1
1 481 . 8 1 1 A 49 49 GLN CA C 49 56.600 56.260 0.340 1
1 482 . 8 1 1 A 49 49 GLN CB C 49 31.300 29.401 1.899 1
1 484 . 8 1 1 A 49 49 GLN N N 49 118.000 120.886 -2.886 1
1 485 . 8 1 1 A 50 50 ARG H H 50 8.400 8.591 -0.191 1
1 486 . 8 1 1 A 50 50 ARG HA H 50 4.380 4.774 -0.394 1
1 491 . 8 1 1 A 50 50 ARG CA C 50 55.100 54.640 0.460 1
1 492 . 8 1 1 A 50 50 ARG CB C 50 31.600 32.700 -1.100 1
1 494 . 8 1 1 A 50 50 ARG N N 50 123.100 125.316 -2.216 1
1 495 . 8 1 1 A 51 51 LEU H H 51 8.710 8.545 0.165 1
1 496 . 8 1 1 A 51 51 LEU HA H 51 5.300 5.236 0.064 1
1 506 . 8 1 1 A 51 51 LEU CA C 51 52.900 53.409 -0.509 1
1 507 . 8 1 1 A 51 51 LEU CB C 51 45.700 45.327 0.373 1
1 511 . 8 1 1 A 51 51 LEU N N 51 124.400 120.172 4.228 1
1 512 . 8 1 1 A 52 52 ILE H H 52 9.060 9.142 -0.082 1
1 513 . 8 1 1 A 52 52 ILE HA H 52 4.840 5.079 -0.239 1
1 523 . 8 1 1 A 52 52 ILE CA C 52 58.900 60.071 -1.171 1
1 524 . 8 1 1 A 52 52 ILE CB C 52 41.200 40.917 0.283 1
1 528 . 8 1 1 A 52 52 ILE N N 52 122.500 124.098 -1.598 1
1 529 . 8 1 1 A 53 53 PHE H H 53 8.730 9.356 -0.626 1
1 530 . 8 1 1 A 53 53 PHE HA H 53 5.100 4.820 0.280 1
1 535 . 8 1 1 A 53 53 PHE CA C 53 56.300 57.490 -1.190 1
1 536 . 8 1 1 A 53 53 PHE CB C 53 43.500 41.658 1.842 1
1 537 . 8 1 1 A 53 53 PHE N N 53 124.800 127.915 -3.115 1
1 538 . 8 1 1 A 54 54 ALA H H 54 8.940 9.158 -0.218 1
1 539 . 8 1 1 A 54 54 ALA HA H 54 3.610 3.957 -0.347 1
1 543 . 8 1 1 A 54 54 ALA CA C 54 52.500 53.045 -0.545 1
1 544 . 8 1 1 A 54 54 ALA CB C 54 16.300 17.377 -1.077 1
1 545 . 8 1 1 A 54 54 ALA N N 54 133.100 130.318 2.782 1
1 546 . 8 1 1 A 55 55 GLY H H 55 8.070 8.438 -0.368 1
1 547 . 8 1 1 A 55 55 GLY HA2 H 55 4.000 3.832 0.168 1
1 548 . 8 1 1 A 55 55 GLY HA3 H 55 3.340 3.872 -0.532 1
1 549 . 8 1 1 A 55 55 GLY CA C 55 45.200 45.190 0.010 1
1 550 . 8 1 1 A 55 55 GLY N N 55 102.500 102.546 -0.046 1
1 551 . 8 1 1 A 56 56 LYS H H 56 7.860 7.812 0.048 1
1 552 . 8 1 1 A 56 56 LYS HA H 56 4.510 4.599 -0.089 1
1 558 . 8 1 1 A 56 56 LYS CA C 56 54.500 54.712 -0.212 1
1 559 . 8 1 1 A 56 56 LYS CB C 56 34.400 33.806 0.594 1
1 561 . 8 1 1 A 56 56 LYS N N 56 121.800 122.031 -0.231 1
1 562 . 8 1 1 A 57 57 GLN H H 57 8.600 8.547 0.053 1
1 563 . 8 1 1 A 57 57 GLN HA H 57 4.410 4.877 -0.467 1
1 568 . 8 1 1 A 57 57 GLN CA C 57 55.900 56.285 -0.385 1
1 569 . 8 1 1 A 57 57 GLN CB C 57 28.800 30.340 -1.540 1
1 571 . 8 1 1 A 57 57 GLN N N 57 123.200 126.135 -2.935 1
1 572 . 8 1 1 A 58 58 LEU H H 58 8.480 8.360 0.120 1
1 573 . 8 1 1 A 58 58 LEU HA H 58 4.060 4.900 -0.840 1
1 583 . 8 1 1 A 58 58 LEU CA C 58 54.100 53.574 0.526 1
1 584 . 8 1 1 A 58 58 LEU CB C 58 41.500 44.156 -2.656 1
1 588 . 8 1 1 A 58 58 LEU N N 58 125.900 117.862 8.038 1
1 589 . 8 1 1 A 59 59 GLU H H 59 8.400 8.507 -0.107 1
1 590 . 8 1 1 A 59 59 GLU HA H 59 4.400 4.874 -0.474 1
1 595 . 8 1 1 A 59 59 GLU CA C 59 55.900 54.994 0.906 1
1 596 . 8 1 1 A 59 59 GLU CB C 59 31.900 32.801 -0.901 1
1 598 . 8 1 1 A 59 59 GLU N N 59 123.100 117.942 5.158 1
1 599 . 8 1 1 A 60 60 ASP H H 60 8.110 8.561 -0.451 1
1 600 . 8 1 1 A 60 60 ASP HA H 60 4.270 5.140 -0.870 1
1 603 . 8 1 1 A 60 60 ASP CA C 60 57.100 52.712 4.388 1
1 604 . 8 1 1 A 60 60 ASP CB C 60 40.800 44.480 -3.680 1
1 605 . 8 1 1 A 60 60 ASP N N 60 120.300 120.118 0.182 1
1 606 . 8 1 1 A 61 61 GLY HA2 H 61 4.000 4.033 -0.033 1
1 607 . 8 1 1 A 61 61 GLY HA3 H 61 3.830 4.063 -0.233 1
1 608 . 8 1 1 A 61 61 GLY CA C 61 45.000 45.730 -0.730 1
1 609 . 8 1 1 A 62 62 ARG H H 62 7.350 7.992 -0.642 1
1 610 . 8 1 1 A 62 62 ARG HA H 62 4.640 4.604 0.036 1
1 615 . 8 1 1 A 62 62 ARG CA C 62 54.400 55.395 -0.995 1
1 616 . 8 1 1 A 62 62 ARG CB C 62 32.600 31.986 0.614 1
1 618 . 8 1 1 A 62 62 ARG N N 62 119.300 121.543 -2.243 1
1 619 . 8 1 1 A 63 63 THR H H 63 8.460 8.683 -0.223 1
1 620 . 8 1 1 A 63 63 THR HA H 63 5.060 4.604 0.456 1
1 625 . 8 1 1 A 63 63 THR CA C 63 59.700 60.756 -1.056 1
1 626 . 8 1 1 A 63 63 THR CB C 63 72.000 71.093 0.907 1
1 628 . 8 1 1 A 63 63 THR N N 63 109.100 112.649 -3.549 1
1 629 . 8 1 1 A 64 64 LEU H H 64 8.190 8.807 -0.617 1
1 630 . 8 1 1 A 64 64 LEU HA H 64 3.920 3.921 -0.001 1
1 640 . 8 1 1 A 64 64 LEU CA C 64 58.400 57.882 0.518 1
1 641 . 8 1 1 A 64 64 LEU CB C 64 40.200 41.228 -1.028 1
1 645 . 8 1 1 A 64 64 LEU N N 64 118.100 123.426 -5.326 1
1 646 . 8 1 1 A 65 65 SER H H 65 8.370 7.956 0.414 1
1 647 . 8 1 1 A 65 65 SER HA H 65 4.150 4.185 -0.035 1
1 650 . 8 1 1 A 65 65 SER CA C 65 60.900 60.879 0.021 1
1 651 . 8 1 1 A 65 65 SER CB C 65 62.500 62.978 -0.478 1
1 652 . 8 1 1 A 65 65 SER N N 65 112.200 114.489 -2.289 1
1 653 . 8 1 1 A 66 66 GLU H H 66 7.780 7.865 -0.085 1
1 654 . 8 1 1 A 66 66 GLU HA H 66 3.890 4.281 -0.391 1
1 659 . 8 1 1 A 66 66 GLU CA C 66 59.200 58.601 0.599 1
1 660 . 8 1 1 A 66 66 GLU CB C 66 29.400 29.401 -0.001 1
1 662 . 8 1 1 A 66 66 GLU N N 66 123.600 121.849 1.751 1
1 663 . 8 1 1 A 67 67 TYR H H 67 7.290 7.932 -0.642 1
1 664 . 8 1 1 A 67 67 TYR HA H 67 4.590 4.612 -0.022 1
1 669 . 8 1 1 A 67 67 TYR CA C 67 58.400 57.776 0.624 1
1 670 . 8 1 1 A 67 67 TYR CB C 67 39.800 38.549 1.251 1
1 671 . 8 1 1 A 67 67 TYR N N 67 116.400 117.524 -1.124 1
1 672 . 8 1 1 A 68 68 ASN H H 68 8.040 8.054 -0.014 1
1 673 . 8 1 1 A 68 68 ASN HA H 68 4.240 4.315 -0.075 1
1 676 . 8 1 1 A 68 68 ASN CA C 68 54.100 54.555 -0.455 1
1 677 . 8 1 1 A 68 68 ASN CB C 68 37.200 37.429 -0.229 1
1 678 . 8 1 1 A 68 68 ASN N N 68 115.600 115.053 0.547 1
1 679 . 8 1 1 A 69 69 ILE H H 69 7.200 7.376 -0.176 1
1 680 . 8 1 1 A 69 69 ILE HA H 69 3.280 4.388 -1.108 1
1 690 . 8 1 1 A 69 69 ILE CA C 69 59.800 59.701 0.099 1
1 691 . 8 1 1 A 69 69 ILE CB C 69 36.600 39.023 -2.423 1
1 695 . 8 1 1 A 69 69 ILE N N 69 119.100 115.046 4.054 1
1 696 . 8 1 1 A 70 70 GLN H H 70 7.570 8.413 -0.843 1
1 697 . 8 1 1 A 70 70 GLN HA H 70 4.410 4.429 -0.019 1
1 702 . 8 1 1 A 70 70 GLN CA C 70 53.500 55.302 -1.802 1
1 703 . 8 1 1 A 70 70 GLN CB C 70 31.500 28.174 3.326 1
1 705 . 8 1 1 A 70 70 GLN N N 70 124.800 120.852 3.948 1
1 706 . 8 1 1 A 71 71 LYS H H 71 8.370 7.419 0.951 1
1 707 . 8 1 1 A 71 71 LYS HA H 71 3.870 3.620 0.250 1
1 716 . 8 1 1 A 71 71 LYS CA C 71 58.000 58.210 -0.210 1
1 717 . 8 1 1 A 71 71 LYS CB C 71 32.500 32.168 0.332 1
1 720 . 8 1 1 A 71 71 LYS N N 71 120.200 120.506 -0.306 1
1 721 . 8 1 1 A 72 72 GLU H H 72 9.230 8.449 0.781 1
1 722 . 8 1 1 A 72 72 GLU HA H 72 3.240 4.143 -0.903 1
1 727 . 8 1 1 A 72 72 GLU CA C 72 58.300 56.672 1.628 1
1 728 . 8 1 1 A 72 72 GLU CB C 72 26.000 28.891 -2.891 1
1 730 . 8 1 1 A 72 72 GLU N N 72 115.100 116.190 -1.090 1
1 731 . 8 1 1 A 73 73 SER H H 73 7.690 8.420 -0.730 1
1 732 . 8 1 1 A 73 73 SER HA H 73 4.520 4.732 -0.212 1
1 735 . 8 1 1 A 73 73 SER CA C 73 61.100 59.236 1.864 1
1 736 . 8 1 1 A 73 73 SER CB C 73 64.800 64.243 0.557 1
1 737 . 8 1 1 A 73 73 SER N N 73 115.300 114.181 1.119 1
1 738 . 8 1 1 A 74 74 THR H H 74 8.620 7.895 0.725 1
1 739 . 8 1 1 A 74 74 THR HA H 74 5.200 5.030 0.170 1
1 744 . 8 1 1 A 74 74 THR CA C 74 62.400 61.731 0.669 1
1 745 . 8 1 1 A 74 74 THR CB C 74 70.200 70.814 -0.614 1
1 747 . 8 1 1 A 74 74 THR N N 74 117.500 112.349 5.151 1
1 748 . 8 1 1 A 75 75 LEU H H 75 9.350 8.980 0.370 1
1 749 . 8 1 1 A 75 75 LEU HA H 75 4.990 4.843 0.147 1
1 759 . 8 1 1 A 75 75 LEU CA C 75 53.800 53.746 0.054 1
1 760 . 8 1 1 A 75 75 LEU CB C 75 44.400 45.960 -1.560 1
1 764 . 8 1 1 A 75 75 LEU N N 75 128.000 127.013 0.987 1
1 765 . 8 1 1 A 76 76 HIS H H 76 9.140 8.508 0.632 1
1 766 . 8 1 1 A 76 76 HIS HA H 76 5.040 5.113 -0.073 1
1 769 . 8 1 1 A 76 76 HIS CA C 76 56.200 54.548 1.652 1
1 770 . 8 1 1 A 76 76 HIS CB C 76 32.500 31.982 0.518 1
1 771 . 8 1 1 A 76 76 HIS N N 76 119.600 120.585 -0.985 1
1 772 . 8 1 1 A 77 77 LEU H H 77 8.240 8.933 -0.693 1
1 773 . 8 1 1 A 77 77 LEU HA H 77 5.080 5.168 -0.088 1
1 783 . 8 1 1 A 77 77 LEU CA C 77 53.600 53.750 -0.150 1
1 784 . 8 1 1 A 77 77 LEU CB C 77 44.100 43.525 0.575 1
1 788 . 8 1 1 A 77 77 LEU N N 77 123.800 121.326 2.474 1
1 789 . 8 1 1 A 78 78 VAL H H 78 9.110 8.839 0.271 1
1 790 . 8 1 1 A 78 78 VAL HA H 78 4.260 4.649 -0.389 1
1 798 . 8 1 1 A 78 78 VAL CA C 78 60.400 61.253 -0.853 1
1 799 . 8 1 1 A 78 78 VAL CB C 78 34.700 35.332 -0.632 1
1 802 . 8 1 1 A 78 78 VAL N N 78 127.100 124.296 2.804 1
1 803 . 8 1 1 A 79 79 LEU H H 79 8.050 8.911 -0.861 1
1 804 . 8 1 1 A 79 79 LEU HA H 79 4.950 4.872 0.078 1
1 813 . 8 1 1 A 79 79 LEU CA C 79 53.800 53.193 0.607 1
1 814 . 8 1 1 A 79 79 LEU CB C 79 42.700 44.320 -1.620 1
1 818 . 8 1 1 A 79 79 LEU N N 79 123.400 129.102 -5.702 1
1 819 . 8 1 1 A 80 80 ARG H H 80 8.540 9.074 -0.534 1
1 820 . 8 1 1 A 80 80 ARG HA H 80 4.170 3.938 0.232 1
1 827 . 8 1 1 A 80 80 ARG CA C 80 55.800 56.948 -1.148 1
1 828 . 8 1 1 A 80 80 ARG CB C 80 31.100 28.798 2.302 1
1 830 . 8 1 1 A 80 80 ARG N N 80 123.500 126.364 -2.864 1
1 831 . 8 1 1 A 81 81 LEU H H 81 8.250 7.773 0.477 1
1 832 . 8 1 1 A 81 81 LEU HA H 81 4.270 4.342 -0.072 1
1 842 . 8 1 1 A 81 81 LEU CA C 81 55.000 54.961 0.039 1
1 843 . 8 1 1 A 81 81 LEU CB C 81 42.200 43.334 -1.134 1
1 847 . 8 1 1 A 81 81 LEU N N 81 124.100 117.964 6.136 1
1 848 . 8 1 1 A 82 82 ARG H H 82 8.310 8.598 -0.288 1
1 849 . 8 1 1 A 82 82 ARG HA H 82 4.200 4.599 -0.399 1
1 852 . 8 1 1 A 82 82 ARG CA C 82 56.300 55.275 1.025 1
1 853 . 8 1 1 A 82 82 ARG CB C 82 30.700 33.443 -2.743 1
1 855 . 8 1 1 A 82 82 ARG N N 82 121.500 119.230 2.270 1
1 856 . 8 1 1 A 83 83 GLY H H 83 8.410 8.597 -0.187 1
1 857 . 8 1 1 A 83 83 GLY HA2 H 83 3.750 4.060 -0.310 1
1 858 . 8 1 1 A 83 83 GLY HA3 H 83 3.754 4.078 -0.324 1
1 859 . 8 1 1 A 83 83 GLY CA C 83 45.100 45.033 0.067 1
1 860 . 8 1 1 A 83 83 GLY N N 83 110.200 109.290 0.910 1
1 861 . 8 1 1 A 84 84 TYR H H 84 7.950 8.656 -0.706 1
1 862 . 8 1 1 A 84 84 TYR HA H 84 4.400 4.819 -0.419 1
1 865 . 8 1 1 A 84 84 TYR CA C 84 58.100 57.154 0.946 1
1 866 . 8 1 1 A 84 84 TYR CB C 84 38.800 39.209 -0.409 1
1 867 . 8 1 1 A 84 84 TYR N N 84 119.900 120.895 -0.995 1
1 868 . 8 1 1 A 85 85 ALA H H 85 8.150 7.581 0.569 1
1 869 . 8 1 1 A 85 85 ALA HA H 85 4.150 4.491 -0.341 1
1 873 . 8 1 1 A 85 85 ALA CA C 85 52.600 51.883 0.717 1
1 874 . 8 1 1 A 85 85 ALA CB C 85 19.200 20.420 -1.220 1
1 875 . 8 1 1 A 85 85 ALA N N 85 124.800 123.999 0.801 1
1 876 . 8 1 1 A 86 86 ASP H H 86 8.020 8.694 -0.674 1
1 877 . 8 1 1 A 86 86 ASP HA H 86 4.450 4.974 -0.524 1
1 880 . 8 1 1 A 86 86 ASP CA C 86 54.100 52.939 1.161 1
1 881 . 8 1 1 A 86 86 ASP CB C 86 41.100 44.403 -3.303 1
1 882 . 8 1 1 A 86 86 ASP N N 86 118.900 116.896 2.004 1
1 883 . 8 1 1 A 87 87 LEU H H 87 8.010 8.172 -0.162 1
1 884 . 8 1 1 A 87 87 LEU HA H 87 4.210 3.820 0.390 1
1 893 . 8 1 1 A 87 87 LEU CA C 87 55.300 56.008 -0.708 1
1 894 . 8 1 1 A 87 87 LEU CB C 87 42.000 40.120 1.880 1
1 898 . 8 1 1 A 87 87 LEU N N 87 122.400 118.515 3.885 1
1 899 . 8 1 1 A 88 88 ARG H H 88 8.170 7.541 0.629 1
1 900 . 8 1 1 A 88 88 ARG HA H 88 4.210 4.498 -0.288 1
1 903 . 8 1 1 A 88 88 ARG CA C 88 56.300 55.605 0.695 1
1 904 . 8 1 1 A 88 88 ARG CB C 88 30.600 32.422 -1.822 1
1 905 . 8 1 1 A 88 88 ARG N N 88 121.200 118.364 2.836 1
1 906 . 8 1 1 A 91 91 PRO HA H 91 4.290 4.675 -0.385 1
1 911 . 8 1 1 A 91 91 PRO CA C 91 63.800 62.912 0.888 1
1 912 . 8 1 1 A 91 91 PRO CB C 91 32.100 33.077 -0.977 1
1 915 . 8 1 1 A 92 92 ASP H H 92 8.280 8.510 -0.230 1
1 916 . 8 1 1 A 92 92 ASP HA H 92 4.540 5.254 -0.714 1
1 919 . 8 1 1 A 92 92 ASP CA C 92 54.600 53.624 0.976 1
1 920 . 8 1 1 A 92 92 ASP CB C 92 41.000 43.456 -2.456 1
1 921 . 8 1 1 A 92 92 ASP N N 92 118.700 117.277 1.423 1
1 922 . 8 1 1 A 93 93 ARG H H 93 7.780 8.953 -1.173 1
1 923 . 8 1 1 A 93 93 ARG HA H 93 4.190 5.074 -0.884 1
1 930 . 8 1 1 A 93 93 ARG CA C 93 56.300 54.083 2.217 1
1 931 . 8 1 1 A 93 93 ARG CB C 93 30.700 33.240 -2.540 1
1 934 . 8 1 1 A 93 93 ARG N N 93 120.700 121.665 -0.965 1
1 935 . 8 1 1 A 94 94 GLN H H 94 8.280 8.631 -0.351 1
1 936 . 8 1 1 A 94 94 GLN HA H 94 4.210 5.243 -1.033 1
1 941 . 8 1 1 A 94 94 GLN CA C 94 55.800 53.607 2.193 1
1 942 . 8 1 1 A 94 94 GLN CB C 94 29.300 31.613 -2.313 1
1 944 . 8 1 1 A 94 94 GLN N N 94 121.000 116.991 4.009 1
1 945 . 8 1 1 A 95 95 ASP H H 95 8.270 8.733 -0.463 1
1 946 . 8 1 1 A 95 95 ASP HA H 95 4.450 5.130 -0.680 1
1 949 . 8 1 1 A 95 95 ASP CA C 95 54.300 53.696 0.604 1
1 950 . 8 1 1 A 95 95 ASP CB C 95 41.000 44.564 -3.564 1
1 951 . 8 1 1 A 95 95 ASP N N 95 121.000 119.406 1.594 1
1 952 . 8 1 1 A 96 96 HIS H H 96 8.090 8.566 -0.476 1
1 953 . 8 1 1 A 96 96 HIS HA H 96 4.470 5.290 -0.820 1
1 956 . 8 1 1 A 96 96 HIS CA C 96 55.900 54.835 1.065 1
1 957 . 8 1 1 A 96 96 HIS CB C 96 30.500 31.548 -1.048 1
1 958 . 8 1 1 A 96 96 HIS N N 96 119.300 116.683 2.617 1
1 959 . 8 1 1 A 97 97 HIS H H 97 8.240 8.868 -0.628 1
1 960 . 8 1 1 A 97 97 HIS HA H 97 4.470 4.845 -0.375 1
1 963 . 8 1 1 A 97 97 HIS CA C 97 56.200 54.885 1.315 1
1 964 . 8 1 1 A 97 97 HIS CB C 97 30.400 30.341 0.059 1
1 965 . 8 1 1 A 97 97 HIS N N 97 121.300 119.707 1.593 1
1 966 . 8 1 1 A 98 98 PRO HA H 98 4.340 4.548 -0.208 1
1 973 . 8 1 1 A 98 98 PRO CA C 98 63.700 62.807 0.893 1
1 974 . 8 1 1 A 98 98 PRO CB C 98 31.900 33.467 -1.567 1
1 977 . 8 1 1 A 99 99 GLY H H 99 8.660 8.161 0.499 1
1 978 . 8 1 1 A 99 99 GLY HA2 H 99 3.920 4.112 -0.192 1
1 979 . 8 1 1 A 99 99 GLY HA3 H 99 3.920 4.115 -0.195 1
1 980 . 8 1 1 A 99 99 GLY CA C 99 45.200 45.841 -0.641 1
1 981 . 8 1 1 A 99 99 GLY N N 99 110.000 108.169 1.831 1
1 982 . 8 1 1 A 100 100 SER H H 100 8.170 8.679 -0.509 1
1 983 . 8 1 1 A 100 100 SER HA H 100 4.360 4.090 0.270 1
1 986 . 8 1 1 A 100 100 SER CA C 100 58.500 59.086 -0.586 1
1 987 . 8 1 1 A 100 100 SER CB C 100 64.000 61.834 2.166 1
1 988 . 8 1 1 A 100 100 SER N N 100 115.600 116.795 -1.195 1
1 989 . 8 1 1 A 101 101 GLY H H 101 8.420 8.132 0.288 1
1 990 . 8 1 1 A 101 101 GLY HA2 H 101 3.890 4.123 -0.233 1
1 991 . 8 1 1 A 101 101 GLY HA3 H 101 3.920 4.126 -0.206 1
1 992 . 8 1 1 A 101 101 GLY CA C 101 45.200 44.937 0.263 1
1 993 . 8 1 1 A 101 101 GLY N N 101 111.000 107.795 3.205 1
1 994 . 8 1 1 A 102 102 ALA H H 102 8.030 8.612 -0.582 1
1 995 . 8 1 1 A 102 102 ALA HA H 102 4.250 4.731 -0.481 1
1 999 . 8 1 1 A 102 102 ALA CA C 102 52.500 51.238 1.262 1
1 1000 . 8 1 1 A 102 102 ALA CB C 102 19.200 22.747 -3.547 1
1 4 . 9 1 1 A 2 2 SER H H 2 8.160 8.492 -0.332 1
1 5 . 9 1 1 A 2 2 SER HA H 2 4.370 5.128 -0.758 1
1 9 . 9 1 1 A 2 2 SER CA C 2 58.300 57.516 0.784 1
1 10 . 9 1 1 A 2 2 SER CB C 2 63.900 64.950 -1.050 1
1 11 . 9 1 1 A 2 2 SER N N 2 115.600 116.692 -1.092 1
1 12 . 9 1 1 A 3 3 LEU H H 3 8.250 8.837 -0.587 1
1 13 . 9 1 1 A 3 3 LEU HA H 3 4.280 4.993 -0.713 1
1 17 . 9 1 1 A 3 3 LEU CA C 3 55.200 53.694 1.506 1
1 18 . 9 1 1 A 3 3 LEU CB C 3 42.100 44.397 -2.297 1
1 19 . 9 1 1 A 3 3 LEU N N 3 124.100 128.554 -4.454 1
1 20 . 9 1 1 A 4 4 VAL H H 4 7.950 8.703 -0.753 1
1 21 . 9 1 1 A 4 4 VAL HA H 4 4.680 4.934 -0.254 1
1 26 . 9 1 1 A 4 4 VAL CA C 4 59.800 58.092 1.708 1
1 27 . 9 1 1 A 4 4 VAL CB C 4 32.500 33.499 -0.999 1
1 28 . 9 1 1 A 4 4 VAL N N 4 122.600 120.348 2.252 1
1 29 . 9 1 1 A 5 5 PRO CA C 5 63.100 62.657 0.443 1
1 30 . 9 1 1 A 5 5 PRO CB C 5 32.000 33.471 -1.471 1
1 32 . 9 1 1 A 6 6 ARG H H 6 8.360 8.798 -0.438 1
1 33 . 9 1 1 A 6 6 ARG HA H 6 4.250 4.944 -0.694 1
1 36 . 9 1 1 A 6 6 ARG CA C 6 56.000 55.656 0.344 1
1 37 . 9 1 1 A 6 6 ARG CB C 6 30.900 33.750 -2.850 1
1 38 . 9 1 1 A 6 6 ARG N N 6 121.800 122.283 -0.483 1
1 39 . 9 1 1 A 7 7 GLY H H 7 8.460 8.587 -0.127 1
1 40 . 9 1 1 A 7 7 GLY HA2 H 7 3.940 4.302 -0.362 1
1 41 . 9 1 1 A 7 7 GLY HA3 H 7 3.760 4.305 -0.545 1
1 42 . 9 1 1 A 7 7 GLY CA C 7 45.000 45.263 -0.263 1
1 43 . 9 1 1 A 7 7 GLY N N 7 110.700 111.892 -1.192 1
1 44 . 9 1 1 A 8 8 SER H H 8 7.990 8.545 -0.555 1
1 45 . 9 1 1 A 8 8 SER HA H 8 4.450 4.382 0.068 1
1 48 . 9 1 1 A 8 8 SER CA C 8 58.900 58.950 -0.050 1
1 49 . 9 1 1 A 8 8 SER CB C 8 64.200 64.284 -0.084 1
1 50 . 9 1 1 A 8 8 SER N N 8 115.500 115.244 0.256 1
1 51 . 9 1 1 A 9 9 MET H H 9 9.040 7.573 1.467 1
1 52 . 9 1 1 A 9 9 MET HA H 9 4.610 5.112 -0.502 1
1 60 . 9 1 1 A 9 9 MET CA C 9 54.400 53.751 0.649 1
1 61 . 9 1 1 A 9 9 MET CB C 9 35.400 34.811 0.589 1
1 64 . 9 1 1 A 9 9 MET N N 9 120.500 119.147 1.353 1
1 65 . 9 1 1 A 10 10 GLN H H 10 8.270 8.993 -0.723 1
1 66 . 9 1 1 A 10 10 GLN HA H 10 5.270 5.293 -0.023 1
1 71 . 9 1 1 A 10 10 GLN CA C 10 54.200 54.463 -0.263 1
1 72 . 9 1 1 A 10 10 GLN CB C 10 30.500 32.282 -1.782 1
1 74 . 9 1 1 A 10 10 GLN N N 10 121.000 122.293 -1.293 1
1 75 . 9 1 1 A 11 11 ILE H H 11 8.270 8.831 -0.561 1
1 76 . 9 1 1 A 11 11 ILE HA H 11 4.100 4.864 -0.764 1
1 86 . 9 1 1 A 11 11 ILE CA C 11 59.400 59.220 0.180 1
1 87 . 9 1 1 A 11 11 ILE CB C 11 41.800 40.896 0.904 1
1 91 . 9 1 1 A 11 11 ILE N N 11 114.600 121.436 -6.836 1
1 92 . 9 1 1 A 12 12 PHE H H 12 8.520 8.833 -0.313 1
1 93 . 9 1 1 A 12 12 PHE HA H 12 5.540 5.315 0.225 1
1 96 . 9 1 1 A 12 12 PHE CA C 12 55.000 56.956 -1.956 1
1 97 . 9 1 1 A 12 12 PHE CB C 12 41.200 40.807 0.393 1
1 98 . 9 1 1 A 12 12 PHE N N 12 118.600 123.672 -5.072 1
1 99 . 9 1 1 A 13 13 VAL H H 13 9.230 8.903 0.327 1
1 100 . 9 1 1 A 13 13 VAL HA H 13 4.740 5.163 -0.423 1
1 108 . 9 1 1 A 13 13 VAL CA C 13 60.300 60.449 -0.149 1
1 109 . 9 1 1 A 13 13 VAL CB C 13 34.100 35.181 -1.081 1
1 112 . 9 1 1 A 13 13 VAL N N 13 121.400 122.226 -0.826 1
1 113 . 9 1 1 A 14 14 LYS H H 14 8.910 8.183 0.727 1
1 114 . 9 1 1 A 14 14 LYS HA H 14 5.190 4.705 0.485 1
1 122 . 9 1 1 A 14 14 LYS CA C 14 54.600 54.787 -0.187 1
1 123 . 9 1 1 A 14 14 LYS CB C 14 34.300 34.233 0.067 1
1 126 . 9 1 1 A 14 14 LYS N N 14 128.000 126.265 1.735 1
1 127 . 9 1 1 A 15 15 THR H H 15 8.650 8.795 -0.145 1
1 128 . 9 1 1 A 15 15 THR HA H 15 4.870 4.698 0.172 1
1 133 . 9 1 1 A 15 15 THR CA C 15 60.300 60.805 -0.505 1
1 134 . 9 1 1 A 15 15 THR CB C 15 70.600 71.312 -0.712 1
1 136 . 9 1 1 A 15 15 THR N N 15 115.300 117.867 -2.567 1
1 137 . 9 1 1 A 16 16 LEU H H 16 9.070 8.816 0.254 1
1 138 . 9 1 1 A 16 16 LEU HA H 16 4.210 4.013 0.197 1
1 148 . 9 1 1 A 16 16 LEU CA C 16 57.400 57.743 -0.343 1
1 149 . 9 1 1 A 16 16 LEU CB C 16 41.800 41.575 0.225 1
1 153 . 9 1 1 A 16 16 LEU N N 16 121.400 122.239 -0.839 1
1 154 . 9 1 1 A 17 17 THR H H 17 7.560 7.803 -0.243 1
1 155 . 9 1 1 A 17 17 THR HA H 17 4.330 4.281 0.049 1
1 160 . 9 1 1 A 17 17 THR CA C 17 61.400 63.761 -2.361 1
1 161 . 9 1 1 A 17 17 THR CB C 17 68.900 69.491 -0.591 1
1 163 . 9 1 1 A 17 17 THR N N 17 105.900 112.083 -6.183 1
1 164 . 9 1 1 A 18 18 GLY H H 18 7.750 7.804 -0.054 1
1 165 . 9 1 1 A 18 18 GLY HA2 H 18 4.250 4.030 0.220 1
1 166 . 9 1 1 A 18 18 GLY HA3 H 18 3.520 4.039 -0.519 1
1 167 . 9 1 1 A 18 18 GLY CA C 18 45.300 45.044 0.256 1
1 168 . 9 1 1 A 18 18 GLY N N 18 109.300 109.291 0.009 1
1 169 . 9 1 1 A 19 19 LYS H H 19 7.210 7.726 -0.516 1
1 170 . 9 1 1 A 19 19 LYS HA H 19 4.260 4.244 0.016 1
1 175 . 9 1 1 A 19 19 LYS CA C 19 56.300 56.834 -0.534 1
1 176 . 9 1 1 A 19 19 LYS CB C 19 33.200 33.964 -0.764 1
1 179 . 9 1 1 A 19 19 LYS N N 19 122.000 121.534 0.466 1
1 180 . 9 1 1 A 20 20 THR H H 20 8.570 8.694 -0.124 1
1 181 . 9 1 1 A 20 20 THR HA H 20 4.950 5.534 -0.584 1
1 186 . 9 1 1 A 20 20 THR CA C 20 62.200 60.321 1.879 1
1 187 . 9 1 1 A 20 20 THR CB C 20 69.700 70.695 -0.995 1
1 189 . 9 1 1 A 20 20 THR N N 20 120.700 113.564 7.136 1
1 190 . 9 1 1 A 21 21 ILE H H 21 9.510 8.846 0.664 1
1 191 . 9 1 1 A 21 21 ILE HA H 21 4.390 4.854 -0.464 1
1 201 . 9 1 1 A 21 21 ILE CA C 21 60.000 58.968 1.032 1
1 202 . 9 1 1 A 21 21 ILE CB C 21 40.700 41.499 -0.799 1
1 206 . 9 1 1 A 21 21 ILE N N 21 128.200 122.919 5.281 1
1 207 . 9 1 1 A 22 22 THR H H 22 8.700 8.612 0.088 1
1 208 . 9 1 1 A 22 22 THR HA H 22 4.860 4.642 0.218 1
1 213 . 9 1 1 A 22 22 THR CA C 22 62.100 62.527 -0.427 1
1 214 . 9 1 1 A 22 22 THR CB C 22 69.500 69.830 -0.330 1
1 216 . 9 1 1 A 22 22 THR N N 22 122.300 120.985 1.315 1
1 217 . 9 1 1 A 23 23 LEU H H 23 8.720 8.691 0.029 1
1 218 . 9 1 1 A 23 23 LEU HA H 23 4.690 5.021 -0.331 1
1 228 . 9 1 1 A 23 23 LEU CA C 23 52.700 53.712 -1.012 1
1 229 . 9 1 1 A 23 23 LEU CB C 23 46.600 46.189 0.411 1
1 233 . 9 1 1 A 23 23 LEU N N 23 125.400 125.804 -0.404 1
1 234 . 9 1 1 A 24 24 GLU H H 24 8.080 8.582 -0.502 1
1 235 . 9 1 1 A 24 24 GLU HA H 24 4.800 5.041 -0.241 1
1 238 . 9 1 1 A 24 24 GLU CA C 24 55.400 55.365 0.035 1
1 239 . 9 1 1 A 24 24 GLU CB C 24 30.100 31.784 -1.684 1
1 241 . 9 1 1 A 24 24 GLU N N 24 121.800 118.867 2.933 1
1 242 . 9 1 1 A 25 25 VAL H H 25 8.800 8.896 -0.096 1
1 243 . 9 1 1 A 25 25 VAL HA H 25 4.640 4.948 -0.308 1
1 251 . 9 1 1 A 25 25 VAL CA C 25 58.600 59.490 -0.890 1
1 252 . 9 1 1 A 25 25 VAL CB C 25 36.300 36.093 0.207 1
1 255 . 9 1 1 A 25 25 VAL N N 25 116.700 117.551 -0.851 1
1 256 . 9 1 1 A 26 26 GLU H H 26 8.500 8.398 0.102 1
1 257 . 9 1 1 A 26 26 GLU HA H 26 4.900 4.629 0.271 1
1 260 . 9 1 1 A 26 26 GLU CA C 26 53.000 53.460 -0.460 1
1 261 . 9 1 1 A 26 26 GLU CB C 26 31.200 34.034 -2.834 1
1 262 . 9 1 1 A 26 26 GLU N N 26 117.900 121.608 -3.708 1
1 263 . 9 1 1 A 27 27 PRO HA H 27 4.040 4.417 -0.377 1
1 270 . 9 1 1 A 27 27 PRO CA C 27 65.400 64.576 0.824 1
1 271 . 9 1 1 A 27 27 PRO CB C 27 31.700 31.950 -0.250 1
1 274 . 9 1 1 A 28 28 SER H H 28 7.010 8.182 -1.172 1
1 275 . 9 1 1 A 28 28 SER HA H 28 4.280 4.680 -0.400 1
1 278 . 9 1 1 A 28 28 SER CA C 28 57.400 58.718 -1.318 1
1 279 . 9 1 1 A 28 28 SER CB C 28 63.400 63.894 -0.494 1
1 280 . 9 1 1 A 28 28 SER N N 28 103.800 111.673 -7.873 1
1 281 . 9 1 1 A 29 29 ASP H H 29 7.960 7.887 0.073 1
1 282 . 9 1 1 A 29 29 ASP HA H 29 4.600 5.041 -0.441 1
1 285 . 9 1 1 A 29 29 ASP CA C 29 55.900 53.255 2.645 1
1 286 . 9 1 1 A 29 29 ASP CB C 29 41.000 42.390 -1.390 1
1 287 . 9 1 1 A 29 29 ASP N N 29 123.700 120.182 3.518 1
1 288 . 9 1 1 A 30 30 THR H H 30 7.780 8.902 -1.122 1
1 289 . 9 1 1 A 30 30 THR HA H 30 4.850 4.792 0.058 1
1 294 . 9 1 1 A 30 30 THR CA C 30 59.400 60.581 -1.181 1
1 295 . 9 1 1 A 30 30 THR CB C 30 71.100 71.357 -0.257 1
1 297 . 9 1 1 A 30 30 THR N N 30 108.800 116.796 -7.996 1
1 298 . 9 1 1 A 31 31 ILE H H 31 8.320 9.002 -0.682 1
1 299 . 9 1 1 A 31 31 ILE HA H 31 3.580 3.753 -0.173 1
1 309 . 9 1 1 A 31 31 ILE CA C 31 62.200 64.685 -2.485 1
1 310 . 9 1 1 A 31 31 ILE CB C 31 34.300 37.665 -3.365 1
1 314 . 9 1 1 A 31 31 ILE N N 31 121.300 122.470 -1.170 1
1 315 . 9 1 1 A 32 32 GLU H H 32 9.850 8.365 1.485 1
1 316 . 9 1 1 A 32 32 GLU HA H 32 3.780 3.920 -0.140 1
1 321 . 9 1 1 A 32 32 GLU CA C 32 60.500 59.985 0.515 1
1 322 . 9 1 1 A 32 32 GLU CB C 32 28.800 29.335 -0.535 1
1 324 . 9 1 1 A 32 32 GLU N N 32 121.600 122.599 -0.999 1
1 325 . 9 1 1 A 33 33 ASN H H 33 7.810 7.571 0.239 1
1 326 . 9 1 1 A 33 33 ASN HA H 33 4.440 4.637 -0.197 1
1 329 . 9 1 1 A 33 33 ASN CA C 33 55.800 55.872 -0.072 1
1 330 . 9 1 1 A 33 33 ASN CB C 33 38.100 38.770 -0.670 1
1 331 . 9 1 1 A 33 33 ASN N N 33 121.000 117.811 3.189 1
1 332 . 9 1 1 A 34 34 VAL H H 34 8.000 7.728 0.272 1
1 333 . 9 1 1 A 34 34 VAL HA H 34 3.300 3.520 -0.220 1
1 341 . 9 1 1 A 34 34 VAL CA C 34 67.600 67.117 0.483 1
1 342 . 9 1 1 A 34 34 VAL CB C 34 30.700 31.431 -0.731 1
1 345 . 9 1 1 A 34 34 VAL N N 34 122.200 120.740 1.460 1
1 346 . 9 1 1 A 35 35 LYS H H 35 8.490 8.365 0.125 1
1 347 . 9 1 1 A 35 35 LYS HA H 35 4.500 4.081 0.419 1
1 352 . 9 1 1 A 35 35 LYS CA C 35 59.300 58.642 0.658 1
1 353 . 9 1 1 A 35 35 LYS CB C 35 33.500 31.855 1.645 1
1 354 . 9 1 1 A 35 35 LYS N N 35 119.200 120.285 -1.085 1
1 355 . 9 1 1 A 36 36 ALA H H 36 7.880 8.289 -0.409 1
1 356 . 9 1 1 A 36 36 ALA HA H 36 4.060 4.050 0.010 1
1 360 . 9 1 1 A 36 36 ALA CA C 36 55.300 54.881 0.419 1
1 361 . 9 1 1 A 36 36 ALA CB C 36 17.600 18.118 -0.518 1
1 362 . 9 1 1 A 36 36 ALA N N 36 123.300 122.065 1.235 1
1 363 . 9 1 1 A 37 37 LYS H H 37 7.790 7.973 -0.183 1
1 364 . 9 1 1 A 37 37 LYS HA H 37 4.110 4.089 0.021 1
1 373 . 9 1 1 A 37 37 LYS CA C 37 59.700 59.614 0.086 1
1 374 . 9 1 1 A 37 37 LYS CB C 37 33.100 32.393 0.707 1
1 378 . 9 1 1 A 37 37 LYS N N 37 120.400 117.152 3.248 1
1 379 . 9 1 1 A 38 38 ILE H H 38 8.240 7.535 0.705 1
1 380 . 9 1 1 A 38 38 ILE HA H 38 3.410 3.995 -0.585 1
1 390 . 9 1 1 A 38 38 ILE CA C 38 66.200 62.171 4.029 1
1 391 . 9 1 1 A 38 38 ILE CB C 38 36.800 37.631 -0.831 1
1 395 . 9 1 1 A 38 38 ILE N N 38 121.400 119.929 1.471 1
1 396 . 9 1 1 A 39 39 GLN H H 39 8.460 8.704 -0.244 1
1 397 . 9 1 1 A 39 39 GLN HA H 39 3.730 3.920 -0.190 1
1 402 . 9 1 1 A 39 39 GLN CA C 39 60.000 59.250 0.750 1
1 403 . 9 1 1 A 39 39 GLN CB C 39 27.600 28.464 -0.864 1
1 405 . 9 1 1 A 39 39 GLN N N 39 123.500 121.290 2.210 1
1 406 . 9 1 1 A 40 40 ASP H H 40 7.970 8.041 -0.071 1
1 407 . 9 1 1 A 40 40 ASP HA H 40 4.240 4.386 -0.146 1
1 410 . 9 1 1 A 40 40 ASP CA C 40 57.400 56.699 0.701 1
1 411 . 9 1 1 A 40 40 ASP CB C 40 41.000 40.693 0.307 1
1 412 . 9 1 1 A 40 40 ASP N N 40 119.900 119.285 0.615 1
1 413 . 9 1 1 A 41 41 LYS H H 41 7.420 7.808 -0.388 1
1 414 . 9 1 1 A 41 41 LYS HA H 41 4.200 4.088 0.112 1
1 423 . 9 1 1 A 41 41 LYS CA C 41 58.200 59.193 -0.993 1
1 424 . 9 1 1 A 41 41 LYS CB C 41 33.900 32.742 1.158 1
1 427 . 9 1 1 A 41 41 LYS N N 41 115.700 119.145 -3.445 1
1 428 . 9 1 1 A 42 42 GLU H H 42 8.650 8.248 0.402 1
1 429 . 9 1 1 A 42 42 GLU HA H 42 4.470 4.507 -0.037 1
1 434 . 9 1 1 A 42 42 GLU CA C 42 55.300 56.079 -0.779 1
1 435 . 9 1 1 A 42 42 GLU CB C 42 33.200 31.866 1.334 1
1 437 . 9 1 1 A 42 42 GLU N N 42 114.200 115.317 -1.117 1
1 438 . 9 1 1 A 43 43 GLY H H 43 8.400 8.020 0.380 1
1 439 . 9 1 1 A 43 43 GLY HA2 H 43 4.040 4.004 0.036 1
1 440 . 9 1 1 A 43 43 GLY HA3 H 43 3.820 4.006 -0.186 1
1 441 . 9 1 1 A 43 43 GLY CA C 43 45.900 45.139 0.761 1
1 442 . 9 1 1 A 43 43 GLY N N 43 109.000 108.143 0.857 1
1 443 . 9 1 1 A 44 44 ILE H H 44 6.080 7.530 -1.450 1
1 444 . 9 1 1 A 44 44 ILE HA H 44 4.290 4.266 0.024 1
1 446 . 9 1 1 A 44 44 ILE CA C 44 57.700 58.741 -1.041 1
1 447 . 9 1 1 A 44 44 ILE CB C 44 40.400 38.722 1.678 1
1 448 . 9 1 1 A 44 44 ILE N N 44 120.500 122.623 -2.123 1
1 449 . 9 1 1 A 46 46 PRO HA H 46 4.030 4.285 -0.255 1
1 454 . 9 1 1 A 46 46 PRO CA C 46 66.100 65.145 0.955 1
1 455 . 9 1 1 A 46 46 PRO CB C 46 32.600 31.988 0.612 1
1 458 . 9 1 1 A 47 47 ASP H H 47 8.470 8.853 -0.383 1
1 459 . 9 1 1 A 47 47 ASP HA H 47 4.310 4.492 -0.182 1
1 462 . 9 1 1 A 47 47 ASP CA C 47 55.700 55.422 0.278 1
1 463 . 9 1 1 A 47 47 ASP CB C 47 39.700 39.393 0.307 1
1 464 . 9 1 1 A 47 47 ASP N N 47 113.700 115.871 -2.171 1
1 465 . 9 1 1 A 48 48 GLN H H 48 7.720 7.834 -0.114 1
1 466 . 9 1 1 A 48 48 GLN HA H 48 4.340 4.461 -0.121 1
1 471 . 9 1 1 A 48 48 GLN CA C 48 55.500 55.148 0.352 1
1 472 . 9 1 1 A 48 48 GLN CB C 48 29.900 29.184 0.716 1
1 474 . 9 1 1 A 48 48 GLN N N 48 116.900 117.824 -0.924 1
1 475 . 9 1 1 A 49 49 GLN H H 49 7.410 7.669 -0.259 1
1 476 . 9 1 1 A 49 49 GLN HA H 49 4.110 5.018 -0.908 1
1 481 . 9 1 1 A 49 49 GLN CA C 49 56.600 54.485 2.115 1
1 482 . 9 1 1 A 49 49 GLN CB C 49 31.300 31.554 -0.254 1
1 484 . 9 1 1 A 49 49 GLN N N 49 118.000 117.610 0.390 1
1 485 . 9 1 1 A 50 50 ARG H H 50 8.400 9.021 -0.621 1
1 486 . 9 1 1 A 50 50 ARG HA H 50 4.380 5.051 -0.671 1
1 491 . 9 1 1 A 50 50 ARG CA C 50 55.100 54.793 0.307 1
1 492 . 9 1 1 A 50 50 ARG CB C 50 31.600 33.384 -1.784 1
1 494 . 9 1 1 A 50 50 ARG N N 50 123.100 120.491 2.609 1
1 495 . 9 1 1 A 51 51 LEU H H 51 8.710 8.573 0.137 1
1 496 . 9 1 1 A 51 51 LEU HA H 51 5.300 5.083 0.217 1
1 506 . 9 1 1 A 51 51 LEU CA C 51 52.900 53.681 -0.781 1
1 507 . 9 1 1 A 51 51 LEU CB C 51 45.700 43.175 2.525 1
1 511 . 9 1 1 A 51 51 LEU N N 51 124.400 124.528 -0.128 1
1 512 . 9 1 1 A 52 52 ILE H H 52 9.060 8.865 0.195 1
1 513 . 9 1 1 A 52 52 ILE HA H 52 4.840 5.041 -0.201 1
1 523 . 9 1 1 A 52 52 ILE CA C 52 58.900 60.147 -1.247 1
1 524 . 9 1 1 A 52 52 ILE CB C 52 41.200 40.922 0.278 1
1 528 . 9 1 1 A 52 52 ILE N N 52 122.500 123.941 -1.441 1
1 529 . 9 1 1 A 53 53 PHE H H 53 8.730 9.478 -0.748 1
1 530 . 9 1 1 A 53 53 PHE HA H 53 5.100 4.806 0.294 1
1 535 . 9 1 1 A 53 53 PHE CA C 53 56.300 57.401 -1.101 1
1 536 . 9 1 1 A 53 53 PHE CB C 53 43.500 42.091 1.409 1
1 537 . 9 1 1 A 53 53 PHE N N 53 124.800 127.820 -3.020 1
1 538 . 9 1 1 A 54 54 ALA H H 54 8.940 9.066 -0.126 1
1 539 . 9 1 1 A 54 54 ALA HA H 54 3.610 3.835 -0.225 1
1 543 . 9 1 1 A 54 54 ALA CA C 54 52.500 52.932 -0.432 1
1 544 . 9 1 1 A 54 54 ALA CB C 54 16.300 17.195 -0.895 1
1 545 . 9 1 1 A 54 54 ALA N N 54 133.100 130.417 2.683 1
1 546 . 9 1 1 A 55 55 GLY H H 55 8.070 8.447 -0.377 1
1 547 . 9 1 1 A 55 55 GLY HA2 H 55 4.000 3.788 0.212 1
1 548 . 9 1 1 A 55 55 GLY HA3 H 55 3.340 3.819 -0.479 1
1 549 . 9 1 1 A 55 55 GLY CA C 55 45.200 45.373 -0.173 1
1 550 . 9 1 1 A 55 55 GLY N N 55 102.500 102.625 -0.125 1
1 551 . 9 1 1 A 56 56 LYS H H 56 7.860 7.949 -0.089 1
1 552 . 9 1 1 A 56 56 LYS HA H 56 4.510 4.549 -0.039 1
1 558 . 9 1 1 A 56 56 LYS CA C 56 54.500 54.621 -0.121 1
1 559 . 9 1 1 A 56 56 LYS CB C 56 34.400 33.755 0.645 1
1 561 . 9 1 1 A 56 56 LYS N N 56 121.800 121.820 -0.020 1
1 562 . 9 1 1 A 57 57 GLN H H 57 8.600 8.599 0.001 1
1 563 . 9 1 1 A 57 57 GLN HA H 57 4.410 4.984 -0.574 1
1 568 . 9 1 1 A 57 57 GLN CA C 57 55.900 56.037 -0.137 1
1 569 . 9 1 1 A 57 57 GLN CB C 57 28.800 30.119 -1.319 1
1 571 . 9 1 1 A 57 57 GLN N N 57 123.200 126.079 -2.879 1
1 572 . 9 1 1 A 58 58 LEU H H 58 8.480 8.957 -0.477 1
1 573 . 9 1 1 A 58 58 LEU HA H 58 4.060 4.757 -0.697 1
1 583 . 9 1 1 A 58 58 LEU CA C 58 54.100 53.592 0.508 1
1 584 . 9 1 1 A 58 58 LEU CB C 58 41.500 43.630 -2.130 1
1 588 . 9 1 1 A 58 58 LEU N N 58 125.900 118.568 7.332 1
1 589 . 9 1 1 A 59 59 GLU H H 59 8.400 8.352 0.048 1
1 590 . 9 1 1 A 59 59 GLU HA H 59 4.400 4.938 -0.538 1
1 595 . 9 1 1 A 59 59 GLU CA C 59 55.900 54.409 1.491 1
1 596 . 9 1 1 A 59 59 GLU CB C 59 31.900 33.314 -1.414 1
1 598 . 9 1 1 A 59 59 GLU N N 59 123.100 117.783 5.317 1
1 599 . 9 1 1 A 60 60 ASP H H 60 8.110 8.922 -0.812 1
1 600 . 9 1 1 A 60 60 ASP HA H 60 4.270 5.616 -1.346 1
1 603 . 9 1 1 A 60 60 ASP CA C 60 57.100 52.600 4.500 1
1 604 . 9 1 1 A 60 60 ASP CB C 60 40.800 44.757 -3.957 1
1 605 . 9 1 1 A 60 60 ASP N N 60 120.300 120.254 0.046 1
1 606 . 9 1 1 A 61 61 GLY HA2 H 61 4.000 4.206 -0.206 1
1 607 . 9 1 1 A 61 61 GLY HA3 H 61 3.830 4.250 -0.420 1
1 608 . 9 1 1 A 61 61 GLY CA C 61 45.000 46.308 -1.308 1
1 609 . 9 1 1 A 62 62 ARG H H 62 7.350 8.190 -0.840 1
1 610 . 9 1 1 A 62 62 ARG HA H 62 4.640 4.601 0.039 1
1 615 . 9 1 1 A 62 62 ARG CA C 62 54.400 55.238 -0.838 1
1 616 . 9 1 1 A 62 62 ARG CB C 62 32.600 31.157 1.443 1
1 618 . 9 1 1 A 62 62 ARG N N 62 119.300 121.238 -1.938 1
1 619 . 9 1 1 A 63 63 THR H H 63 8.460 8.419 0.041 1
1 620 . 9 1 1 A 63 63 THR HA H 63 5.060 4.683 0.377 1
1 625 . 9 1 1 A 63 63 THR CA C 63 59.700 60.788 -1.088 1
1 626 . 9 1 1 A 63 63 THR CB C 63 72.000 71.110 0.890 1
1 628 . 9 1 1 A 63 63 THR N N 63 109.100 112.650 -3.550 1
1 629 . 9 1 1 A 64 64 LEU H H 64 8.190 8.865 -0.675 1
1 630 . 9 1 1 A 64 64 LEU HA H 64 3.920 4.006 -0.086 1
1 640 . 9 1 1 A 64 64 LEU CA C 64 58.400 58.019 0.381 1
1 641 . 9 1 1 A 64 64 LEU CB C 64 40.200 41.224 -1.024 1
1 645 . 9 1 1 A 64 64 LEU N N 64 118.100 123.496 -5.396 1
1 646 . 9 1 1 A 65 65 SER H H 65 8.370 7.855 0.515 1
1 647 . 9 1 1 A 65 65 SER HA H 65 4.150 4.166 -0.016 1
1 650 . 9 1 1 A 65 65 SER CA C 65 60.900 60.044 0.856 1
1 651 . 9 1 1 A 65 65 SER CB C 65 62.500 63.836 -1.336 1
1 652 . 9 1 1 A 65 65 SER N N 65 112.200 114.401 -2.201 1
1 653 . 9 1 1 A 66 66 GLU H H 66 7.780 7.769 0.011 1
1 654 . 9 1 1 A 66 66 GLU HA H 66 3.890 4.103 -0.213 1
1 659 . 9 1 1 A 66 66 GLU CA C 66 59.200 58.826 0.374 1
1 660 . 9 1 1 A 66 66 GLU CB C 66 29.400 29.371 0.029 1
1 662 . 9 1 1 A 66 66 GLU N N 66 123.600 121.943 1.657 1
1 663 . 9 1 1 A 67 67 TYR H H 67 7.290 7.836 -0.546 1
1 664 . 9 1 1 A 67 67 TYR HA H 67 4.590 4.628 -0.038 1
1 669 . 9 1 1 A 67 67 TYR CA C 67 58.400 57.568 0.832 1
1 670 . 9 1 1 A 67 67 TYR CB C 67 39.800 38.588 1.212 1
1 671 . 9 1 1 A 67 67 TYR N N 67 116.400 117.203 -0.803 1
1 672 . 9 1 1 A 68 68 ASN H H 68 8.040 8.010 0.030 1
1 673 . 9 1 1 A 68 68 ASN HA H 68 4.240 4.348 -0.108 1
1 676 . 9 1 1 A 68 68 ASN CA C 68 54.100 54.167 -0.067 1
1 677 . 9 1 1 A 68 68 ASN CB C 68 37.200 37.277 -0.077 1
1 678 . 9 1 1 A 68 68 ASN N N 68 115.600 118.372 -2.772 1
1 679 . 9 1 1 A 69 69 ILE H H 69 7.200 7.355 -0.155 1
1 680 . 9 1 1 A 69 69 ILE HA H 69 3.280 4.559 -1.279 1
1 690 . 9 1 1 A 69 69 ILE CA C 69 59.800 59.333 0.467 1
1 691 . 9 1 1 A 69 69 ILE CB C 69 36.600 39.733 -3.133 1
1 695 . 9 1 1 A 69 69 ILE N N 69 119.100 114.191 4.909 1
1 696 . 9 1 1 A 70 70 GLN H H 70 7.570 8.442 -0.872 1
1 697 . 9 1 1 A 70 70 GLN HA H 70 4.410 4.266 0.144 1
1 702 . 9 1 1 A 70 70 GLN CA C 70 53.500 55.365 -1.865 1
1 703 . 9 1 1 A 70 70 GLN CB C 70 31.500 27.992 3.508 1
1 705 . 9 1 1 A 70 70 GLN N N 70 124.800 120.678 4.122 1
1 706 . 9 1 1 A 71 71 LYS H H 71 8.370 7.588 0.782 1
1 707 . 9 1 1 A 71 71 LYS HA H 71 3.870 4.102 -0.232 1
1 716 . 9 1 1 A 71 71 LYS CA C 71 58.000 55.112 2.888 1
1 717 . 9 1 1 A 71 71 LYS CB C 71 32.500 30.673 1.827 1
1 720 . 9 1 1 A 71 71 LYS N N 71 120.200 121.856 -1.656 1
1 721 . 9 1 1 A 72 72 GLU H H 72 9.230 7.879 1.351 1
1 722 . 9 1 1 A 72 72 GLU HA H 72 3.240 4.569 -1.329 1
1 727 . 9 1 1 A 72 72 GLU CA C 72 58.300 55.484 2.816 1
1 728 . 9 1 1 A 72 72 GLU CB C 72 26.000 30.496 -4.496 1
1 730 . 9 1 1 A 72 72 GLU N N 72 115.100 124.428 -9.328 1
1 731 . 9 1 1 A 73 73 SER H H 73 7.690 8.042 -0.352 1
1 732 . 9 1 1 A 73 73 SER HA H 73 4.520 4.722 -0.202 1
1 735 . 9 1 1 A 73 73 SER CA C 73 61.100 59.423 1.677 1
1 736 . 9 1 1 A 73 73 SER CB C 73 64.800 65.050 -0.250 1
1 737 . 9 1 1 A 73 73 SER N N 73 115.300 115.993 -0.693 1
1 738 . 9 1 1 A 74 74 THR H H 74 8.620 7.848 0.772 1
1 739 . 9 1 1 A 74 74 THR HA H 74 5.200 5.091 0.109 1
1 744 . 9 1 1 A 74 74 THR CA C 74 62.400 61.801 0.599 1
1 745 . 9 1 1 A 74 74 THR CB C 74 70.200 70.710 -0.510 1
1 747 . 9 1 1 A 74 74 THR N N 74 117.500 111.283 6.217 1
1 748 . 9 1 1 A 75 75 LEU H H 75 9.350 9.109 0.241 1
1 749 . 9 1 1 A 75 75 LEU HA H 75 4.990 4.924 0.066 1
1 759 . 9 1 1 A 75 75 LEU CA C 75 53.800 54.008 -0.208 1
1 760 . 9 1 1 A 75 75 LEU CB C 75 44.400 45.910 -1.510 1
1 764 . 9 1 1 A 75 75 LEU N N 75 128.000 127.439 0.561 1
1 765 . 9 1 1 A 76 76 HIS H H 76 9.140 8.268 0.872 1
1 766 . 9 1 1 A 76 76 HIS HA H 76 5.040 5.125 -0.085 1
1 769 . 9 1 1 A 76 76 HIS CA C 76 56.200 54.211 1.989 1
1 770 . 9 1 1 A 76 76 HIS CB C 76 32.500 31.878 0.622 1
1 771 . 9 1 1 A 76 76 HIS N N 76 119.600 122.115 -2.515 1
1 772 . 9 1 1 A 77 77 LEU H H 77 8.240 9.271 -1.031 1
1 773 . 9 1 1 A 77 77 LEU HA H 77 5.080 5.112 -0.032 1
1 783 . 9 1 1 A 77 77 LEU CA C 77 53.600 54.423 -0.823 1
1 784 . 9 1 1 A 77 77 LEU CB C 77 44.100 43.345 0.755 1
1 788 . 9 1 1 A 77 77 LEU N N 77 123.800 124.746 -0.946 1
1 789 . 9 1 1 A 78 78 VAL H H 78 9.110 8.692 0.418 1
1 790 . 9 1 1 A 78 78 VAL HA H 78 4.260 4.710 -0.450 1
1 798 . 9 1 1 A 78 78 VAL CA C 78 60.400 60.831 -0.431 1
1 799 . 9 1 1 A 78 78 VAL CB C 78 34.700 35.907 -1.207 1
1 802 . 9 1 1 A 78 78 VAL N N 78 127.100 124.072 3.028 1
1 803 . 9 1 1 A 79 79 LEU H H 79 8.050 8.911 -0.861 1
1 804 . 9 1 1 A 79 79 LEU HA H 79 4.950 4.908 0.042 1
1 813 . 9 1 1 A 79 79 LEU CA C 79 53.800 53.193 0.607 1
1 814 . 9 1 1 A 79 79 LEU CB C 79 42.700 44.341 -1.641 1
1 818 . 9 1 1 A 79 79 LEU N N 79 123.400 128.523 -5.123 1
1 819 . 9 1 1 A 80 80 ARG H H 80 8.540 9.075 -0.535 1
1 820 . 9 1 1 A 80 80 ARG HA H 80 4.170 3.938 0.232 1
1 827 . 9 1 1 A 80 80 ARG CA C 80 55.800 56.948 -1.148 1
1 828 . 9 1 1 A 80 80 ARG CB C 80 31.100 28.788 2.312 1
1 830 . 9 1 1 A 80 80 ARG N N 80 123.500 126.390 -2.890 1
1 831 . 9 1 1 A 81 81 LEU H H 81 8.250 7.788 0.462 1
1 832 . 9 1 1 A 81 81 LEU HA H 81 4.270 4.282 -0.012 1
1 842 . 9 1 1 A 81 81 LEU CA C 81 55.000 54.840 0.160 1
1 843 . 9 1 1 A 81 81 LEU CB C 81 42.200 43.295 -1.095 1
1 847 . 9 1 1 A 81 81 LEU N N 81 124.100 118.714 5.386 1
1 848 . 9 1 1 A 82 82 ARG H H 82 8.310 8.603 -0.293 1
1 849 . 9 1 1 A 82 82 ARG HA H 82 4.200 4.695 -0.495 1
1 852 . 9 1 1 A 82 82 ARG CA C 82 56.300 55.920 0.380 1
1 853 . 9 1 1 A 82 82 ARG CB C 82 30.700 32.042 -1.342 1
1 855 . 9 1 1 A 82 82 ARG N N 82 121.500 120.547 0.953 1
1 856 . 9 1 1 A 83 83 GLY H H 83 8.410 8.992 -0.582 1
1 857 . 9 1 1 A 83 83 GLY HA2 H 83 3.750 4.233 -0.483 1
1 858 . 9 1 1 A 83 83 GLY HA3 H 83 3.754 4.235 -0.481 1
1 859 . 9 1 1 A 83 83 GLY CA C 83 45.100 44.285 0.815 1
1 860 . 9 1 1 A 83 83 GLY N N 83 110.200 112.205 -2.005 1
1 861 . 9 1 1 A 84 84 TYR H H 84 7.950 8.825 -0.875 1
1 862 . 9 1 1 A 84 84 TYR HA H 84 4.400 4.828 -0.428 1
1 865 . 9 1 1 A 84 84 TYR CA C 84 58.100 57.806 0.294 1
1 866 . 9 1 1 A 84 84 TYR CB C 84 38.800 40.576 -1.776 1
1 867 . 9 1 1 A 84 84 TYR N N 84 119.900 119.378 0.522 1
1 868 . 9 1 1 A 85 85 ALA H H 85 8.150 8.214 -0.064 1
1 869 . 9 1 1 A 85 85 ALA HA H 85 4.150 4.478 -0.328 1
1 873 . 9 1 1 A 85 85 ALA CA C 85 52.600 51.168 1.432 1
1 874 . 9 1 1 A 85 85 ALA CB C 85 19.200 20.110 -0.910 1
1 875 . 9 1 1 A 85 85 ALA N N 85 124.800 123.028 1.772 1
1 876 . 9 1 1 A 86 86 ASP H H 86 8.020 8.782 -0.762 1
1 877 . 9 1 1 A 86 86 ASP HA H 86 4.450 4.573 -0.123 1
1 880 . 9 1 1 A 86 86 ASP CA C 86 54.100 56.428 -2.328 1
1 881 . 9 1 1 A 86 86 ASP CB C 86 41.100 40.192 0.908 1
1 882 . 9 1 1 A 86 86 ASP N N 86 118.900 117.298 1.602 1
1 883 . 9 1 1 A 87 87 LEU H H 87 8.010 8.591 -0.581 1
1 884 . 9 1 1 A 87 87 LEU HA H 87 4.210 4.515 -0.305 1
1 893 . 9 1 1 A 87 87 LEU CA C 87 55.300 54.553 0.747 1
1 894 . 9 1 1 A 87 87 LEU CB C 87 42.000 42.713 -0.713 1
1 898 . 9 1 1 A 87 87 LEU N N 87 122.400 123.221 -0.821 1
1 899 . 9 1 1 A 88 88 ARG H H 88 8.170 8.479 -0.309 1
1 900 . 9 1 1 A 88 88 ARG HA H 88 4.210 4.759 -0.549 1
1 903 . 9 1 1 A 88 88 ARG CA C 88 56.300 53.983 2.317 1
1 904 . 9 1 1 A 88 88 ARG CB C 88 30.600 33.056 -2.456 1
1 905 . 9 1 1 A 88 88 ARG N N 88 121.200 119.199 2.001 1
1 906 . 9 1 1 A 91 91 PRO HA H 91 4.290 4.699 -0.409 1
1 911 . 9 1 1 A 91 91 PRO CA C 91 63.800 62.455 1.345 1
1 912 . 9 1 1 A 91 91 PRO CB C 91 32.100 29.512 2.588 1
1 915 . 9 1 1 A 92 92 ASP H H 92 8.280 8.405 -0.125 1
1 916 . 9 1 1 A 92 92 ASP HA H 92 4.540 5.064 -0.524 1
1 919 . 9 1 1 A 92 92 ASP CA C 92 54.600 53.902 0.698 1
1 920 . 9 1 1 A 92 92 ASP CB C 92 41.000 44.789 -3.789 1
1 921 . 9 1 1 A 92 92 ASP N N 92 118.700 123.983 -5.283 1
1 922 . 9 1 1 A 93 93 ARG H H 93 7.780 8.782 -1.002 1
1 923 . 9 1 1 A 93 93 ARG HA H 93 4.190 4.576 -0.386 1
1 930 . 9 1 1 A 93 93 ARG CA C 93 56.300 56.511 -0.211 1
1 931 . 9 1 1 A 93 93 ARG CB C 93 30.700 32.676 -1.976 1
1 934 . 9 1 1 A 93 93 ARG N N 93 120.700 121.409 -0.709 1
1 935 . 9 1 1 A 94 94 GLN H H 94 8.280 7.511 0.769 1
1 936 . 9 1 1 A 94 94 GLN HA H 94 4.210 4.479 -0.269 1
1 941 . 9 1 1 A 94 94 GLN CA C 94 55.800 54.835 0.965 1
1 942 . 9 1 1 A 94 94 GLN CB C 94 29.300 30.582 -1.282 1
1 944 . 9 1 1 A 94 94 GLN N N 94 121.000 117.874 3.126 1
1 945 . 9 1 1 A 95 95 ASP H H 95 8.270 9.211 -0.941 1
1 946 . 9 1 1 A 95 95 ASP HA H 95 4.450 4.826 -0.376 1
1 949 . 9 1 1 A 95 95 ASP CA C 95 54.300 55.681 -1.381 1
1 950 . 9 1 1 A 95 95 ASP CB C 95 41.000 41.402 -0.402 1
1 951 . 9 1 1 A 95 95 ASP N N 95 121.000 119.672 1.328 1
1 952 . 9 1 1 A 96 96 HIS H H 96 8.090 7.752 0.338 1
1 953 . 9 1 1 A 96 96 HIS HA H 96 4.470 4.913 -0.443 1
1 956 . 9 1 1 A 96 96 HIS CA C 96 55.900 55.951 -0.051 1
1 957 . 9 1 1 A 96 96 HIS CB C 96 30.500 32.698 -2.198 1
1 958 . 9 1 1 A 96 96 HIS N N 96 119.300 114.889 4.411 1
1 959 . 9 1 1 A 97 97 HIS H H 97 8.240 8.299 -0.059 1
1 960 . 9 1 1 A 97 97 HIS HA H 97 4.470 4.810 -0.340 1
1 963 . 9 1 1 A 97 97 HIS CA C 97 56.200 53.670 2.530 1
1 964 . 9 1 1 A 97 97 HIS CB C 97 30.400 30.028 0.372 1
1 965 . 9 1 1 A 97 97 HIS N N 97 121.300 123.500 -2.200 1
1 966 . 9 1 1 A 98 98 PRO HA H 98 4.340 4.484 -0.144 1
1 973 . 9 1 1 A 98 98 PRO CA C 98 63.700 62.889 0.811 1
1 974 . 9 1 1 A 98 98 PRO CB C 98 31.900 33.263 -1.363 1
1 977 . 9 1 1 A 99 99 GLY H H 99 8.660 8.163 0.497 1
1 978 . 9 1 1 A 99 99 GLY HA2 H 99 3.920 4.030 -0.110 1
1 979 . 9 1 1 A 99 99 GLY HA3 H 99 3.920 4.067 -0.147 1
1 980 . 9 1 1 A 99 99 GLY CA C 99 45.200 45.045 0.155 1
1 981 . 9 1 1 A 99 99 GLY N N 99 110.000 107.212 2.788 1
1 982 . 9 1 1 A 100 100 SER H H 100 8.170 8.373 -0.203 1
1 983 . 9 1 1 A 100 100 SER HA H 100 4.360 4.993 -0.633 1
1 986 . 9 1 1 A 100 100 SER CA C 100 58.500 57.429 1.071 1
1 987 . 9 1 1 A 100 100 SER CB C 100 64.000 65.946 -1.946 1
1 988 . 9 1 1 A 100 100 SER N N 100 115.600 113.220 2.380 1
1 989 . 9 1 1 A 101 101 GLY H H 101 8.420 8.290 0.130 1
1 990 . 9 1 1 A 101 101 GLY HA2 H 101 3.890 4.271 -0.381 1
1 991 . 9 1 1 A 101 101 GLY HA3 H 101 3.920 4.273 -0.353 1
1 992 . 9 1 1 A 101 101 GLY CA C 101 45.200 46.090 -0.890 1
1 993 . 9 1 1 A 101 101 GLY N N 101 111.000 107.488 3.512 1
1 994 . 9 1 1 A 102 102 ALA H H 102 8.030 8.294 -0.264 1
1 995 . 9 1 1 A 102 102 ALA HA H 102 4.250 4.805 -0.555 1
1 999 . 9 1 1 A 102 102 ALA CA C 102 52.500 51.241 1.259 1
1 1000 . 9 1 1 A 102 102 ALA CB C 102 19.200 22.820 -3.620 1
1 4 . 10 1 1 A 2 2 SER H H 2 8.160 8.219 -0.059 1
1 5 . 10 1 1 A 2 2 SER HA H 2 4.370 5.184 -0.814 1
1 9 . 10 1 1 A 2 2 SER CA C 2 58.300 57.565 0.735 1
1 10 . 10 1 1 A 2 2 SER CB C 2 63.900 66.180 -2.280 1
1 11 . 10 1 1 A 2 2 SER N N 2 115.600 118.076 -2.476 1
1 12 . 10 1 1 A 3 3 LEU H H 3 8.250 8.703 -0.453 1
1 13 . 10 1 1 A 3 3 LEU HA H 3 4.280 5.299 -1.019 1
1 17 . 10 1 1 A 3 3 LEU CA C 3 55.200 52.779 2.421 1
1 18 . 10 1 1 A 3 3 LEU CB C 3 42.100 46.215 -4.115 1
1 19 . 10 1 1 A 3 3 LEU N N 3 124.100 121.759 2.341 1
1 20 . 10 1 1 A 4 4 VAL H H 4 7.950 9.014 -1.064 1
1 21 . 10 1 1 A 4 4 VAL HA H 4 4.680 4.817 -0.137 1
1 26 . 10 1 1 A 4 4 VAL CA C 4 59.800 57.927 1.873 1
1 27 . 10 1 1 A 4 4 VAL CB C 4 32.500 34.802 -2.302 1
1 28 . 10 1 1 A 4 4 VAL N N 4 122.600 119.649 2.951 1
1 29 . 10 1 1 A 5 5 PRO CA C 5 63.100 62.526 0.574 1
1 30 . 10 1 1 A 5 5 PRO CB C 5 32.000 33.360 -1.360 1
1 32 . 10 1 1 A 6 6 ARG H H 6 8.360 8.692 -0.332 1
1 33 . 10 1 1 A 6 6 ARG HA H 6 4.250 5.084 -0.834 1
1 36 . 10 1 1 A 6 6 ARG CA C 6 56.000 54.620 1.380 1
1 37 . 10 1 1 A 6 6 ARG CB C 6 30.900 33.898 -2.998 1
1 38 . 10 1 1 A 6 6 ARG N N 6 121.800 117.063 4.737 1
1 39 . 10 1 1 A 7 7 GLY H H 7 8.460 8.439 0.021 1
1 40 . 10 1 1 A 7 7 GLY HA2 H 7 3.940 4.261 -0.321 1
1 41 . 10 1 1 A 7 7 GLY HA3 H 7 3.760 4.262 -0.502 1
1 42 . 10 1 1 A 7 7 GLY CA C 7 45.000 45.355 -0.355 1
1 43 . 10 1 1 A 7 7 GLY N N 7 110.700 107.632 3.068 1
1 44 . 10 1 1 A 8 8 SER H H 8 7.990 8.612 -0.622 1
1 45 . 10 1 1 A 8 8 SER HA H 8 4.450 4.622 -0.172 1
1 48 . 10 1 1 A 8 8 SER CA C 8 58.900 59.238 -0.338 1
1 49 . 10 1 1 A 8 8 SER CB C 8 64.200 64.732 -0.532 1
1 50 . 10 1 1 A 8 8 SER N N 8 115.500 114.890 0.610 1
1 51 . 10 1 1 A 9 9 MET H H 9 9.040 7.594 1.446 1
1 52 . 10 1 1 A 9 9 MET HA H 9 4.610 5.094 -0.484 1
1 60 . 10 1 1 A 9 9 MET CA C 9 54.400 53.486 0.914 1
1 61 . 10 1 1 A 9 9 MET CB C 9 35.400 33.714 1.686 1
1 64 . 10 1 1 A 9 9 MET N N 9 120.500 119.481 1.019 1
1 65 . 10 1 1 A 10 10 GLN H H 10 8.270 8.925 -0.655 1
1 66 . 10 1 1 A 10 10 GLN HA H 10 5.270 5.318 -0.048 1
1 71 . 10 1 1 A 10 10 GLN CA C 10 54.200 54.344 -0.144 1
1 72 . 10 1 1 A 10 10 GLN CB C 10 30.500 32.522 -2.022 1
1 74 . 10 1 1 A 10 10 GLN N N 10 121.000 122.563 -1.563 1
1 75 . 10 1 1 A 11 11 ILE H H 11 8.270 8.786 -0.516 1
1 76 . 10 1 1 A 11 11 ILE HA H 11 4.100 4.811 -0.711 1
1 86 . 10 1 1 A 11 11 ILE CA C 11 59.400 59.334 0.066 1
1 87 . 10 1 1 A 11 11 ILE CB C 11 41.800 40.313 1.487 1
1 91 . 10 1 1 A 11 11 ILE N N 11 114.600 121.374 -6.774 1
1 92 . 10 1 1 A 12 12 PHE H H 12 8.520 8.815 -0.295 1
1 93 . 10 1 1 A 12 12 PHE HA H 12 5.540 5.344 0.196 1
1 96 . 10 1 1 A 12 12 PHE CA C 12 55.000 56.895 -1.895 1
1 97 . 10 1 1 A 12 12 PHE CB C 12 41.200 40.763 0.437 1
1 98 . 10 1 1 A 12 12 PHE N N 12 118.600 123.223 -4.623 1
1 99 . 10 1 1 A 13 13 VAL H H 13 9.230 8.894 0.336 1
1 100 . 10 1 1 A 13 13 VAL HA H 13 4.740 5.340 -0.600 1
1 108 . 10 1 1 A 13 13 VAL CA C 13 60.300 60.487 -0.187 1
1 109 . 10 1 1 A 13 13 VAL CB C 13 34.100 35.413 -1.313 1
1 112 . 10 1 1 A 13 13 VAL N N 13 121.400 122.035 -0.635 1
1 113 . 10 1 1 A 14 14 LYS H H 14 8.910 8.838 0.072 1
1 114 . 10 1 1 A 14 14 LYS HA H 14 5.190 5.134 0.056 1
1 122 . 10 1 1 A 14 14 LYS CA C 14 54.600 54.556 0.044 1
1 123 . 10 1 1 A 14 14 LYS CB C 14 34.300 35.374 -1.074 1
1 126 . 10 1 1 A 14 14 LYS N N 14 128.000 126.448 1.552 1
1 127 . 10 1 1 A 15 15 THR H H 15 8.650 8.708 -0.058 1
1 128 . 10 1 1 A 15 15 THR HA H 15 4.870 4.841 0.029 1
1 133 . 10 1 1 A 15 15 THR CA C 15 60.300 60.053 0.247 1
1 134 . 10 1 1 A 15 15 THR CB C 15 70.600 71.171 -0.571 1
1 136 . 10 1 1 A 15 15 THR N N 15 115.300 113.492 1.808 1
1 137 . 10 1 1 A 16 16 LEU H H 16 9.070 8.944 0.126 1
1 138 . 10 1 1 A 16 16 LEU HA H 16 4.210 4.017 0.193 1
1 148 . 10 1 1 A 16 16 LEU CA C 16 57.400 57.837 -0.437 1
1 149 . 10 1 1 A 16 16 LEU CB C 16 41.800 41.314 0.486 1
1 153 . 10 1 1 A 16 16 LEU N N 16 121.400 122.076 -0.676 1
1 154 . 10 1 1 A 17 17 THR H H 17 7.560 7.428 0.132 1
1 155 . 10 1 1 A 17 17 THR HA H 17 4.330 4.321 0.009 1
1 160 . 10 1 1 A 17 17 THR CA C 17 61.400 63.182 -1.782 1
1 161 . 10 1 1 A 17 17 THR CB C 17 68.900 69.572 -0.672 1
1 163 . 10 1 1 A 17 17 THR N N 17 105.900 111.721 -5.821 1
1 164 . 10 1 1 A 18 18 GLY H H 18 7.750 7.801 -0.051 1
1 165 . 10 1 1 A 18 18 GLY HA2 H 18 4.250 4.074 0.176 1
1 166 . 10 1 1 A 18 18 GLY HA3 H 18 3.520 4.084 -0.564 1
1 167 . 10 1 1 A 18 18 GLY CA C 18 45.300 44.914 0.386 1
1 168 . 10 1 1 A 18 18 GLY N N 18 109.300 109.373 -0.073 1
1 169 . 10 1 1 A 19 19 LYS H H 19 7.210 7.804 -0.594 1
1 170 . 10 1 1 A 19 19 LYS HA H 19 4.260 4.335 -0.075 1
1 175 . 10 1 1 A 19 19 LYS CA C 19 56.300 56.411 -0.111 1
1 176 . 10 1 1 A 19 19 LYS CB C 19 33.200 33.802 -0.602 1
1 179 . 10 1 1 A 19 19 LYS N N 19 122.000 120.275 1.725 1
1 180 . 10 1 1 A 20 20 THR H H 20 8.570 8.623 -0.053 1
1 181 . 10 1 1 A 20 20 THR HA H 20 4.950 5.657 -0.707 1
1 186 . 10 1 1 A 20 20 THR CA C 20 62.200 60.298 1.902 1
1 187 . 10 1 1 A 20 20 THR CB C 20 69.700 70.548 -0.848 1
1 189 . 10 1 1 A 20 20 THR N N 20 120.700 112.694 8.006 1
1 190 . 10 1 1 A 21 21 ILE H H 21 9.510 8.537 0.973 1
1 191 . 10 1 1 A 21 21 ILE HA H 21 4.390 4.859 -0.469 1
1 201 . 10 1 1 A 21 21 ILE CA C 21 60.000 59.088 0.912 1
1 202 . 10 1 1 A 21 21 ILE CB C 21 40.700 41.522 -0.822 1
1 206 . 10 1 1 A 21 21 ILE N N 21 128.200 123.011 5.189 1
1 207 . 10 1 1 A 22 22 THR H H 22 8.700 8.673 0.027 1
1 208 . 10 1 1 A 22 22 THR HA H 22 4.860 4.491 0.369 1
1 213 . 10 1 1 A 22 22 THR CA C 22 62.100 62.930 -0.830 1
1 214 . 10 1 1 A 22 22 THR CB C 22 69.500 68.915 0.585 1
1 216 . 10 1 1 A 22 22 THR N N 22 122.300 121.615 0.685 1
1 217 . 10 1 1 A 23 23 LEU H H 23 8.720 8.865 -0.145 1
1 218 . 10 1 1 A 23 23 LEU HA H 23 4.690 5.038 -0.348 1
1 228 . 10 1 1 A 23 23 LEU CA C 23 52.700 53.553 -0.853 1
1 229 . 10 1 1 A 23 23 LEU CB C 23 46.600 45.749 0.851 1
1 233 . 10 1 1 A 23 23 LEU N N 23 125.400 127.315 -1.915 1
1 234 . 10 1 1 A 24 24 GLU H H 24 8.080 8.658 -0.578 1
1 235 . 10 1 1 A 24 24 GLU HA H 24 4.800 5.042 -0.242 1
1 238 . 10 1 1 A 24 24 GLU CA C 24 55.400 55.250 0.150 1
1 239 . 10 1 1 A 24 24 GLU CB C 24 30.100 31.964 -1.864 1
1 241 . 10 1 1 A 24 24 GLU N N 24 121.800 118.770 3.030 1
1 242 . 10 1 1 A 25 25 VAL H H 25 8.800 8.849 -0.049 1
1 243 . 10 1 1 A 25 25 VAL HA H 25 4.640 4.950 -0.310 1
1 251 . 10 1 1 A 25 25 VAL CA C 25 58.600 59.643 -1.043 1
1 252 . 10 1 1 A 25 25 VAL CB C 25 36.300 36.205 0.095 1
1 255 . 10 1 1 A 25 25 VAL N N 25 116.700 117.255 -0.555 1
1 256 . 10 1 1 A 26 26 GLU H H 26 8.500 8.454 0.046 1
1 257 . 10 1 1 A 26 26 GLU HA H 26 4.900 4.659 0.241 1
1 260 . 10 1 1 A 26 26 GLU CA C 26 53.000 53.294 -0.294 1
1 261 . 10 1 1 A 26 26 GLU CB C 26 31.200 32.927 -1.727 1
1 262 . 10 1 1 A 26 26 GLU N N 26 117.900 121.531 -3.631 1
1 263 . 10 1 1 A 27 27 PRO HA H 27 4.040 4.437 -0.397 1
1 270 . 10 1 1 A 27 27 PRO CA C 27 65.400 64.505 0.895 1
1 271 . 10 1 1 A 27 27 PRO CB C 27 31.700 31.894 -0.194 1
1 274 . 10 1 1 A 28 28 SER H H 28 7.010 8.133 -1.123 1
1 275 . 10 1 1 A 28 28 SER HA H 28 4.280 4.469 -0.189 1
1 278 . 10 1 1 A 28 28 SER CA C 28 57.400 57.944 -0.544 1
1 279 . 10 1 1 A 28 28 SER CB C 28 63.400 64.244 -0.844 1
1 280 . 10 1 1 A 28 28 SER N N 28 103.800 110.609 -6.809 1
1 281 . 10 1 1 A 29 29 ASP H H 29 7.960 7.471 0.489 1
1 282 . 10 1 1 A 29 29 ASP HA H 29 4.600 5.308 -0.708 1
1 285 . 10 1 1 A 29 29 ASP CA C 29 55.900 52.368 3.532 1
1 286 . 10 1 1 A 29 29 ASP CB C 29 41.000 44.337 -3.337 1
1 287 . 10 1 1 A 29 29 ASP N N 29 123.700 120.724 2.976 1
1 288 . 10 1 1 A 30 30 THR H H 30 7.780 8.463 -0.683 1
1 289 . 10 1 1 A 30 30 THR HA H 30 4.850 4.906 -0.056 1
1 294 . 10 1 1 A 30 30 THR CA C 30 59.400 59.315 0.085 1
1 295 . 10 1 1 A 30 30 THR CB C 30 71.100 71.511 -0.411 1
1 297 . 10 1 1 A 30 30 THR N N 30 108.800 113.198 -4.398 1
1 298 . 10 1 1 A 31 31 ILE H H 31 8.320 9.044 -0.724 1
1 299 . 10 1 1 A 31 31 ILE HA H 31 3.580 3.764 -0.184 1
1 309 . 10 1 1 A 31 31 ILE CA C 31 62.200 64.661 -2.461 1
1 310 . 10 1 1 A 31 31 ILE CB C 31 34.300 37.859 -3.559 1
1 314 . 10 1 1 A 31 31 ILE N N 31 121.300 126.443 -5.143 1
1 315 . 10 1 1 A 32 32 GLU H H 32 9.850 8.179 1.671 1
1 316 . 10 1 1 A 32 32 GLU HA H 32 3.780 4.009 -0.229 1
1 321 . 10 1 1 A 32 32 GLU CA C 32 60.500 59.108 1.392 1
1 322 . 10 1 1 A 32 32 GLU CB C 32 28.800 29.333 -0.533 1
1 324 . 10 1 1 A 32 32 GLU N N 32 121.600 122.749 -1.149 1
1 325 . 10 1 1 A 33 33 ASN H H 33 7.810 7.790 0.020 1
1 326 . 10 1 1 A 33 33 ASN HA H 33 4.440 4.677 -0.237 1
1 329 . 10 1 1 A 33 33 ASN CA C 33 55.800 55.674 0.126 1
1 330 . 10 1 1 A 33 33 ASN CB C 33 38.100 38.643 -0.543 1
1 331 . 10 1 1 A 33 33 ASN N N 33 121.000 116.936 4.064 1
1 332 . 10 1 1 A 34 34 VAL H H 34 8.000 7.859 0.141 1
1 333 . 10 1 1 A 34 34 VAL HA H 34 3.300 3.979 -0.679 1
1 341 . 10 1 1 A 34 34 VAL CA C 34 67.600 65.424 2.176 1
1 342 . 10 1 1 A 34 34 VAL CB C 34 30.700 31.320 -0.620 1
1 345 . 10 1 1 A 34 34 VAL N N 34 122.200 116.531 5.669 1
1 346 . 10 1 1 A 35 35 LYS H H 35 8.490 8.084 0.406 1
1 347 . 10 1 1 A 35 35 LYS HA H 35 4.500 4.089 0.411 1
1 352 . 10 1 1 A 35 35 LYS CA C 35 59.300 58.618 0.682 1
1 353 . 10 1 1 A 35 35 LYS CB C 35 33.500 31.936 1.564 1
1 354 . 10 1 1 A 35 35 LYS N N 35 119.200 121.084 -1.884 1
1 355 . 10 1 1 A 36 36 ALA H H 36 7.880 8.270 -0.390 1
1 356 . 10 1 1 A 36 36 ALA HA H 36 4.060 4.129 -0.069 1
1 360 . 10 1 1 A 36 36 ALA CA C 36 55.300 54.954 0.346 1
1 361 . 10 1 1 A 36 36 ALA CB C 36 17.600 18.378 -0.778 1
1 362 . 10 1 1 A 36 36 ALA N N 36 123.300 121.829 1.471 1
1 363 . 10 1 1 A 37 37 LYS H H 37 7.790 7.741 0.049 1
1 364 . 10 1 1 A 37 37 LYS HA H 37 4.110 4.109 0.001 1
1 373 . 10 1 1 A 37 37 LYS CA C 37 59.700 59.471 0.229 1
1 374 . 10 1 1 A 37 37 LYS CB C 37 33.100 32.407 0.693 1
1 378 . 10 1 1 A 37 37 LYS N N 37 120.400 117.515 2.885 1
1 379 . 10 1 1 A 38 38 ILE H H 38 8.240 8.250 -0.010 1
1 380 . 10 1 1 A 38 38 ILE HA H 38 3.410 3.904 -0.494 1
1 390 . 10 1 1 A 38 38 ILE CA C 38 66.200 63.370 2.830 1
1 391 . 10 1 1 A 38 38 ILE CB C 38 36.800 37.519 -0.719 1
1 395 . 10 1 1 A 38 38 ILE N N 38 121.400 120.262 1.138 1
1 396 . 10 1 1 A 39 39 GLN H H 39 8.460 8.143 0.317 1
1 397 . 10 1 1 A 39 39 GLN HA H 39 3.730 4.020 -0.290 1
1 402 . 10 1 1 A 39 39 GLN CA C 39 60.000 58.484 1.516 1
1 403 . 10 1 1 A 39 39 GLN CB C 39 27.600 28.752 -1.152 1
1 405 . 10 1 1 A 39 39 GLN N N 39 123.500 120.654 2.846 1
1 406 . 10 1 1 A 40 40 ASP H H 40 7.970 7.920 0.050 1
1 407 . 10 1 1 A 40 40 ASP HA H 40 4.240 4.428 -0.188 1
1 410 . 10 1 1 A 40 40 ASP CA C 40 57.400 56.789 0.611 1
1 411 . 10 1 1 A 40 40 ASP CB C 40 41.000 40.681 0.319 1
1 412 . 10 1 1 A 40 40 ASP N N 40 119.900 119.315 0.585 1
1 413 . 10 1 1 A 41 41 LYS H H 41 7.420 7.957 -0.537 1
1 414 . 10 1 1 A 41 41 LYS HA H 41 4.200 4.129 0.071 1
1 423 . 10 1 1 A 41 41 LYS CA C 41 58.200 59.057 -0.857 1
1 424 . 10 1 1 A 41 41 LYS CB C 41 33.900 32.820 1.080 1
1 427 . 10 1 1 A 41 41 LYS N N 41 115.700 119.102 -3.402 1
1 428 . 10 1 1 A 42 42 GLU H H 42 8.650 7.667 0.983 1
1 429 . 10 1 1 A 42 42 GLU HA H 42 4.470 4.818 -0.348 1
1 434 . 10 1 1 A 42 42 GLU CA C 42 55.300 55.861 -0.561 1
1 435 . 10 1 1 A 42 42 GLU CB C 42 33.200 32.198 1.002 1
1 437 . 10 1 1 A 42 42 GLU N N 42 114.200 113.672 0.528 1
1 438 . 10 1 1 A 43 43 GLY H H 43 8.400 7.753 0.647 1
1 439 . 10 1 1 A 43 43 GLY HA2 H 43 4.040 4.014 0.026 1
1 440 . 10 1 1 A 43 43 GLY HA3 H 43 3.820 4.032 -0.212 1
1 441 . 10 1 1 A 43 43 GLY CA C 43 45.900 45.627 0.273 1
1 442 . 10 1 1 A 43 43 GLY N N 43 109.000 109.837 -0.837 1
1 443 . 10 1 1 A 44 44 ILE H H 44 6.080 7.932 -1.852 1
1 444 . 10 1 1 A 44 44 ILE HA H 44 4.290 4.281 0.009 1
1 446 . 10 1 1 A 44 44 ILE CA C 44 57.700 59.753 -2.053 1
1 447 . 10 1 1 A 44 44 ILE CB C 44 40.400 38.641 1.759 1
1 448 . 10 1 1 A 44 44 ILE N N 44 120.500 122.779 -2.279 1
1 449 . 10 1 1 A 46 46 PRO HA H 46 4.030 4.325 -0.295 1
1 454 . 10 1 1 A 46 46 PRO CA C 46 66.100 65.098 1.002 1
1 455 . 10 1 1 A 46 46 PRO CB C 46 32.600 31.896 0.704 1
1 458 . 10 1 1 A 47 47 ASP H H 47 8.470 8.854 -0.384 1
1 459 . 10 1 1 A 47 47 ASP HA H 47 4.310 4.371 -0.061 1
1 462 . 10 1 1 A 47 47 ASP CA C 47 55.700 56.796 -1.096 1
1 463 . 10 1 1 A 47 47 ASP CB C 47 39.700 39.596 0.104 1
1 464 . 10 1 1 A 47 47 ASP N N 47 113.700 116.693 -2.993 1
1 465 . 10 1 1 A 48 48 GLN H H 48 7.720 7.758 -0.038 1
1 466 . 10 1 1 A 48 48 GLN HA H 48 4.340 4.462 -0.122 1
1 471 . 10 1 1 A 48 48 GLN CA C 48 55.500 56.858 -1.358 1
1 472 . 10 1 1 A 48 48 GLN CB C 48 29.900 30.142 -0.242 1
1 474 . 10 1 1 A 48 48 GLN N N 48 116.900 118.065 -1.165 1
1 475 . 10 1 1 A 49 49 GLN H H 49 7.410 8.015 -0.605 1
1 476 . 10 1 1 A 49 49 GLN HA H 49 4.110 4.100 0.010 1
1 481 . 10 1 1 A 49 49 GLN CA C 49 56.600 56.457 0.143 1
1 482 . 10 1 1 A 49 49 GLN CB C 49 31.300 29.291 2.009 1
1 484 . 10 1 1 A 49 49 GLN N N 49 118.000 119.568 -1.568 1
1 485 . 10 1 1 A 50 50 ARG H H 50 8.400 8.636 -0.236 1
1 486 . 10 1 1 A 50 50 ARG HA H 50 4.380 4.710 -0.330 1
1 491 . 10 1 1 A 50 50 ARG CA C 50 55.100 55.249 -0.149 1
1 492 . 10 1 1 A 50 50 ARG CB C 50 31.600 32.620 -1.020 1
1 494 . 10 1 1 A 50 50 ARG N N 50 123.100 125.625 -2.525 1
1 495 . 10 1 1 A 51 51 LEU H H 51 8.710 8.733 -0.023 1
1 496 . 10 1 1 A 51 51 LEU HA H 51 5.300 5.161 0.139 1
1 506 . 10 1 1 A 51 51 LEU CA C 51 52.900 53.546 -0.646 1
1 507 . 10 1 1 A 51 51 LEU CB C 51 45.700 44.617 1.083 1
1 511 . 10 1 1 A 51 51 LEU N N 51 124.400 124.215 0.185 1
1 512 . 10 1 1 A 52 52 ILE H H 52 9.060 9.025 0.035 1
1 513 . 10 1 1 A 52 52 ILE HA H 52 4.840 5.060 -0.220 1
1 523 . 10 1 1 A 52 52 ILE CA C 52 58.900 60.110 -1.210 1
1 524 . 10 1 1 A 52 52 ILE CB C 52 41.200 40.994 0.206 1
1 528 . 10 1 1 A 52 52 ILE N N 52 122.500 126.877 -4.377 1
1 529 . 10 1 1 A 53 53 PHE H H 53 8.730 9.537 -0.807 1
1 530 . 10 1 1 A 53 53 PHE HA H 53 5.100 4.838 0.262 1
1 535 . 10 1 1 A 53 53 PHE CA C 53 56.300 57.450 -1.150 1
1 536 . 10 1 1 A 53 53 PHE CB C 53 43.500 42.025 1.475 1
1 537 . 10 1 1 A 53 53 PHE N N 53 124.800 127.921 -3.121 1
1 538 . 10 1 1 A 54 54 ALA H H 54 8.940 9.169 -0.229 1
1 539 . 10 1 1 A 54 54 ALA HA H 54 3.610 3.904 -0.294 1
1 543 . 10 1 1 A 54 54 ALA CA C 54 52.500 53.011 -0.511 1
1 544 . 10 1 1 A 54 54 ALA CB C 54 16.300 17.324 -1.024 1
1 545 . 10 1 1 A 54 54 ALA N N 54 133.100 130.471 2.629 1
1 546 . 10 1 1 A 55 55 GLY H H 55 8.070 8.539 -0.469 1
1 547 . 10 1 1 A 55 55 GLY HA2 H 55 4.000 3.823 0.177 1
1 548 . 10 1 1 A 55 55 GLY HA3 H 55 3.340 3.867 -0.527 1
1 549 . 10 1 1 A 55 55 GLY CA C 55 45.200 45.293 -0.093 1
1 550 . 10 1 1 A 55 55 GLY N N 55 102.500 102.691 -0.191 1
1 551 . 10 1 1 A 56 56 LYS H H 56 7.860 7.961 -0.101 1
1 552 . 10 1 1 A 56 56 LYS HA H 56 4.510 4.572 -0.062 1
1 558 . 10 1 1 A 56 56 LYS CA C 56 54.500 54.690 -0.190 1
1 559 . 10 1 1 A 56 56 LYS CB C 56 34.400 33.776 0.624 1
1 561 . 10 1 1 A 56 56 LYS N N 56 121.800 121.923 -0.123 1
1 562 . 10 1 1 A 57 57 GLN H H 57 8.600 8.385 0.215 1
1 563 . 10 1 1 A 57 57 GLN HA H 57 4.410 4.774 -0.364 1
1 568 . 10 1 1 A 57 57 GLN CA C 57 55.900 55.439 0.461 1
1 569 . 10 1 1 A 57 57 GLN CB C 57 28.800 29.633 -0.833 1
1 571 . 10 1 1 A 57 57 GLN N N 57 123.200 123.907 -0.707 1
1 572 . 10 1 1 A 58 58 LEU H H 58 8.480 8.781 -0.301 1
1 573 . 10 1 1 A 58 58 LEU HA H 58 4.060 4.966 -0.906 1
1 583 . 10 1 1 A 58 58 LEU CA C 58 54.100 53.378 0.722 1
1 584 . 10 1 1 A 58 58 LEU CB C 58 41.500 46.007 -4.507 1
1 588 . 10 1 1 A 58 58 LEU N N 58 125.900 121.918 3.982 1
1 589 . 10 1 1 A 59 59 GLU H H 59 8.400 8.785 -0.385 1
1 590 . 10 1 1 A 59 59 GLU HA H 59 4.400 4.679 -0.279 1
1 595 . 10 1 1 A 59 59 GLU CA C 59 55.900 57.204 -1.304 1
1 596 . 10 1 1 A 59 59 GLU CB C 59 31.900 32.374 -0.474 1
1 598 . 10 1 1 A 59 59 GLU N N 59 123.100 118.616 4.484 1
1 599 . 10 1 1 A 60 60 ASP H H 60 8.110 7.864 0.246 1
1 600 . 10 1 1 A 60 60 ASP HA H 60 4.270 4.515 -0.245 1
1 603 . 10 1 1 A 60 60 ASP CA C 60 57.100 55.433 1.667 1
1 604 . 10 1 1 A 60 60 ASP CB C 60 40.800 41.525 -0.725 1
1 605 . 10 1 1 A 60 60 ASP N N 60 120.300 119.663 0.637 1
1 606 . 10 1 1 A 61 61 GLY HA2 H 61 4.000 4.220 -0.220 1
1 607 . 10 1 1 A 61 61 GLY HA3 H 61 3.830 4.244 -0.414 1
1 608 . 10 1 1 A 61 61 GLY CA C 61 45.000 45.237 -0.237 1
1 609 . 10 1 1 A 62 62 ARG H H 62 7.350 8.774 -1.424 1
1 610 . 10 1 1 A 62 62 ARG HA H 62 4.640 4.912 -0.272 1
1 615 . 10 1 1 A 62 62 ARG CA C 62 54.400 53.925 0.475 1
1 616 . 10 1 1 A 62 62 ARG CB C 62 32.600 34.523 -1.923 1
1 618 . 10 1 1 A 62 62 ARG N N 62 119.300 125.573 -6.273 1
1 619 . 10 1 1 A 63 63 THR H H 63 8.460 8.295 0.165 1
1 620 . 10 1 1 A 63 63 THR HA H 63 5.060 4.745 0.315 1
1 625 . 10 1 1 A 63 63 THR CA C 63 59.700 60.932 -1.232 1
1 626 . 10 1 1 A 63 63 THR CB C 63 72.000 71.230 0.770 1
1 628 . 10 1 1 A 63 63 THR N N 63 109.100 112.702 -3.602 1
1 629 . 10 1 1 A 64 64 LEU H H 64 8.190 8.740 -0.550 1
1 630 . 10 1 1 A 64 64 LEU HA H 64 3.920 3.949 -0.029 1
1 640 . 10 1 1 A 64 64 LEU CA C 64 58.400 57.936 0.464 1
1 641 . 10 1 1 A 64 64 LEU CB C 64 40.200 41.358 -1.158 1
1 645 . 10 1 1 A 64 64 LEU N N 64 118.100 122.918 -4.818 1
1 646 . 10 1 1 A 65 65 SER H H 65 8.370 7.709 0.661 1
1 647 . 10 1 1 A 65 65 SER HA H 65 4.150 4.204 -0.054 1
1 650 . 10 1 1 A 65 65 SER CA C 65 60.900 60.474 0.426 1
1 651 . 10 1 1 A 65 65 SER CB C 65 62.500 63.329 -0.829 1
1 652 . 10 1 1 A 65 65 SER N N 65 112.200 114.317 -2.117 1
1 653 . 10 1 1 A 66 66 GLU H H 66 7.780 7.961 -0.181 1
1 654 . 10 1 1 A 66 66 GLU HA H 66 3.890 4.134 -0.244 1
1 659 . 10 1 1 A 66 66 GLU CA C 66 59.200 58.898 0.302 1
1 660 . 10 1 1 A 66 66 GLU CB C 66 29.400 29.580 -0.180 1
1 662 . 10 1 1 A 66 66 GLU N N 66 123.600 121.974 1.626 1
1 663 . 10 1 1 A 67 67 TYR H H 67 7.290 7.627 -0.337 1
1 664 . 10 1 1 A 67 67 TYR HA H 67 4.590 4.561 0.029 1
1 669 . 10 1 1 A 67 67 TYR CA C 67 58.400 59.526 -1.126 1
1 670 . 10 1 1 A 67 67 TYR CB C 67 39.800 39.084 0.716 1
1 671 . 10 1 1 A 67 67 TYR N N 67 116.400 119.652 -3.252 1
1 672 . 10 1 1 A 68 68 ASN H H 68 8.040 8.001 0.039 1
1 673 . 10 1 1 A 68 68 ASN HA H 68 4.240 4.341 -0.101 1
1 676 . 10 1 1 A 68 68 ASN CA C 68 54.100 54.209 -0.109 1
1 677 . 10 1 1 A 68 68 ASN CB C 68 37.200 37.509 -0.309 1
1 678 . 10 1 1 A 68 68 ASN N N 68 115.600 116.805 -1.205 1
1 679 . 10 1 1 A 69 69 ILE H H 69 7.200 7.290 -0.090 1
1 680 . 10 1 1 A 69 69 ILE HA H 69 3.280 4.433 -1.153 1
1 690 . 10 1 1 A 69 69 ILE CA C 69 59.800 59.514 0.286 1
1 691 . 10 1 1 A 69 69 ILE CB C 69 36.600 39.068 -2.468 1
1 695 . 10 1 1 A 69 69 ILE N N 69 119.100 115.506 3.594 1
1 696 . 10 1 1 A 70 70 GLN H H 70 7.570 8.865 -1.295 1
1 697 . 10 1 1 A 70 70 GLN HA H 70 4.410 4.541 -0.131 1
1 702 . 10 1 1 A 70 70 GLN CA C 70 53.500 55.188 -1.688 1
1 703 . 10 1 1 A 70 70 GLN CB C 70 31.500 29.112 2.388 1
1 705 . 10 1 1 A 70 70 GLN N N 70 124.800 120.503 4.297 1
1 706 . 10 1 1 A 71 71 LYS H H 71 8.370 7.415 0.955 1
1 707 . 10 1 1 A 71 71 LYS HA H 71 3.870 3.284 0.586 1
1 716 . 10 1 1 A 71 71 LYS CA C 71 58.000 57.887 0.113 1
1 717 . 10 1 1 A 71 71 LYS CB C 71 32.500 31.940 0.560 1
1 720 . 10 1 1 A 71 71 LYS N N 71 120.200 120.939 -0.739 1
1 721 . 10 1 1 A 72 72 GLU H H 72 9.230 8.424 0.806 1
1 722 . 10 1 1 A 72 72 GLU HA H 72 3.240 4.124 -0.884 1
1 727 . 10 1 1 A 72 72 GLU CA C 72 58.300 56.573 1.727 1
1 728 . 10 1 1 A 72 72 GLU CB C 72 26.000 28.767 -2.767 1
1 730 . 10 1 1 A 72 72 GLU N N 72 115.100 115.687 -0.587 1
1 731 . 10 1 1 A 73 73 SER H H 73 7.690 8.490 -0.800 1
1 732 . 10 1 1 A 73 73 SER HA H 73 4.520 4.709 -0.189 1
1 735 . 10 1 1 A 73 73 SER CA C 73 61.100 59.309 1.791 1
1 736 . 10 1 1 A 73 73 SER CB C 73 64.800 64.315 0.485 1
1 737 . 10 1 1 A 73 73 SER N N 73 115.300 115.092 0.208 1
1 738 . 10 1 1 A 74 74 THR H H 74 8.620 7.899 0.721 1
1 739 . 10 1 1 A 74 74 THR HA H 74 5.200 5.040 0.160 1
1 744 . 10 1 1 A 74 74 THR CA C 74 62.400 61.716 0.684 1
1 745 . 10 1 1 A 74 74 THR CB C 74 70.200 70.802 -0.602 1
1 747 . 10 1 1 A 74 74 THR N N 74 117.500 112.378 5.122 1
1 748 . 10 1 1 A 75 75 LEU H H 75 9.350 8.507 0.843 1
1 749 . 10 1 1 A 75 75 LEU HA H 75 4.990 4.895 0.095 1
1 759 . 10 1 1 A 75 75 LEU CA C 75 53.800 53.731 0.069 1
1 760 . 10 1 1 A 75 75 LEU CB C 75 44.400 46.109 -1.709 1
1 764 . 10 1 1 A 75 75 LEU N N 75 128.000 127.233 0.767 1
1 765 . 10 1 1 A 76 76 HIS H H 76 9.140 8.486 0.654 1
1 766 . 10 1 1 A 76 76 HIS HA H 76 5.040 5.159 -0.119 1
1 769 . 10 1 1 A 76 76 HIS CA C 76 56.200 54.595 1.605 1
1 770 . 10 1 1 A 76 76 HIS CB C 76 32.500 31.817 0.683 1
1 771 . 10 1 1 A 76 76 HIS N N 76 119.600 120.893 -1.293 1
1 772 . 10 1 1 A 77 77 LEU H H 77 8.240 8.948 -0.708 1
1 773 . 10 1 1 A 77 77 LEU HA H 77 5.080 5.456 -0.376 1
1 783 . 10 1 1 A 77 77 LEU CA C 77 53.600 53.767 -0.167 1
1 784 . 10 1 1 A 77 77 LEU CB C 77 44.100 43.372 0.728 1
1 788 . 10 1 1 A 77 77 LEU N N 77 123.800 121.277 2.523 1
1 789 . 10 1 1 A 78 78 VAL H H 78 9.110 8.833 0.277 1
1 790 . 10 1 1 A 78 78 VAL HA H 78 4.260 4.645 -0.385 1
1 798 . 10 1 1 A 78 78 VAL CA C 78 60.400 61.167 -0.767 1
1 799 . 10 1 1 A 78 78 VAL CB C 78 34.700 35.575 -0.875 1
1 802 . 10 1 1 A 78 78 VAL N N 78 127.100 124.184 2.916 1
1 803 . 10 1 1 A 79 79 LEU H H 79 8.050 8.882 -0.832 1
1 804 . 10 1 1 A 79 79 LEU HA H 79 4.950 4.925 0.025 1
1 813 . 10 1 1 A 79 79 LEU CA C 79 53.800 53.154 0.646 1
1 814 . 10 1 1 A 79 79 LEU CB C 79 42.700 44.662 -1.962 1
1 818 . 10 1 1 A 79 79 LEU N N 79 123.400 129.272 -5.872 1
1 819 . 10 1 1 A 80 80 ARG H H 80 8.540 9.065 -0.525 1
1 820 . 10 1 1 A 80 80 ARG HA H 80 4.170 3.946 0.224 1
1 827 . 10 1 1 A 80 80 ARG CA C 80 55.800 56.930 -1.130 1
1 828 . 10 1 1 A 80 80 ARG CB C 80 31.100 28.787 2.313 1
1 830 . 10 1 1 A 80 80 ARG N N 80 123.500 126.284 -2.784 1
1 831 . 10 1 1 A 81 81 LEU H H 81 8.250 7.722 0.528 1
1 832 . 10 1 1 A 81 81 LEU HA H 81 4.270 4.290 -0.020 1
1 842 . 10 1 1 A 81 81 LEU CA C 81 55.000 54.443 0.557 1
1 843 . 10 1 1 A 81 81 LEU CB C 81 42.200 43.408 -1.208 1
1 847 . 10 1 1 A 81 81 LEU N N 81 124.100 118.769 5.331 1
1 848 . 10 1 1 A 82 82 ARG H H 82 8.310 8.968 -0.658 1
1 849 . 10 1 1 A 82 82 ARG HA H 82 4.200 4.560 -0.360 1
1 852 . 10 1 1 A 82 82 ARG CA C 82 56.300 56.879 -0.579 1
1 853 . 10 1 1 A 82 82 ARG CB C 82 30.700 32.444 -1.744 1
1 855 . 10 1 1 A 82 82 ARG N N 82 121.500 118.059 3.441 1
1 856 . 10 1 1 A 83 83 GLY H H 83 8.410 8.131 0.279 1
1 857 . 10 1 1 A 83 83 GLY HA2 H 83 3.750 4.096 -0.346 1
1 858 . 10 1 1 A 83 83 GLY HA3 H 83 3.754 4.097 -0.343 1
1 859 . 10 1 1 A 83 83 GLY CA C 83 45.100 45.322 -0.222 1
1 860 . 10 1 1 A 83 83 GLY N N 83 110.200 104.836 5.364 1
1 861 . 10 1 1 A 84 84 TYR H H 84 7.950 8.253 -0.303 1
1 862 . 10 1 1 A 84 84 TYR HA H 84 4.400 5.006 -0.606 1
1 865 . 10 1 1 A 84 84 TYR CA C 84 58.100 58.055 0.045 1
1 866 . 10 1 1 A 84 84 TYR CB C 84 38.800 42.119 -3.319 1
1 867 . 10 1 1 A 84 84 TYR N N 84 119.900 124.791 -4.891 1
1 868 . 10 1 1 A 85 85 ALA H H 85 8.150 8.271 -0.121 1
1 869 . 10 1 1 A 85 85 ALA HA H 85 4.150 5.236 -1.086 1
1 873 . 10 1 1 A 85 85 ALA CA C 85 52.600 50.430 2.170 1
1 874 . 10 1 1 A 85 85 ALA CB C 85 19.200 23.775 -4.575 1
1 875 . 10 1 1 A 85 85 ALA N N 85 124.800 129.823 -5.023 1
1 876 . 10 1 1 A 86 86 ASP H H 86 8.020 8.743 -0.723 1
1 877 . 10 1 1 A 86 86 ASP HA H 86 4.450 4.943 -0.493 1
1 880 . 10 1 1 A 86 86 ASP CA C 86 54.100 52.878 1.222 1
1 881 . 10 1 1 A 86 86 ASP CB C 86 41.100 45.521 -4.421 1
1 882 . 10 1 1 A 86 86 ASP N N 86 118.900 117.081 1.819 1
1 883 . 10 1 1 A 87 87 LEU H H 87 8.010 8.401 -0.391 1
1 884 . 10 1 1 A 87 87 LEU HA H 87 4.210 4.671 -0.461 1
1 893 . 10 1 1 A 87 87 LEU CA C 87 55.300 53.809 1.491 1
1 894 . 10 1 1 A 87 87 LEU CB C 87 42.000 42.344 -0.344 1
1 898 . 10 1 1 A 87 87 LEU N N 87 122.400 117.497 4.903 1
1 899 . 10 1 1 A 88 88 ARG H H 88 8.170 7.716 0.454 1
1 900 . 10 1 1 A 88 88 ARG HA H 88 4.210 4.526 -0.316 1
1 903 . 10 1 1 A 88 88 ARG CA C 88 56.300 56.078 0.222 1
1 904 . 10 1 1 A 88 88 ARG CB C 88 30.600 33.122 -2.522 1
1 905 . 10 1 1 A 88 88 ARG N N 88 121.200 120.299 0.901 1
1 906 . 10 1 1 A 91 91 PRO HA H 91 4.290 4.697 -0.407 1
1 911 . 10 1 1 A 91 91 PRO CA C 91 63.800 62.802 0.998 1
1 912 . 10 1 1 A 91 91 PRO CB C 91 32.100 31.544 0.556 1
1 915 . 10 1 1 A 92 92 ASP H H 92 8.280 8.515 -0.235 1
1 916 . 10 1 1 A 92 92 ASP HA H 92 4.540 5.262 -0.722 1
1 919 . 10 1 1 A 92 92 ASP CA C 92 54.600 53.069 1.531 1
1 920 . 10 1 1 A 92 92 ASP CB C 92 41.000 44.453 -3.453 1
1 921 . 10 1 1 A 92 92 ASP N N 92 118.700 117.731 0.969 1
1 922 . 10 1 1 A 93 93 ARG H H 93 7.780 8.671 -0.891 1
1 923 . 10 1 1 A 93 93 ARG HA H 93 4.190 4.880 -0.690 1
1 930 . 10 1 1 A 93 93 ARG CA C 93 56.300 54.112 2.188 1
1 931 . 10 1 1 A 93 93 ARG CB C 93 30.700 33.816 -3.116 1
1 934 . 10 1 1 A 93 93 ARG N N 93 120.700 121.161 -0.461 1
1 935 . 10 1 1 A 94 94 GLN H H 94 8.280 8.855 -0.575 1
1 936 . 10 1 1 A 94 94 GLN HA H 94 4.210 5.202 -0.992 1
1 941 . 10 1 1 A 94 94 GLN CA C 94 55.800 53.563 2.237 1
1 942 . 10 1 1 A 94 94 GLN CB C 94 29.300 32.146 -2.846 1
1 944 . 10 1 1 A 94 94 GLN N N 94 121.000 117.367 3.633 1
1 945 . 10 1 1 A 95 95 ASP H H 95 8.270 8.559 -0.289 1
1 946 . 10 1 1 A 95 95 ASP HA H 95 4.450 5.525 -1.075 1
1 949 . 10 1 1 A 95 95 ASP CA C 95 54.300 52.736 1.564 1
1 950 . 10 1 1 A 95 95 ASP CB C 95 41.000 44.371 -3.371 1
1 951 . 10 1 1 A 95 95 ASP N N 95 121.000 119.182 1.818 1
1 952 . 10 1 1 A 96 96 HIS H H 96 8.090 8.721 -0.631 1
1 953 . 10 1 1 A 96 96 HIS HA H 96 4.470 5.608 -1.138 1
1 956 . 10 1 1 A 96 96 HIS CA C 96 55.900 54.064 1.836 1
1 957 . 10 1 1 A 96 96 HIS CB C 96 30.500 33.660 -3.160 1
1 958 . 10 1 1 A 96 96 HIS N N 96 119.300 115.715 3.585 1
1 959 . 10 1 1 A 97 97 HIS H H 97 8.240 8.876 -0.636 1
1 960 . 10 1 1 A 97 97 HIS HA H 97 4.470 4.748 -0.278 1
1 963 . 10 1 1 A 97 97 HIS CA C 97 56.200 54.755 1.445 1
1 964 . 10 1 1 A 97 97 HIS CB C 97 30.400 30.318 0.082 1
1 965 . 10 1 1 A 97 97 HIS N N 97 121.300 119.328 1.972 1
1 966 . 10 1 1 A 98 98 PRO HA H 98 4.340 4.464 -0.124 1
1 973 . 10 1 1 A 98 98 PRO CA C 98 63.700 63.041 0.659 1
1 974 . 10 1 1 A 98 98 PRO CB C 98 31.900 32.832 -0.932 1
1 977 . 10 1 1 A 99 99 GLY H H 99 8.660 8.075 0.585 1
1 978 . 10 1 1 A 99 99 GLY HA2 H 99 3.920 4.120 -0.200 1
1 979 . 10 1 1 A 99 99 GLY HA3 H 99 3.920 4.141 -0.221 1
1 980 . 10 1 1 A 99 99 GLY CA C 99 45.200 45.426 -0.226 1
1 981 . 10 1 1 A 99 99 GLY N N 99 110.000 108.644 1.356 1
1 982 . 10 1 1 A 100 100 SER H H 100 8.170 8.877 -0.707 1
1 983 . 10 1 1 A 100 100 SER HA H 100 4.360 5.189 -0.829 1
1 986 . 10 1 1 A 100 100 SER CA C 100 58.500 57.811 0.689 1
1 987 . 10 1 1 A 100 100 SER CB C 100 64.000 66.525 -2.525 1
1 988 . 10 1 1 A 100 100 SER N N 100 115.600 120.222 -4.622 1
1 989 . 10 1 1 A 101 101 GLY H H 101 8.420 8.289 0.131 1
1 990 . 10 1 1 A 101 101 GLY HA2 H 101 3.890 4.143 -0.253 1
1 991 . 10 1 1 A 101 101 GLY HA3 H 101 3.920 4.143 -0.223 1
1 992 . 10 1 1 A 101 101 GLY CA C 101 45.200 45.721 -0.521 1
1 993 . 10 1 1 A 101 101 GLY N N 101 111.000 111.075 -0.075 1
1 994 . 10 1 1 A 102 102 ALA H H 102 8.030 8.432 -0.402 1
1 995 . 10 1 1 A 102 102 ALA HA H 102 4.250 3.921 0.329 1
1 999 . 10 1 1 A 102 102 ALA CA C 102 52.500 52.891 -0.391 1
1 1000 . 10 1 1 A 102 102 ALA CB C 102 19.200 17.259 1.941 1
1 4 . 11 1 1 A 2 2 SER H H 2 8.160 8.938 -0.778 1
1 5 . 11 1 1 A 2 2 SER HA H 2 4.370 5.020 -0.650 1
1 9 . 11 1 1 A 2 2 SER CA C 2 58.300 57.577 0.723 1
1 10 . 11 1 1 A 2 2 SER CB C 2 63.900 66.177 -2.277 1
1 11 . 11 1 1 A 2 2 SER N N 2 115.600 121.411 -5.811 1
1 12 . 11 1 1 A 3 3 LEU H H 3 8.250 8.596 -0.346 1
1 13 . 11 1 1 A 3 3 LEU HA H 3 4.280 4.208 0.072 1
1 17 . 11 1 1 A 3 3 LEU CA C 3 55.200 54.867 0.333 1
1 18 . 11 1 1 A 3 3 LEU CB C 3 42.100 42.907 -0.807 1
1 19 . 11 1 1 A 3 3 LEU N N 3 124.100 124.268 -0.168 1
1 20 . 11 1 1 A 4 4 VAL H H 4 7.950 8.433 -0.483 1
1 21 . 11 1 1 A 4 4 VAL HA H 4 4.680 4.451 0.229 1
1 26 . 11 1 1 A 4 4 VAL CA C 4 59.800 60.855 -1.055 1
1 27 . 11 1 1 A 4 4 VAL CB C 4 32.500 31.604 0.896 1
1 28 . 11 1 1 A 4 4 VAL N N 4 122.600 117.118 5.482 1
1 29 . 11 1 1 A 5 5 PRO CA C 5 63.100 64.845 -1.745 1
1 30 . 11 1 1 A 5 5 PRO CB C 5 32.000 32.098 -0.098 1
1 32 . 11 1 1 A 6 6 ARG H H 6 8.360 7.559 0.801 1
1 33 . 11 1 1 A 6 6 ARG HA H 6 4.250 4.719 -0.469 1
1 36 . 11 1 1 A 6 6 ARG CA C 6 56.000 54.711 1.289 1
1 37 . 11 1 1 A 6 6 ARG CB C 6 30.900 33.498 -2.598 1
1 38 . 11 1 1 A 6 6 ARG N N 6 121.800 112.810 8.990 1
1 39 . 11 1 1 A 7 7 GLY H H 7 8.460 8.300 0.160 1
1 40 . 11 1 1 A 7 7 GLY HA2 H 7 3.940 4.121 -0.181 1
1 41 . 11 1 1 A 7 7 GLY HA3 H 7 3.760 4.130 -0.370 1
1 42 . 11 1 1 A 7 7 GLY CA C 7 45.000 44.517 0.483 1
1 43 . 11 1 1 A 7 7 GLY N N 7 110.700 107.793 2.907 1
1 44 . 11 1 1 A 8 8 SER H H 8 7.990 8.141 -0.151 1
1 45 . 11 1 1 A 8 8 SER HA H 8 4.450 4.593 -0.143 1
1 48 . 11 1 1 A 8 8 SER CA C 8 58.900 59.795 -0.895 1
1 49 . 11 1 1 A 8 8 SER CB C 8 64.200 65.002 -0.802 1
1 50 . 11 1 1 A 8 8 SER N N 8 115.500 116.319 -0.819 1
1 51 . 11 1 1 A 9 9 MET H H 9 9.040 7.858 1.182 1
1 52 . 11 1 1 A 9 9 MET HA H 9 4.610 5.084 -0.474 1
1 60 . 11 1 1 A 9 9 MET CA C 9 54.400 53.485 0.915 1
1 61 . 11 1 1 A 9 9 MET CB C 9 35.400 33.731 1.669 1
1 64 . 11 1 1 A 9 9 MET N N 9 120.500 117.468 3.032 1
1 65 . 11 1 1 A 10 10 GLN H H 10 8.270 8.892 -0.622 1
1 66 . 11 1 1 A 10 10 GLN HA H 10 5.270 5.273 -0.003 1
1 71 . 11 1 1 A 10 10 GLN CA C 10 54.200 54.153 0.047 1
1 72 . 11 1 1 A 10 10 GLN CB C 10 30.500 32.517 -2.017 1
1 74 . 11 1 1 A 10 10 GLN N N 10 121.000 122.405 -1.405 1
1 75 . 11 1 1 A 11 11 ILE H H 11 8.270 8.708 -0.438 1
1 76 . 11 1 1 A 11 11 ILE HA H 11 4.100 4.744 -0.644 1
1 86 . 11 1 1 A 11 11 ILE CA C 11 59.400 59.242 0.158 1
1 87 . 11 1 1 A 11 11 ILE CB C 11 41.800 40.298 1.502 1
1 91 . 11 1 1 A 11 11 ILE N N 11 114.600 121.324 -6.724 1
1 92 . 11 1 1 A 12 12 PHE H H 12 8.520 8.871 -0.351 1
1 93 . 11 1 1 A 12 12 PHE HA H 12 5.540 5.357 0.183 1
1 96 . 11 1 1 A 12 12 PHE CA C 12 55.000 56.892 -1.892 1
1 97 . 11 1 1 A 12 12 PHE CB C 12 41.200 41.116 0.084 1
1 98 . 11 1 1 A 12 12 PHE N N 12 118.600 123.209 -4.609 1
1 99 . 11 1 1 A 13 13 VAL H H 13 9.230 9.114 0.116 1
1 100 . 11 1 1 A 13 13 VAL HA H 13 4.740 5.271 -0.531 1
1 108 . 11 1 1 A 13 13 VAL CA C 13 60.300 60.685 -0.385 1
1 109 . 11 1 1 A 13 13 VAL CB C 13 34.100 35.332 -1.232 1
1 112 . 11 1 1 A 13 13 VAL N N 13 121.400 123.681 -2.281 1
1 113 . 11 1 1 A 14 14 LYS H H 14 8.910 9.134 -0.224 1
1 114 . 11 1 1 A 14 14 LYS HA H 14 5.190 4.900 0.290 1
1 122 . 11 1 1 A 14 14 LYS CA C 14 54.600 54.995 -0.395 1
1 123 . 11 1 1 A 14 14 LYS CB C 14 34.300 34.947 -0.647 1
1 126 . 11 1 1 A 14 14 LYS N N 14 128.000 126.870 1.130 1
1 127 . 11 1 1 A 15 15 THR H H 15 8.650 9.021 -0.371 1
1 128 . 11 1 1 A 15 15 THR HA H 15 4.870 4.719 0.151 1
1 133 . 11 1 1 A 15 15 THR CA C 15 60.300 60.868 -0.568 1
1 134 . 11 1 1 A 15 15 THR CB C 15 70.600 71.302 -0.702 1
1 136 . 11 1 1 A 15 15 THR N N 15 115.300 117.252 -1.952 1
1 137 . 11 1 1 A 16 16 LEU H H 16 9.070 8.830 0.240 1
1 138 . 11 1 1 A 16 16 LEU HA H 16 4.210 3.998 0.212 1
1 148 . 11 1 1 A 16 16 LEU CA C 16 57.400 57.757 -0.357 1
1 149 . 11 1 1 A 16 16 LEU CB C 16 41.800 41.508 0.292 1
1 153 . 11 1 1 A 16 16 LEU N N 16 121.400 122.344 -0.944 1
1 154 . 11 1 1 A 17 17 THR H H 17 7.560 7.802 -0.242 1
1 155 . 11 1 1 A 17 17 THR HA H 17 4.330 4.285 0.045 1
1 160 . 11 1 1 A 17 17 THR CA C 17 61.400 63.855 -2.455 1
1 161 . 11 1 1 A 17 17 THR CB C 17 68.900 69.516 -0.616 1
1 163 . 11 1 1 A 17 17 THR N N 17 105.900 112.234 -6.334 1
1 164 . 11 1 1 A 18 18 GLY H H 18 7.750 7.752 -0.002 1
1 165 . 11 1 1 A 18 18 GLY HA2 H 18 4.250 4.030 0.220 1
1 166 . 11 1 1 A 18 18 GLY HA3 H 18 3.520 4.032 -0.512 1
1 167 . 11 1 1 A 18 18 GLY CA C 18 45.300 45.149 0.151 1
1 168 . 11 1 1 A 18 18 GLY N N 18 109.300 109.304 -0.004 1
1 169 . 11 1 1 A 19 19 LYS H H 19 7.210 7.660 -0.450 1
1 170 . 11 1 1 A 19 19 LYS HA H 19 4.260 4.254 0.006 1
1 175 . 11 1 1 A 19 19 LYS CA C 19 56.300 56.882 -0.582 1
1 176 . 11 1 1 A 19 19 LYS CB C 19 33.200 33.986 -0.786 1
1 179 . 11 1 1 A 19 19 LYS N N 19 122.000 121.538 0.462 1
1 180 . 11 1 1 A 20 20 THR H H 20 8.570 8.552 0.018 1
1 181 . 11 1 1 A 20 20 THR HA H 20 4.950 5.304 -0.354 1
1 186 . 11 1 1 A 20 20 THR CA C 20 62.200 61.998 0.202 1
1 187 . 11 1 1 A 20 20 THR CB C 20 69.700 70.482 -0.782 1
1 189 . 11 1 1 A 20 20 THR N N 20 120.700 118.496 2.204 1
1 190 . 11 1 1 A 21 21 ILE H H 21 9.510 8.468 1.042 1
1 191 . 11 1 1 A 21 21 ILE HA H 21 4.390 4.868 -0.478 1
1 201 . 11 1 1 A 21 21 ILE CA C 21 60.000 58.996 1.004 1
1 202 . 11 1 1 A 21 21 ILE CB C 21 40.700 41.417 -0.717 1
1 206 . 11 1 1 A 21 21 ILE N N 21 128.200 122.451 5.749 1
1 207 . 11 1 1 A 22 22 THR H H 22 8.700 8.923 -0.223 1
1 208 . 11 1 1 A 22 22 THR HA H 22 4.860 4.454 0.406 1
1 213 . 11 1 1 A 22 22 THR CA C 22 62.100 62.591 -0.491 1
1 214 . 11 1 1 A 22 22 THR CB C 22 69.500 69.221 0.279 1
1 216 . 11 1 1 A 22 22 THR N N 22 122.300 121.245 1.055 1
1 217 . 11 1 1 A 23 23 LEU H H 23 8.720 8.883 -0.163 1
1 218 . 11 1 1 A 23 23 LEU HA H 23 4.690 5.002 -0.312 1
1 228 . 11 1 1 A 23 23 LEU CA C 23 52.700 53.539 -0.839 1
1 229 . 11 1 1 A 23 23 LEU CB C 23 46.600 45.199 1.401 1
1 233 . 11 1 1 A 23 23 LEU N N 23 125.400 128.098 -2.698 1
1 234 . 11 1 1 A 24 24 GLU H H 24 8.080 8.472 -0.392 1
1 235 . 11 1 1 A 24 24 GLU HA H 24 4.800 4.798 0.002 1
1 238 . 11 1 1 A 24 24 GLU CA C 24 55.400 55.757 -0.357 1
1 239 . 11 1 1 A 24 24 GLU CB C 24 30.100 30.967 -0.867 1
1 241 . 11 1 1 A 24 24 GLU N N 24 121.800 120.100 1.700 1
1 242 . 11 1 1 A 25 25 VAL H H 25 8.800 8.529 0.271 1
1 243 . 11 1 1 A 25 25 VAL HA H 25 4.640 4.854 -0.214 1
1 251 . 11 1 1 A 25 25 VAL CA C 25 58.600 59.603 -1.003 1
1 252 . 11 1 1 A 25 25 VAL CB C 25 36.300 35.651 0.649 1
1 255 . 11 1 1 A 25 25 VAL N N 25 116.700 120.003 -3.303 1
1 256 . 11 1 1 A 26 26 GLU H H 26 8.500 8.493 0.007 1
1 257 . 11 1 1 A 26 26 GLU HA H 26 4.900 4.594 0.306 1
1 260 . 11 1 1 A 26 26 GLU CA C 26 53.000 53.516 -0.516 1
1 261 . 11 1 1 A 26 26 GLU CB C 26 31.200 34.016 -2.816 1
1 262 . 11 1 1 A 26 26 GLU N N 26 117.900 126.392 -8.492 1
1 263 . 11 1 1 A 27 27 PRO HA H 27 4.040 4.393 -0.353 1
1 270 . 11 1 1 A 27 27 PRO CA C 27 65.400 64.876 0.524 1
1 271 . 11 1 1 A 27 27 PRO CB C 27 31.700 32.069 -0.369 1
1 274 . 11 1 1 A 28 28 SER H H 28 7.010 8.050 -1.040 1
1 275 . 11 1 1 A 28 28 SER HA H 28 4.280 4.452 -0.172 1
1 278 . 11 1 1 A 28 28 SER CA C 28 57.400 58.256 -0.856 1
1 279 . 11 1 1 A 28 28 SER CB C 28 63.400 64.246 -0.846 1
1 280 . 11 1 1 A 28 28 SER N N 28 103.800 110.478 -6.678 1
1 281 . 11 1 1 A 29 29 ASP H H 29 7.960 7.721 0.239 1
1 282 . 11 1 1 A 29 29 ASP HA H 29 4.600 5.080 -0.480 1
1 285 . 11 1 1 A 29 29 ASP CA C 29 55.900 53.446 2.454 1
1 286 . 11 1 1 A 29 29 ASP CB C 29 41.000 42.467 -1.467 1
1 287 . 11 1 1 A 29 29 ASP N N 29 123.700 122.773 0.927 1
1 288 . 11 1 1 A 30 30 THR H H 30 7.780 8.492 -0.712 1
1 289 . 11 1 1 A 30 30 THR HA H 30 4.850 4.712 0.138 1
1 294 . 11 1 1 A 30 30 THR CA C 30 59.400 59.949 -0.549 1
1 295 . 11 1 1 A 30 30 THR CB C 30 71.100 71.435 -0.335 1
1 297 . 11 1 1 A 30 30 THR N N 30 108.800 119.687 -10.887 1
1 298 . 11 1 1 A 31 31 ILE H H 31 8.320 9.057 -0.737 1
1 299 . 11 1 1 A 31 31 ILE HA H 31 3.580 3.763 -0.183 1
1 309 . 11 1 1 A 31 31 ILE CA C 31 62.200 64.762 -2.562 1
1 310 . 11 1 1 A 31 31 ILE CB C 31 34.300 37.612 -3.312 1
1 314 . 11 1 1 A 31 31 ILE N N 31 121.300 126.886 -5.586 1
1 315 . 11 1 1 A 32 32 GLU H H 32 9.850 8.473 1.377 1
1 316 . 11 1 1 A 32 32 GLU HA H 32 3.780 3.968 -0.188 1
1 321 . 11 1 1 A 32 32 GLU CA C 32 60.500 59.811 0.689 1
1 322 . 11 1 1 A 32 32 GLU CB C 32 28.800 29.135 -0.335 1
1 324 . 11 1 1 A 32 32 GLU N N 32 121.600 121.736 -0.136 1
1 325 . 11 1 1 A 33 33 ASN H H 33 7.810 7.996 -0.186 1
1 326 . 11 1 1 A 33 33 ASN HA H 33 4.440 4.543 -0.103 1
1 329 . 11 1 1 A 33 33 ASN CA C 33 55.800 55.885 -0.085 1
1 330 . 11 1 1 A 33 33 ASN CB C 33 38.100 38.308 -0.208 1
1 331 . 11 1 1 A 33 33 ASN N N 33 121.000 118.283 2.717 1
1 332 . 11 1 1 A 34 34 VAL H H 34 8.000 7.627 0.373 1
1 333 . 11 1 1 A 34 34 VAL HA H 34 3.300 3.575 -0.275 1
1 341 . 11 1 1 A 34 34 VAL CA C 34 67.600 67.126 0.474 1
1 342 . 11 1 1 A 34 34 VAL CB C 34 30.700 31.329 -0.629 1
1 345 . 11 1 1 A 34 34 VAL N N 34 122.200 120.906 1.294 1
1 346 . 11 1 1 A 35 35 LYS H H 35 8.490 8.012 0.478 1
1 347 . 11 1 1 A 35 35 LYS HA H 35 4.500 4.010 0.490 1
1 352 . 11 1 1 A 35 35 LYS CA C 35 59.300 59.200 0.100 1
1 353 . 11 1 1 A 35 35 LYS CB C 35 33.500 32.339 1.161 1
1 354 . 11 1 1 A 35 35 LYS N N 35 119.200 119.804 -0.604 1
1 355 . 11 1 1 A 36 36 ALA H H 36 7.880 7.781 0.099 1
1 356 . 11 1 1 A 36 36 ALA HA H 36 4.060 4.047 0.013 1
1 360 . 11 1 1 A 36 36 ALA CA C 36 55.300 55.179 0.121 1
1 361 . 11 1 1 A 36 36 ALA CB C 36 17.600 18.388 -0.788 1
1 362 . 11 1 1 A 36 36 ALA N N 36 123.300 122.374 0.926 1
1 363 . 11 1 1 A 37 37 LYS H H 37 7.790 8.110 -0.320 1
1 364 . 11 1 1 A 37 37 LYS HA H 37 4.110 4.028 0.082 1
1 373 . 11 1 1 A 37 37 LYS CA C 37 59.700 59.419 0.281 1
1 374 . 11 1 1 A 37 37 LYS CB C 37 33.100 32.364 0.736 1
1 378 . 11 1 1 A 37 37 LYS N N 37 120.400 117.404 2.996 1
1 379 . 11 1 1 A 38 38 ILE H H 38 8.240 8.427 -0.187 1
1 380 . 11 1 1 A 38 38 ILE HA H 38 3.410 3.895 -0.485 1
1 390 . 11 1 1 A 38 38 ILE CA C 38 66.200 62.555 3.645 1
1 391 . 11 1 1 A 38 38 ILE CB C 38 36.800 37.273 -0.473 1
1 395 . 11 1 1 A 38 38 ILE N N 38 121.400 120.093 1.307 1
1 396 . 11 1 1 A 39 39 GLN H H 39 8.460 7.807 0.653 1
1 397 . 11 1 1 A 39 39 GLN HA H 39 3.730 3.943 -0.213 1
1 402 . 11 1 1 A 39 39 GLN CA C 39 60.000 58.911 1.089 1
1 403 . 11 1 1 A 39 39 GLN CB C 39 27.600 28.535 -0.935 1
1 405 . 11 1 1 A 39 39 GLN N N 39 123.500 121.096 2.404 1
1 406 . 11 1 1 A 40 40 ASP H H 40 7.970 7.807 0.163 1
1 407 . 11 1 1 A 40 40 ASP HA H 40 4.240 4.356 -0.116 1
1 410 . 11 1 1 A 40 40 ASP CA C 40 57.400 56.855 0.545 1
1 411 . 11 1 1 A 40 40 ASP CB C 40 41.000 40.585 0.415 1
1 412 . 11 1 1 A 40 40 ASP N N 40 119.900 119.457 0.443 1
1 413 . 11 1 1 A 41 41 LYS H H 41 7.420 7.681 -0.261 1
1 414 . 11 1 1 A 41 41 LYS HA H 41 4.200 4.101 0.099 1
1 423 . 11 1 1 A 41 41 LYS CA C 41 58.200 59.390 -1.190 1
1 424 . 11 1 1 A 41 41 LYS CB C 41 33.900 32.650 1.250 1
1 427 . 11 1 1 A 41 41 LYS N N 41 115.700 119.355 -3.655 1
1 428 . 11 1 1 A 42 42 GLU H H 42 8.650 7.813 0.837 1
1 429 . 11 1 1 A 42 42 GLU HA H 42 4.470 4.521 -0.051 1
1 434 . 11 1 1 A 42 42 GLU CA C 42 55.300 56.028 -0.728 1
1 435 . 11 1 1 A 42 42 GLU CB C 42 33.200 32.059 1.141 1
1 437 . 11 1 1 A 42 42 GLU N N 42 114.200 115.399 -1.199 1
1 438 . 11 1 1 A 43 43 GLY H H 43 8.400 8.028 0.372 1
1 439 . 11 1 1 A 43 43 GLY HA2 H 43 4.040 3.898 0.142 1
1 440 . 11 1 1 A 43 43 GLY HA3 H 43 3.820 3.899 -0.079 1
1 441 . 11 1 1 A 43 43 GLY CA C 43 45.900 45.744 0.156 1
1 442 . 11 1 1 A 43 43 GLY N N 43 109.000 108.725 0.275 1
1 443 . 11 1 1 A 44 44 ILE H H 44 6.080 7.719 -1.639 1
1 444 . 11 1 1 A 44 44 ILE HA H 44 4.290 4.130 0.160 1
1 446 . 11 1 1 A 44 44 ILE CA C 44 57.700 59.539 -1.839 1
1 447 . 11 1 1 A 44 44 ILE CB C 44 40.400 38.560 1.840 1
1 448 . 11 1 1 A 44 44 ILE N N 44 120.500 121.774 -1.274 1
1 449 . 11 1 1 A 46 46 PRO HA H 46 4.030 4.317 -0.287 1
1 454 . 11 1 1 A 46 46 PRO CA C 46 66.100 65.100 1.000 1
1 455 . 11 1 1 A 46 46 PRO CB C 46 32.600 31.926 0.674 1
1 458 . 11 1 1 A 47 47 ASP H H 47 8.470 8.524 -0.054 1
1 459 . 11 1 1 A 47 47 ASP HA H 47 4.310 4.369 -0.059 1
1 462 . 11 1 1 A 47 47 ASP CA C 47 55.700 56.998 -1.298 1
1 463 . 11 1 1 A 47 47 ASP CB C 47 39.700 40.302 -0.602 1
1 464 . 11 1 1 A 47 47 ASP N N 47 113.700 117.757 -4.057 1
1 465 . 11 1 1 A 48 48 GLN H H 48 7.720 7.450 0.270 1
1 466 . 11 1 1 A 48 48 GLN HA H 48 4.340 4.436 -0.096 1
1 471 . 11 1 1 A 48 48 GLN CA C 48 55.500 55.145 0.355 1
1 472 . 11 1 1 A 48 48 GLN CB C 48 29.900 30.266 -0.366 1
1 474 . 11 1 1 A 48 48 GLN N N 48 116.900 115.253 1.647 1
1 475 . 11 1 1 A 49 49 GLN H H 49 7.410 7.637 -0.227 1
1 476 . 11 1 1 A 49 49 GLN HA H 49 4.110 4.105 0.005 1
1 481 . 11 1 1 A 49 49 GLN CA C 49 56.600 56.314 0.286 1
1 482 . 11 1 1 A 49 49 GLN CB C 49 31.300 29.304 1.996 1
1 484 . 11 1 1 A 49 49 GLN N N 49 118.000 121.895 -3.895 1
1 485 . 11 1 1 A 50 50 ARG H H 50 8.400 8.652 -0.252 1
1 486 . 11 1 1 A 50 50 ARG HA H 50 4.380 4.748 -0.368 1
1 491 . 11 1 1 A 50 50 ARG CA C 50 55.100 55.239 -0.139 1
1 492 . 11 1 1 A 50 50 ARG CB C 50 31.600 31.728 -0.128 1
1 494 . 11 1 1 A 50 50 ARG N N 50 123.100 125.586 -2.486 1
1 495 . 11 1 1 A 51 51 LEU H H 51 8.710 8.610 0.100 1
1 496 . 11 1 1 A 51 51 LEU HA H 51 5.300 5.267 0.033 1
1 506 . 11 1 1 A 51 51 LEU CA C 51 52.900 53.539 -0.639 1
1 507 . 11 1 1 A 51 51 LEU CB C 51 45.700 45.478 0.222 1
1 511 . 11 1 1 A 51 51 LEU N N 51 124.400 120.610 3.790 1
1 512 . 11 1 1 A 52 52 ILE H H 52 9.060 9.030 0.030 1
1 513 . 11 1 1 A 52 52 ILE HA H 52 4.840 5.009 -0.169 1
1 523 . 11 1 1 A 52 52 ILE CA C 52 58.900 60.103 -1.203 1
1 524 . 11 1 1 A 52 52 ILE CB C 52 41.200 41.098 0.102 1
1 528 . 11 1 1 A 52 52 ILE N N 52 122.500 123.405 -0.905 1
1 529 . 11 1 1 A 53 53 PHE H H 53 8.730 9.447 -0.717 1
1 530 . 11 1 1 A 53 53 PHE HA H 53 5.100 4.773 0.327 1
1 535 . 11 1 1 A 53 53 PHE CA C 53 56.300 57.455 -1.155 1
1 536 . 11 1 1 A 53 53 PHE CB C 53 43.500 41.871 1.629 1
1 537 . 11 1 1 A 53 53 PHE N N 53 124.800 127.516 -2.716 1
1 538 . 11 1 1 A 54 54 ALA H H 54 8.940 9.147 -0.207 1
1 539 . 11 1 1 A 54 54 ALA HA H 54 3.610 3.913 -0.303 1
1 543 . 11 1 1 A 54 54 ALA CA C 54 52.500 53.022 -0.522 1
1 544 . 11 1 1 A 54 54 ALA CB C 54 16.300 17.382 -1.082 1
1 545 . 11 1 1 A 54 54 ALA N N 54 133.100 130.344 2.756 1
1 546 . 11 1 1 A 55 55 GLY H H 55 8.070 8.398 -0.328 1
1 547 . 11 1 1 A 55 55 GLY HA2 H 55 4.000 3.804 0.196 1
1 548 . 11 1 1 A 55 55 GLY HA3 H 55 3.340 3.848 -0.508 1
1 549 . 11 1 1 A 55 55 GLY CA C 55 45.200 45.195 0.005 1
1 550 . 11 1 1 A 55 55 GLY N N 55 102.500 102.668 -0.168 1
1 551 . 11 1 1 A 56 56 LYS H H 56 7.860 7.895 -0.035 1
1 552 . 11 1 1 A 56 56 LYS HA H 56 4.510 4.573 -0.063 1
1 558 . 11 1 1 A 56 56 LYS CA C 56 54.500 54.687 -0.187 1
1 559 . 11 1 1 A 56 56 LYS CB C 56 34.400 33.763 0.637 1
1 561 . 11 1 1 A 56 56 LYS N N 56 121.800 121.953 -0.153 1
1 562 . 11 1 1 A 57 57 GLN H H 57 8.600 8.486 0.114 1
1 563 . 11 1 1 A 57 57 GLN HA H 57 4.410 4.760 -0.350 1
1 568 . 11 1 1 A 57 57 GLN CA C 57 55.900 55.500 0.400 1
1 569 . 11 1 1 A 57 57 GLN CB C 57 28.800 29.578 -0.778 1
1 571 . 11 1 1 A 57 57 GLN N N 57 123.200 124.910 -1.710 1
1 572 . 11 1 1 A 58 58 LEU H H 58 8.480 8.169 0.311 1
1 573 . 11 1 1 A 58 58 LEU HA H 58 4.060 4.749 -0.689 1
1 583 . 11 1 1 A 58 58 LEU CA C 58 54.100 53.846 0.254 1
1 584 . 11 1 1 A 58 58 LEU CB C 58 41.500 42.437 -0.937 1
1 588 . 11 1 1 A 58 58 LEU N N 58 125.900 122.825 3.075 1
1 589 . 11 1 1 A 59 59 GLU H H 59 8.400 8.863 -0.463 1
1 590 . 11 1 1 A 59 59 GLU HA H 59 4.400 4.557 -0.157 1
1 595 . 11 1 1 A 59 59 GLU CA C 59 55.900 57.715 -1.815 1
1 596 . 11 1 1 A 59 59 GLU CB C 59 31.900 30.862 1.038 1
1 598 . 11 1 1 A 59 59 GLU N N 59 123.100 119.333 3.767 1
1 599 . 11 1 1 A 60 60 ASP H H 60 8.110 8.155 -0.045 1
1 600 . 11 1 1 A 60 60 ASP HA H 60 4.270 5.087 -0.817 1
1 603 . 11 1 1 A 60 60 ASP CA C 60 57.100 52.581 4.519 1
1 604 . 11 1 1 A 60 60 ASP CB C 60 40.800 43.222 -2.422 1
1 605 . 11 1 1 A 60 60 ASP N N 60 120.300 118.195 2.105 1
1 606 . 11 1 1 A 61 61 GLY HA2 H 61 4.000 4.146 -0.146 1
1 607 . 11 1 1 A 61 61 GLY HA3 H 61 3.830 4.161 -0.331 1
1 608 . 11 1 1 A 61 61 GLY CA C 61 45.000 45.217 -0.217 1
1 609 . 11 1 1 A 62 62 ARG H H 62 7.350 8.859 -1.509 1
1 610 . 11 1 1 A 62 62 ARG HA H 62 4.640 4.934 -0.294 1
1 615 . 11 1 1 A 62 62 ARG CA C 62 54.400 53.964 0.436 1
1 616 . 11 1 1 A 62 62 ARG CB C 62 32.600 34.474 -1.874 1
1 618 . 11 1 1 A 62 62 ARG N N 62 119.300 125.586 -6.286 1
1 619 . 11 1 1 A 63 63 THR H H 63 8.460 9.192 -0.732 1
1 620 . 11 1 1 A 63 63 THR HA H 63 5.060 4.621 0.439 1
1 625 . 11 1 1 A 63 63 THR CA C 63 59.700 60.904 -1.204 1
1 626 . 11 1 1 A 63 63 THR CB C 63 72.000 70.693 1.307 1
1 628 . 11 1 1 A 63 63 THR N N 63 109.100 112.905 -3.805 1
1 629 . 11 1 1 A 64 64 LEU H H 64 8.190 8.697 -0.507 1
1 630 . 11 1 1 A 64 64 LEU HA H 64 3.920 4.086 -0.166 1
1 640 . 11 1 1 A 64 64 LEU CA C 64 58.400 57.336 1.064 1
1 641 . 11 1 1 A 64 64 LEU CB C 64 40.200 41.453 -1.253 1
1 645 . 11 1 1 A 64 64 LEU N N 64 118.100 122.804 -4.704 1
1 646 . 11 1 1 A 65 65 SER H H 65 8.370 7.785 0.585 1
1 647 . 11 1 1 A 65 65 SER HA H 65 4.150 4.182 -0.032 1
1 650 . 11 1 1 A 65 65 SER CA C 65 60.900 61.334 -0.434 1
1 651 . 11 1 1 A 65 65 SER CB C 65 62.500 62.806 -0.306 1
1 652 . 11 1 1 A 65 65 SER N N 65 112.200 114.555 -2.355 1
1 653 . 11 1 1 A 66 66 GLU H H 66 7.780 8.581 -0.801 1
1 654 . 11 1 1 A 66 66 GLU HA H 66 3.890 4.086 -0.196 1
1 659 . 11 1 1 A 66 66 GLU CA C 66 59.200 59.077 0.123 1
1 660 . 11 1 1 A 66 66 GLU CB C 66 29.400 29.020 0.380 1
1 662 . 11 1 1 A 66 66 GLU N N 66 123.600 118.729 4.871 1
1 663 . 11 1 1 A 67 67 TYR H H 67 7.290 7.416 -0.126 1
1 664 . 11 1 1 A 67 67 TYR HA H 67 4.590 4.554 0.036 1
1 669 . 11 1 1 A 67 67 TYR CA C 67 58.400 59.638 -1.238 1
1 670 . 11 1 1 A 67 67 TYR CB C 67 39.800 39.226 0.574 1
1 671 . 11 1 1 A 67 67 TYR N N 67 116.400 120.519 -4.119 1
1 672 . 11 1 1 A 68 68 ASN H H 68 8.040 8.000 0.040 1
1 673 . 11 1 1 A 68 68 ASN HA H 68 4.240 4.349 -0.109 1
1 676 . 11 1 1 A 68 68 ASN CA C 68 54.100 54.245 -0.145 1
1 677 . 11 1 1 A 68 68 ASN CB C 68 37.200 37.477 -0.277 1
1 678 . 11 1 1 A 68 68 ASN N N 68 115.600 116.885 -1.285 1
1 679 . 11 1 1 A 69 69 ILE H H 69 7.200 7.331 -0.131 1
1 680 . 11 1 1 A 69 69 ILE HA H 69 3.280 4.630 -1.350 1
1 690 . 11 1 1 A 69 69 ILE CA C 69 59.800 59.367 0.433 1
1 691 . 11 1 1 A 69 69 ILE CB C 69 36.600 39.390 -2.790 1
1 695 . 11 1 1 A 69 69 ILE N N 69 119.100 114.704 4.396 1
1 696 . 11 1 1 A 70 70 GLN H H 70 7.570 8.653 -1.083 1
1 697 . 11 1 1 A 70 70 GLN HA H 70 4.410 4.462 -0.052 1
1 702 . 11 1 1 A 70 70 GLN CA C 70 53.500 54.862 -1.362 1
1 703 . 11 1 1 A 70 70 GLN CB C 70 31.500 27.016 4.484 1
1 705 . 11 1 1 A 70 70 GLN N N 70 124.800 121.171 3.629 1
1 706 . 11 1 1 A 71 71 LYS H H 71 8.370 7.905 0.465 1
1 707 . 11 1 1 A 71 71 LYS HA H 71 3.870 3.863 0.007 1
1 716 . 11 1 1 A 71 71 LYS CA C 71 58.000 55.827 2.173 1
1 717 . 11 1 1 A 71 71 LYS CB C 71 32.500 32.121 0.379 1
1 720 . 11 1 1 A 71 71 LYS N N 71 120.200 122.195 -1.995 1
1 721 . 11 1 1 A 72 72 GLU H H 72 9.230 8.157 1.073 1
1 722 . 11 1 1 A 72 72 GLU HA H 72 3.240 4.426 -1.186 1
1 727 . 11 1 1 A 72 72 GLU CA C 72 58.300 55.941 2.359 1
1 728 . 11 1 1 A 72 72 GLU CB C 72 26.000 29.286 -3.286 1
1 730 . 11 1 1 A 72 72 GLU N N 72 115.100 118.536 -3.436 1
1 731 . 11 1 1 A 73 73 SER H H 73 7.690 8.129 -0.439 1
1 732 . 11 1 1 A 73 73 SER HA H 73 4.520 4.776 -0.256 1
1 735 . 11 1 1 A 73 73 SER CA C 73 61.100 59.412 1.688 1
1 736 . 11 1 1 A 73 73 SER CB C 73 64.800 64.565 0.235 1
1 737 . 11 1 1 A 73 73 SER N N 73 115.300 113.753 1.547 1
1 738 . 11 1 1 A 74 74 THR H H 74 8.620 7.890 0.730 1
1 739 . 11 1 1 A 74 74 THR HA H 74 5.200 5.054 0.146 1
1 744 . 11 1 1 A 74 74 THR CA C 74 62.400 61.728 0.672 1
1 745 . 11 1 1 A 74 74 THR CB C 74 70.200 70.777 -0.577 1
1 747 . 11 1 1 A 74 74 THR N N 74 117.500 112.333 5.167 1
1 748 . 11 1 1 A 75 75 LEU H H 75 9.350 8.613 0.737 1
1 749 . 11 1 1 A 75 75 LEU HA H 75 4.990 4.861 0.129 1
1 759 . 11 1 1 A 75 75 LEU CA C 75 53.800 53.678 0.122 1
1 760 . 11 1 1 A 75 75 LEU CB C 75 44.400 45.769 -1.369 1
1 764 . 11 1 1 A 75 75 LEU N N 75 128.000 127.533 0.467 1
1 765 . 11 1 1 A 76 76 HIS H H 76 9.140 8.450 0.690 1
1 766 . 11 1 1 A 76 76 HIS HA H 76 5.040 5.156 -0.116 1
1 769 . 11 1 1 A 76 76 HIS CA C 76 56.200 54.551 1.649 1
1 770 . 11 1 1 A 76 76 HIS CB C 76 32.500 31.644 0.856 1
1 771 . 11 1 1 A 76 76 HIS N N 76 119.600 121.437 -1.837 1
1 772 . 11 1 1 A 77 77 LEU H H 77 8.240 8.932 -0.692 1
1 773 . 11 1 1 A 77 77 LEU HA H 77 5.080 5.176 -0.096 1
1 783 . 11 1 1 A 77 77 LEU CA C 77 53.600 53.766 -0.166 1
1 784 . 11 1 1 A 77 77 LEU CB C 77 44.100 43.488 0.612 1
1 788 . 11 1 1 A 77 77 LEU N N 77 123.800 121.177 2.623 1
1 789 . 11 1 1 A 78 78 VAL H H 78 9.110 8.856 0.254 1
1 790 . 11 1 1 A 78 78 VAL HA H 78 4.260 4.669 -0.409 1
1 798 . 11 1 1 A 78 78 VAL CA C 78 60.400 60.990 -0.590 1
1 799 . 11 1 1 A 78 78 VAL CB C 78 34.700 35.644 -0.944 1
1 802 . 11 1 1 A 78 78 VAL N N 78 127.100 124.242 2.858 1
1 803 . 11 1 1 A 79 79 LEU H H 79 8.050 8.879 -0.829 1
1 804 . 11 1 1 A 79 79 LEU HA H 79 4.950 4.913 0.037 1
1 813 . 11 1 1 A 79 79 LEU CA C 79 53.800 53.195 0.605 1
1 814 . 11 1 1 A 79 79 LEU CB C 79 42.700 44.363 -1.663 1
1 818 . 11 1 1 A 79 79 LEU N N 79 123.400 128.656 -5.256 1
1 819 . 11 1 1 A 80 80 ARG H H 80 8.540 9.076 -0.536 1
1 820 . 11 1 1 A 80 80 ARG HA H 80 4.170 3.945 0.225 1
1 827 . 11 1 1 A 80 80 ARG CA C 80 55.800 56.942 -1.142 1
1 828 . 11 1 1 A 80 80 ARG CB C 80 31.100 28.798 2.302 1
1 830 . 11 1 1 A 80 80 ARG N N 80 123.500 126.368 -2.868 1
1 831 . 11 1 1 A 81 81 LEU H H 81 8.250 7.751 0.499 1
1 832 . 11 1 1 A 81 81 LEU HA H 81 4.270 4.317 -0.047 1
1 842 . 11 1 1 A 81 81 LEU CA C 81 55.000 54.281 0.719 1
1 843 . 11 1 1 A 81 81 LEU CB C 81 42.200 43.579 -1.379 1
1 847 . 11 1 1 A 81 81 LEU N N 81 124.100 119.564 4.536 1
1 848 . 11 1 1 A 82 82 ARG H H 82 8.310 9.093 -0.783 1
1 849 . 11 1 1 A 82 82 ARG HA H 82 4.200 4.491 -0.291 1
1 852 . 11 1 1 A 82 82 ARG CA C 82 56.300 57.092 -0.792 1
1 853 . 11 1 1 A 82 82 ARG CB C 82 30.700 33.086 -2.386 1
1 855 . 11 1 1 A 82 82 ARG N N 82 121.500 120.494 1.006 1
1 856 . 11 1 1 A 83 83 GLY H H 83 8.410 7.578 0.832 1
1 857 . 11 1 1 A 83 83 GLY HA2 H 83 3.750 4.216 -0.466 1
1 858 . 11 1 1 A 83 83 GLY HA3 H 83 3.754 4.241 -0.487 1
1 859 . 11 1 1 A 83 83 GLY CA C 83 45.100 46.168 -1.068 1
1 860 . 11 1 1 A 83 83 GLY N N 83 110.200 106.048 4.152 1
1 861 . 11 1 1 A 84 84 TYR H H 84 7.950 8.830 -0.880 1
1 862 . 11 1 1 A 84 84 TYR HA H 84 4.400 5.170 -0.770 1
1 865 . 11 1 1 A 84 84 TYR CA C 84 58.100 56.999 1.101 1
1 866 . 11 1 1 A 84 84 TYR CB C 84 38.800 40.465 -1.665 1
1 867 . 11 1 1 A 84 84 TYR N N 84 119.900 119.277 0.623 1
1 868 . 11 1 1 A 85 85 ALA H H 85 8.150 8.257 -0.107 1
1 869 . 11 1 1 A 85 85 ALA HA H 85 4.150 4.922 -0.772 1
1 873 . 11 1 1 A 85 85 ALA CA C 85 52.600 49.933 2.667 1
1 874 . 11 1 1 A 85 85 ALA CB C 85 19.200 23.420 -4.220 1
1 875 . 11 1 1 A 85 85 ALA N N 85 124.800 122.863 1.937 1
1 876 . 11 1 1 A 86 86 ASP H H 86 8.020 8.857 -0.837 1
1 877 . 11 1 1 A 86 86 ASP HA H 86 4.450 4.755 -0.305 1
1 880 . 11 1 1 A 86 86 ASP CA C 86 54.100 53.809 0.291 1
1 881 . 11 1 1 A 86 86 ASP CB C 86 41.100 39.783 1.317 1
1 882 . 11 1 1 A 86 86 ASP N N 86 118.900 117.654 1.246 1
1 883 . 11 1 1 A 87 87 LEU H H 87 8.010 7.718 0.292 1
1 884 . 11 1 1 A 87 87 LEU HA H 87 4.210 3.808 0.402 1
1 893 . 11 1 1 A 87 87 LEU CA C 87 55.300 55.812 -0.512 1
1 894 . 11 1 1 A 87 87 LEU CB C 87 42.000 40.307 1.693 1
1 898 . 11 1 1 A 87 87 LEU N N 87 122.400 116.264 6.136 1
1 899 . 11 1 1 A 88 88 ARG H H 88 8.170 7.707 0.463 1
1 900 . 11 1 1 A 88 88 ARG HA H 88 4.210 4.444 -0.234 1
1 903 . 11 1 1 A 88 88 ARG CA C 88 56.300 55.898 0.402 1
1 904 . 11 1 1 A 88 88 ARG CB C 88 30.600 30.373 0.227 1
1 905 . 11 1 1 A 88 88 ARG N N 88 121.200 119.357 1.843 1
1 906 . 11 1 1 A 91 91 PRO HA H 91 4.290 4.303 -0.013 1
1 911 . 11 1 1 A 91 91 PRO CA C 91 63.800 64.758 -0.958 1
1 912 . 11 1 1 A 91 91 PRO CB C 91 32.100 31.972 0.128 1
1 915 . 11 1 1 A 92 92 ASP H H 92 8.280 7.867 0.413 1
1 916 . 11 1 1 A 92 92 ASP HA H 92 4.540 5.018 -0.478 1
1 919 . 11 1 1 A 92 92 ASP CA C 92 54.600 53.213 1.387 1
1 920 . 11 1 1 A 92 92 ASP CB C 92 41.000 43.833 -2.833 1
1 921 . 11 1 1 A 92 92 ASP N N 92 118.700 116.683 2.017 1
1 922 . 11 1 1 A 93 93 ARG H H 93 7.780 8.556 -0.776 1
1 923 . 11 1 1 A 93 93 ARG HA H 93 4.190 4.335 -0.145 1
1 930 . 11 1 1 A 93 93 ARG CA C 93 56.300 55.521 0.779 1
1 931 . 11 1 1 A 93 93 ARG CB C 93 30.700 31.175 -0.475 1
1 934 . 11 1 1 A 93 93 ARG N N 93 120.700 124.883 -4.183 1
1 935 . 11 1 1 A 94 94 GLN H H 94 8.280 8.463 -0.183 1
1 936 . 11 1 1 A 94 94 GLN HA H 94 4.210 4.220 -0.010 1
1 941 . 11 1 1 A 94 94 GLN CA C 94 55.800 55.114 0.686 1
1 942 . 11 1 1 A 94 94 GLN CB C 94 29.300 29.704 -0.404 1
1 944 . 11 1 1 A 94 94 GLN N N 94 121.000 118.544 2.456 1
1 945 . 11 1 1 A 95 95 ASP H H 95 8.270 8.765 -0.495 1
1 946 . 11 1 1 A 95 95 ASP HA H 95 4.450 5.083 -0.633 1
1 949 . 11 1 1 A 95 95 ASP CA C 95 54.300 53.414 0.886 1
1 950 . 11 1 1 A 95 95 ASP CB C 95 41.000 44.875 -3.875 1
1 951 . 11 1 1 A 95 95 ASP N N 95 121.000 119.933 1.067 1
1 952 . 11 1 1 A 96 96 HIS H H 96 8.090 8.468 -0.378 1
1 953 . 11 1 1 A 96 96 HIS HA H 96 4.470 5.643 -1.173 1
1 956 . 11 1 1 A 96 96 HIS CA C 96 55.900 53.576 2.324 1
1 957 . 11 1 1 A 96 96 HIS CB C 96 30.500 33.087 -2.587 1
1 958 . 11 1 1 A 96 96 HIS N N 96 119.300 116.112 3.188 1
1 959 . 11 1 1 A 97 97 HIS H H 97 8.240 8.969 -0.729 1
1 960 . 11 1 1 A 97 97 HIS HA H 97 4.470 5.072 -0.602 1
1 963 . 11 1 1 A 97 97 HIS CA C 97 56.200 54.441 1.759 1
1 964 . 11 1 1 A 97 97 HIS CB C 97 30.400 34.930 -4.530 1
1 965 . 11 1 1 A 97 97 HIS N N 97 121.300 119.074 2.226 1
1 966 . 11 1 1 A 98 98 PRO HA H 98 4.340 4.580 -0.240 1
1 973 . 11 1 1 A 98 98 PRO CA C 98 63.700 62.083 1.617 1
1 974 . 11 1 1 A 98 98 PRO CB C 98 31.900 29.565 2.335 1
1 977 . 11 1 1 A 99 99 GLY H H 99 8.660 8.332 0.328 1
1 978 . 11 1 1 A 99 99 GLY HA2 H 99 3.920 4.364 -0.444 1
1 979 . 11 1 1 A 99 99 GLY HA3 H 99 3.920 4.442 -0.522 1
1 980 . 11 1 1 A 99 99 GLY CA C 99 45.200 44.502 0.698 1
1 981 . 11 1 1 A 99 99 GLY N N 99 110.000 110.620 -0.620 1
1 982 . 11 1 1 A 100 100 SER H H 100 8.170 8.848 -0.678 1
1 983 . 11 1 1 A 100 100 SER HA H 100 4.360 4.285 0.075 1
1 986 . 11 1 1 A 100 100 SER CA C 100 58.500 59.336 -0.836 1
1 987 . 11 1 1 A 100 100 SER CB C 100 64.000 61.051 2.949 1
1 988 . 11 1 1 A 100 100 SER N N 100 115.600 115.544 0.056 1
1 989 . 11 1 1 A 101 101 GLY H H 101 8.420 8.140 0.280 1
1 990 . 11 1 1 A 101 101 GLY HA2 H 101 3.890 4.178 -0.288 1
1 991 . 11 1 1 A 101 101 GLY HA3 H 101 3.920 4.178 -0.258 1
1 992 . 11 1 1 A 101 101 GLY CA C 101 45.200 44.799 0.401 1
1 993 . 11 1 1 A 101 101 GLY N N 101 111.000 109.518 1.482 1
1 994 . 11 1 1 A 102 102 ALA H H 102 8.030 8.783 -0.753 1
1 995 . 11 1 1 A 102 102 ALA HA H 102 4.250 4.848 -0.598 1
1 999 . 11 1 1 A 102 102 ALA CA C 102 52.500 51.041 1.459 1
1 1000 . 11 1 1 A 102 102 ALA CB C 102 19.200 23.477 -4.277 1
1 4 . 12 1 1 A 2 2 SER H H 2 8.160 7.946 0.214 1
1 5 . 12 1 1 A 2 2 SER HA H 2 4.370 4.571 -0.201 1
1 9 . 12 1 1 A 2 2 SER CA C 2 58.300 58.175 0.125 1
1 10 . 12 1 1 A 2 2 SER CB C 2 63.900 64.484 -0.584 1
1 11 . 12 1 1 A 2 2 SER N N 2 115.600 116.684 -1.084 1
1 12 . 12 1 1 A 3 3 LEU H H 3 8.250 8.544 -0.294 1
1 13 . 12 1 1 A 3 3 LEU HA H 3 4.280 4.241 0.039 1
1 17 . 12 1 1 A 3 3 LEU CA C 3 55.200 54.940 0.260 1
1 18 . 12 1 1 A 3 3 LEU CB C 3 42.100 42.486 -0.386 1
1 19 . 12 1 1 A 3 3 LEU N N 3 124.100 124.133 -0.033 1
1 20 . 12 1 1 A 4 4 VAL H H 4 7.950 8.731 -0.781 1
1 21 . 12 1 1 A 4 4 VAL HA H 4 4.680 4.915 -0.235 1
1 26 . 12 1 1 A 4 4 VAL CA C 4 59.800 58.103 1.697 1
1 27 . 12 1 1 A 4 4 VAL CB C 4 32.500 33.411 -0.911 1
1 28 . 12 1 1 A 4 4 VAL N N 4 122.600 117.727 4.873 1
1 29 . 12 1 1 A 5 5 PRO CA C 5 63.100 62.610 0.490 1
1 30 . 12 1 1 A 5 5 PRO CB C 5 32.000 32.350 -0.350 1
1 32 . 12 1 1 A 6 6 ARG H H 6 8.360 8.683 -0.323 1
1 33 . 12 1 1 A 6 6 ARG HA H 6 4.250 4.848 -0.598 1
1 36 . 12 1 1 A 6 6 ARG CA C 6 56.000 55.714 0.286 1
1 37 . 12 1 1 A 6 6 ARG CB C 6 30.900 33.643 -2.743 1
1 38 . 12 1 1 A 6 6 ARG N N 6 121.800 123.432 -1.632 1
1 39 . 12 1 1 A 7 7 GLY H H 7 8.460 8.423 0.037 1
1 40 . 12 1 1 A 7 7 GLY HA2 H 7 3.940 4.237 -0.297 1
1 41 . 12 1 1 A 7 7 GLY HA3 H 7 3.760 4.240 -0.480 1
1 42 . 12 1 1 A 7 7 GLY CA C 7 45.000 44.603 0.397 1
1 43 . 12 1 1 A 7 7 GLY N N 7 110.700 112.490 -1.790 1
1 44 . 12 1 1 A 8 8 SER H H 8 7.990 8.813 -0.823 1
1 45 . 12 1 1 A 8 8 SER HA H 8 4.450 4.494 -0.044 1
1 48 . 12 1 1 A 8 8 SER CA C 8 58.900 59.654 -0.754 1
1 49 . 12 1 1 A 8 8 SER CB C 8 64.200 64.550 -0.350 1
1 50 . 12 1 1 A 8 8 SER N N 8 115.500 116.269 -0.769 1
1 51 . 12 1 1 A 9 9 MET H H 9 9.040 7.680 1.360 1
1 52 . 12 1 1 A 9 9 MET HA H 9 4.610 5.108 -0.498 1
1 60 . 12 1 1 A 9 9 MET CA C 9 54.400 53.624 0.776 1
1 61 . 12 1 1 A 9 9 MET CB C 9 35.400 33.553 1.847 1
1 64 . 12 1 1 A 9 9 MET N N 9 120.500 119.497 1.003 1
1 65 . 12 1 1 A 10 10 GLN H H 10 8.270 8.914 -0.644 1
1 66 . 12 1 1 A 10 10 GLN HA H 10 5.270 5.287 -0.017 1
1 71 . 12 1 1 A 10 10 GLN CA C 10 54.200 54.370 -0.170 1
1 72 . 12 1 1 A 10 10 GLN CB C 10 30.500 32.381 -1.881 1
1 74 . 12 1 1 A 10 10 GLN N N 10 121.000 122.382 -1.382 1
1 75 . 12 1 1 A 11 11 ILE H H 11 8.270 8.694 -0.424 1
1 76 . 12 1 1 A 11 11 ILE HA H 11 4.100 4.744 -0.644 1
1 86 . 12 1 1 A 11 11 ILE CA C 11 59.400 59.141 0.259 1
1 87 . 12 1 1 A 11 11 ILE CB C 11 41.800 40.585 1.215 1
1 91 . 12 1 1 A 11 11 ILE N N 11 114.600 121.338 -6.738 1
1 92 . 12 1 1 A 12 12 PHE H H 12 8.520 8.807 -0.287 1
1 93 . 12 1 1 A 12 12 PHE HA H 12 5.540 5.355 0.185 1
1 96 . 12 1 1 A 12 12 PHE CA C 12 55.000 56.999 -1.999 1
1 97 . 12 1 1 A 12 12 PHE CB C 12 41.200 41.018 0.182 1
1 98 . 12 1 1 A 12 12 PHE N N 12 118.600 123.471 -4.871 1
1 99 . 12 1 1 A 13 13 VAL H H 13 9.230 9.080 0.150 1
1 100 . 12 1 1 A 13 13 VAL HA H 13 4.740 5.190 -0.450 1
1 108 . 12 1 1 A 13 13 VAL CA C 13 60.300 60.544 -0.244 1
1 109 . 12 1 1 A 13 13 VAL CB C 13 34.100 35.375 -1.275 1
1 112 . 12 1 1 A 13 13 VAL N N 13 121.400 122.953 -1.553 1
1 113 . 12 1 1 A 14 14 LYS H H 14 8.910 8.887 0.023 1
1 114 . 12 1 1 A 14 14 LYS HA H 14 5.190 5.008 0.182 1
1 122 . 12 1 1 A 14 14 LYS CA C 14 54.600 55.012 -0.412 1
1 123 . 12 1 1 A 14 14 LYS CB C 14 34.300 35.414 -1.114 1
1 126 . 12 1 1 A 14 14 LYS N N 14 128.000 126.729 1.271 1
1 127 . 12 1 1 A 15 15 THR H H 15 8.650 8.736 -0.086 1
1 128 . 12 1 1 A 15 15 THR HA H 15 4.870 4.801 0.069 1
1 133 . 12 1 1 A 15 15 THR CA C 15 60.300 60.325 -0.025 1
1 134 . 12 1 1 A 15 15 THR CB C 15 70.600 71.982 -1.382 1
1 136 . 12 1 1 A 15 15 THR N N 15 115.300 116.484 -1.184 1
1 137 . 12 1 1 A 16 16 LEU H H 16 9.070 8.847 0.223 1
1 138 . 12 1 1 A 16 16 LEU HA H 16 4.210 4.001 0.209 1
1 148 . 12 1 1 A 16 16 LEU CA C 16 57.400 57.707 -0.307 1
1 149 . 12 1 1 A 16 16 LEU CB C 16 41.800 41.506 0.294 1
1 153 . 12 1 1 A 16 16 LEU N N 16 121.400 122.154 -0.754 1
1 154 . 12 1 1 A 17 17 THR H H 17 7.560 7.853 -0.293 1
1 155 . 12 1 1 A 17 17 THR HA H 17 4.330 4.237 0.093 1
1 160 . 12 1 1 A 17 17 THR CA C 17 61.400 63.760 -2.360 1
1 161 . 12 1 1 A 17 17 THR CB C 17 68.900 69.396 -0.496 1
1 163 . 12 1 1 A 17 17 THR N N 17 105.900 112.363 -6.463 1
1 164 . 12 1 1 A 18 18 GLY H H 18 7.750 7.835 -0.085 1
1 165 . 12 1 1 A 18 18 GLY HA2 H 18 4.250 4.105 0.145 1
1 166 . 12 1 1 A 18 18 GLY HA3 H 18 3.520 4.109 -0.589 1
1 167 . 12 1 1 A 18 18 GLY CA C 18 45.300 44.926 0.374 1
1 168 . 12 1 1 A 18 18 GLY N N 18 109.300 108.758 0.542 1
1 169 . 12 1 1 A 19 19 LYS H H 19 7.210 7.897 -0.687 1
1 170 . 12 1 1 A 19 19 LYS HA H 19 4.260 4.359 -0.099 1
1 175 . 12 1 1 A 19 19 LYS CA C 19 56.300 56.672 -0.372 1
1 176 . 12 1 1 A 19 19 LYS CB C 19 33.200 33.703 -0.503 1
1 179 . 12 1 1 A 19 19 LYS N N 19 122.000 120.573 1.427 1
1 180 . 12 1 1 A 20 20 THR H H 20 8.570 8.782 -0.212 1
1 181 . 12 1 1 A 20 20 THR HA H 20 4.950 5.610 -0.660 1
1 186 . 12 1 1 A 20 20 THR CA C 20 62.200 60.484 1.716 1
1 187 . 12 1 1 A 20 20 THR CB C 20 69.700 70.653 -0.953 1
1 189 . 12 1 1 A 20 20 THR N N 20 120.700 112.795 7.905 1
1 190 . 12 1 1 A 21 21 ILE H H 21 9.510 8.484 1.026 1
1 191 . 12 1 1 A 21 21 ILE HA H 21 4.390 4.889 -0.499 1
1 201 . 12 1 1 A 21 21 ILE CA C 21 60.000 59.096 0.904 1
1 202 . 12 1 1 A 21 21 ILE CB C 21 40.700 41.697 -0.997 1
1 206 . 12 1 1 A 21 21 ILE N N 21 128.200 123.205 4.995 1
1 207 . 12 1 1 A 22 22 THR H H 22 8.700 8.683 0.017 1
1 208 . 12 1 1 A 22 22 THR HA H 22 4.860 4.414 0.446 1
1 213 . 12 1 1 A 22 22 THR CA C 22 62.100 62.810 -0.710 1
1 214 . 12 1 1 A 22 22 THR CB C 22 69.500 68.860 0.640 1
1 216 . 12 1 1 A 22 22 THR N N 22 122.300 120.814 1.486 1
1 217 . 12 1 1 A 23 23 LEU H H 23 8.720 8.990 -0.270 1
1 218 . 12 1 1 A 23 23 LEU HA H 23 4.690 4.992 -0.302 1
1 228 . 12 1 1 A 23 23 LEU CA C 23 52.700 53.356 -0.656 1
1 229 . 12 1 1 A 23 23 LEU CB C 23 46.600 44.989 1.611 1
1 233 . 12 1 1 A 23 23 LEU N N 23 125.400 127.759 -2.359 1
1 234 . 12 1 1 A 24 24 GLU H H 24 8.080 8.705 -0.625 1
1 235 . 12 1 1 A 24 24 GLU HA H 24 4.800 4.998 -0.198 1
1 238 . 12 1 1 A 24 24 GLU CA C 24 55.400 55.566 -0.166 1
1 239 . 12 1 1 A 24 24 GLU CB C 24 30.100 31.465 -1.365 1
1 241 . 12 1 1 A 24 24 GLU N N 24 121.800 119.220 2.580 1
1 242 . 12 1 1 A 25 25 VAL H H 25 8.800 8.910 -0.110 1
1 243 . 12 1 1 A 25 25 VAL HA H 25 4.640 4.952 -0.312 1
1 251 . 12 1 1 A 25 25 VAL CA C 25 58.600 59.571 -0.971 1
1 252 . 12 1 1 A 25 25 VAL CB C 25 36.300 35.434 0.866 1
1 255 . 12 1 1 A 25 25 VAL N N 25 116.700 117.419 -0.719 1
1 256 . 12 1 1 A 26 26 GLU H H 26 8.500 8.406 0.094 1
1 257 . 12 1 1 A 26 26 GLU HA H 26 4.900 4.543 0.357 1
1 260 . 12 1 1 A 26 26 GLU CA C 26 53.000 54.544 -1.544 1
1 261 . 12 1 1 A 26 26 GLU CB C 26 31.200 34.047 -2.847 1
1 262 . 12 1 1 A 26 26 GLU N N 26 117.900 122.027 -4.127 1
1 263 . 12 1 1 A 27 27 PRO HA H 27 4.040 4.380 -0.340 1
1 270 . 12 1 1 A 27 27 PRO CA C 27 65.400 64.877 0.523 1
1 271 . 12 1 1 A 27 27 PRO CB C 27 31.700 32.038 -0.338 1
1 274 . 12 1 1 A 28 28 SER H H 28 7.010 8.101 -1.091 1
1 275 . 12 1 1 A 28 28 SER HA H 28 4.280 4.486 -0.206 1
1 278 . 12 1 1 A 28 28 SER CA C 28 57.400 58.022 -0.622 1
1 279 . 12 1 1 A 28 28 SER CB C 28 63.400 64.005 -0.605 1
1 280 . 12 1 1 A 28 28 SER N N 28 103.800 110.456 -6.656 1
1 281 . 12 1 1 A 29 29 ASP H H 29 7.960 7.734 0.226 1
1 282 . 12 1 1 A 29 29 ASP HA H 29 4.600 4.944 -0.344 1
1 285 . 12 1 1 A 29 29 ASP CA C 29 55.900 52.959 2.941 1
1 286 . 12 1 1 A 29 29 ASP CB C 29 41.000 41.615 -0.615 1
1 287 . 12 1 1 A 29 29 ASP N N 29 123.700 122.099 1.601 1
1 288 . 12 1 1 A 30 30 THR H H 30 7.780 8.863 -1.083 1
1 289 . 12 1 1 A 30 30 THR HA H 30 4.850 4.572 0.278 1
1 294 . 12 1 1 A 30 30 THR CA C 30 59.400 60.929 -1.529 1
1 295 . 12 1 1 A 30 30 THR CB C 30 71.100 70.377 0.723 1
1 297 . 12 1 1 A 30 30 THR N N 30 108.800 120.694 -11.894 1
1 298 . 12 1 1 A 31 31 ILE H H 31 8.320 8.934 -0.614 1
1 299 . 12 1 1 A 31 31 ILE HA H 31 3.580 3.764 -0.184 1
1 309 . 12 1 1 A 31 31 ILE CA C 31 62.200 64.989 -2.789 1
1 310 . 12 1 1 A 31 31 ILE CB C 31 34.300 37.509 -3.209 1
1 314 . 12 1 1 A 31 31 ILE N N 31 121.300 127.243 -5.943 1
1 315 . 12 1 1 A 32 32 GLU H H 32 9.850 8.364 1.486 1
1 316 . 12 1 1 A 32 32 GLU HA H 32 3.780 3.911 -0.131 1
1 321 . 12 1 1 A 32 32 GLU CA C 32 60.500 59.985 0.515 1
1 322 . 12 1 1 A 32 32 GLU CB C 32 28.800 29.330 -0.530 1
1 324 . 12 1 1 A 32 32 GLU N N 32 121.600 122.186 -0.586 1
1 325 . 12 1 1 A 33 33 ASN H H 33 7.810 7.609 0.201 1
1 326 . 12 1 1 A 33 33 ASN HA H 33 4.440 4.529 -0.089 1
1 329 . 12 1 1 A 33 33 ASN CA C 33 55.800 55.745 0.055 1
1 330 . 12 1 1 A 33 33 ASN CB C 33 38.100 38.556 -0.456 1
1 331 . 12 1 1 A 33 33 ASN N N 33 121.000 118.832 2.168 1
1 332 . 12 1 1 A 34 34 VAL H H 34 8.000 8.173 -0.173 1
1 333 . 12 1 1 A 34 34 VAL HA H 34 3.300 3.873 -0.573 1
1 341 . 12 1 1 A 34 34 VAL CA C 34 67.600 66.561 1.039 1
1 342 . 12 1 1 A 34 34 VAL CB C 34 30.700 31.639 -0.939 1
1 345 . 12 1 1 A 34 34 VAL N N 34 122.200 120.198 2.002 1
1 346 . 12 1 1 A 35 35 LYS H H 35 8.490 8.458 0.032 1
1 347 . 12 1 1 A 35 35 LYS HA H 35 4.500 4.067 0.433 1
1 352 . 12 1 1 A 35 35 LYS CA C 35 59.300 58.632 0.668 1
1 353 . 12 1 1 A 35 35 LYS CB C 35 33.500 31.896 1.604 1
1 354 . 12 1 1 A 35 35 LYS N N 35 119.200 120.197 -0.997 1
1 355 . 12 1 1 A 36 36 ALA H H 36 7.880 8.266 -0.386 1
1 356 . 12 1 1 A 36 36 ALA HA H 36 4.060 4.044 0.016 1
1 360 . 12 1 1 A 36 36 ALA CA C 36 55.300 55.490 -0.190 1
1 361 . 12 1 1 A 36 36 ALA CB C 36 17.600 18.343 -0.743 1
1 362 . 12 1 1 A 36 36 ALA N N 36 123.300 122.259 1.041 1
1 363 . 12 1 1 A 37 37 LYS H H 37 7.790 7.782 0.008 1
1 364 . 12 1 1 A 37 37 LYS HA H 37 4.110 3.949 0.161 1
1 373 . 12 1 1 A 37 37 LYS CA C 37 59.700 59.530 0.170 1
1 374 . 12 1 1 A 37 37 LYS CB C 37 33.100 32.456 0.644 1
1 378 . 12 1 1 A 37 37 LYS N N 37 120.400 117.109 3.291 1
1 379 . 12 1 1 A 38 38 ILE H H 38 8.240 7.719 0.521 1
1 380 . 12 1 1 A 38 38 ILE HA H 38 3.410 3.993 -0.583 1
1 390 . 12 1 1 A 38 38 ILE CA C 38 66.200 62.074 4.126 1
1 391 . 12 1 1 A 38 38 ILE CB C 38 36.800 37.608 -0.808 1
1 395 . 12 1 1 A 38 38 ILE N N 38 121.400 119.937 1.463 1
1 396 . 12 1 1 A 39 39 GLN H H 39 8.460 8.402 0.058 1
1 397 . 12 1 1 A 39 39 GLN HA H 39 3.730 4.026 -0.296 1
1 402 . 12 1 1 A 39 39 GLN CA C 39 60.000 59.045 0.955 1
1 403 . 12 1 1 A 39 39 GLN CB C 39 27.600 28.088 -0.488 1
1 405 . 12 1 1 A 39 39 GLN N N 39 123.500 121.587 1.913 1
1 406 . 12 1 1 A 40 40 ASP H H 40 7.970 7.568 0.402 1
1 407 . 12 1 1 A 40 40 ASP HA H 40 4.240 4.449 -0.209 1
1 410 . 12 1 1 A 40 40 ASP CA C 40 57.400 56.696 0.704 1
1 411 . 12 1 1 A 40 40 ASP CB C 40 41.000 40.388 0.612 1
1 412 . 12 1 1 A 40 40 ASP N N 40 119.900 119.518 0.382 1
1 413 . 12 1 1 A 41 41 LYS H H 41 7.420 7.927 -0.507 1
1 414 . 12 1 1 A 41 41 LYS HA H 41 4.200 4.159 0.041 1
1 423 . 12 1 1 A 41 41 LYS CA C 41 58.200 59.188 -0.988 1
1 424 . 12 1 1 A 41 41 LYS CB C 41 33.900 32.747 1.153 1
1 427 . 12 1 1 A 41 41 LYS N N 41 115.700 120.820 -5.120 1
1 428 . 12 1 1 A 42 42 GLU H H 42 8.650 7.712 0.938 1
1 429 . 12 1 1 A 42 42 GLU HA H 42 4.470 4.580 -0.110 1
1 434 . 12 1 1 A 42 42 GLU CA C 42 55.300 55.924 -0.624 1
1 435 . 12 1 1 A 42 42 GLU CB C 42 33.200 32.078 1.122 1
1 437 . 12 1 1 A 42 42 GLU N N 42 114.200 113.757 0.443 1
1 438 . 12 1 1 A 43 43 GLY H H 43 8.400 7.822 0.578 1
1 439 . 12 1 1 A 43 43 GLY HA2 H 43 4.040 3.939 0.101 1
1 440 . 12 1 1 A 43 43 GLY HA3 H 43 3.820 3.943 -0.123 1
1 441 . 12 1 1 A 43 43 GLY CA C 43 45.900 45.753 0.147 1
1 442 . 12 1 1 A 43 43 GLY N N 43 109.000 109.858 -0.858 1
1 443 . 12 1 1 A 44 44 ILE H H 44 6.080 7.818 -1.738 1
1 444 . 12 1 1 A 44 44 ILE HA H 44 4.290 4.250 0.040 1
1 446 . 12 1 1 A 44 44 ILE CA C 44 57.700 58.543 -0.843 1
1 447 . 12 1 1 A 44 44 ILE CB C 44 40.400 38.563 1.837 1
1 448 . 12 1 1 A 44 44 ILE N N 44 120.500 121.938 -1.438 1
1 449 . 12 1 1 A 46 46 PRO HA H 46 4.030 4.271 -0.241 1
1 454 . 12 1 1 A 46 46 PRO CA C 46 66.100 65.099 1.001 1
1 455 . 12 1 1 A 46 46 PRO CB C 46 32.600 31.880 0.720 1
1 458 . 12 1 1 A 47 47 ASP H H 47 8.470 8.487 -0.017 1
1 459 . 12 1 1 A 47 47 ASP HA H 47 4.310 4.375 -0.065 1
1 462 . 12 1 1 A 47 47 ASP CA C 47 55.700 56.858 -1.158 1
1 463 . 12 1 1 A 47 47 ASP CB C 47 39.700 40.332 -0.632 1
1 464 . 12 1 1 A 47 47 ASP N N 47 113.700 117.420 -3.720 1
1 465 . 12 1 1 A 48 48 GLN H H 48 7.720 7.494 0.226 1
1 466 . 12 1 1 A 48 48 GLN HA H 48 4.340 4.414 -0.074 1
1 471 . 12 1 1 A 48 48 GLN CA C 48 55.500 55.837 -0.337 1
1 472 . 12 1 1 A 48 48 GLN CB C 48 29.900 30.369 -0.469 1
1 474 . 12 1 1 A 48 48 GLN N N 48 116.900 115.881 1.019 1
1 475 . 12 1 1 A 49 49 GLN H H 49 7.410 7.837 -0.427 1
1 476 . 12 1 1 A 49 49 GLN HA H 49 4.110 4.120 -0.010 1
1 481 . 12 1 1 A 49 49 GLN CA C 49 56.600 56.336 0.264 1
1 482 . 12 1 1 A 49 49 GLN CB C 49 31.300 28.946 2.354 1
1 484 . 12 1 1 A 49 49 GLN N N 49 118.000 120.785 -2.785 1
1 485 . 12 1 1 A 50 50 ARG H H 50 8.400 8.306 0.094 1
1 486 . 12 1 1 A 50 50 ARG HA H 50 4.380 4.253 0.127 1
1 491 . 12 1 1 A 50 50 ARG CA C 50 55.100 56.133 -1.033 1
1 492 . 12 1 1 A 50 50 ARG CB C 50 31.600 30.667 0.933 1
1 494 . 12 1 1 A 50 50 ARG N N 50 123.100 123.778 -0.678 1
1 495 . 12 1 1 A 51 51 LEU H H 51 8.710 8.572 0.138 1
1 496 . 12 1 1 A 51 51 LEU HA H 51 5.300 5.132 0.168 1
1 506 . 12 1 1 A 51 51 LEU CA C 51 52.900 53.312 -0.412 1
1 507 . 12 1 1 A 51 51 LEU CB C 51 45.700 44.714 0.986 1
1 511 . 12 1 1 A 51 51 LEU N N 51 124.400 122.854 1.546 1
1 512 . 12 1 1 A 52 52 ILE H H 52 9.060 8.698 0.362 1
1 513 . 12 1 1 A 52 52 ILE HA H 52 4.840 5.103 -0.263 1
1 523 . 12 1 1 A 52 52 ILE CA C 52 58.900 60.108 -1.208 1
1 524 . 12 1 1 A 52 52 ILE CB C 52 41.200 40.701 0.499 1
1 528 . 12 1 1 A 52 52 ILE N N 52 122.500 123.204 -0.704 1
1 529 . 12 1 1 A 53 53 PHE H H 53 8.730 9.596 -0.866 1
1 530 . 12 1 1 A 53 53 PHE HA H 53 5.100 4.869 0.231 1
1 535 . 12 1 1 A 53 53 PHE CA C 53 56.300 57.519 -1.219 1
1 536 . 12 1 1 A 53 53 PHE CB C 53 43.500 42.154 1.346 1
1 537 . 12 1 1 A 53 53 PHE N N 53 124.800 127.563 -2.763 1
1 538 . 12 1 1 A 54 54 ALA H H 54 8.940 9.139 -0.199 1
1 539 . 12 1 1 A 54 54 ALA HA H 54 3.610 3.890 -0.280 1
1 543 . 12 1 1 A 54 54 ALA CA C 54 52.500 53.013 -0.513 1
1 544 . 12 1 1 A 54 54 ALA CB C 54 16.300 17.340 -1.040 1
1 545 . 12 1 1 A 54 54 ALA N N 54 133.100 130.349 2.751 1
1 546 . 12 1 1 A 55 55 GLY H H 55 8.070 8.496 -0.426 1
1 547 . 12 1 1 A 55 55 GLY HA2 H 55 4.000 3.806 0.194 1
1 548 . 12 1 1 A 55 55 GLY HA3 H 55 3.340 3.840 -0.500 1
1 549 . 12 1 1 A 55 55 GLY CA C 55 45.200 45.316 -0.116 1
1 550 . 12 1 1 A 55 55 GLY N N 55 102.500 102.650 -0.150 1
1 551 . 12 1 1 A 56 56 LYS H H 56 7.860 7.831 0.029 1
1 552 . 12 1 1 A 56 56 LYS HA H 56 4.510 4.509 0.001 1
1 558 . 12 1 1 A 56 56 LYS CA C 56 54.500 55.533 -1.033 1
1 559 . 12 1 1 A 56 56 LYS CB C 56 34.400 33.411 0.989 1
1 561 . 12 1 1 A 56 56 LYS N N 56 121.800 118.373 3.427 1
1 562 . 12 1 1 A 57 57 GLN H H 57 8.600 8.713 -0.113 1
1 563 . 12 1 1 A 57 57 GLN HA H 57 4.410 5.368 -0.958 1
1 568 . 12 1 1 A 57 57 GLN CA C 57 55.900 54.784 1.116 1
1 569 . 12 1 1 A 57 57 GLN CB C 57 28.800 30.595 -1.795 1
1 571 . 12 1 1 A 57 57 GLN N N 57 123.200 123.153 0.047 1
1 572 . 12 1 1 A 58 58 LEU H H 58 8.480 8.494 -0.014 1
1 573 . 12 1 1 A 58 58 LEU HA H 58 4.060 5.052 -0.992 1
1 583 . 12 1 1 A 58 58 LEU CA C 58 54.100 52.747 1.353 1
1 584 . 12 1 1 A 58 58 LEU CB C 58 41.500 45.772 -4.272 1
1 588 . 12 1 1 A 58 58 LEU N N 58 125.900 122.450 3.450 1
1 589 . 12 1 1 A 59 59 GLU H H 59 8.400 8.752 -0.352 1
1 590 . 12 1 1 A 59 59 GLU HA H 59 4.400 4.578 -0.178 1
1 595 . 12 1 1 A 59 59 GLU CA C 59 55.900 57.152 -1.252 1
1 596 . 12 1 1 A 59 59 GLU CB C 59 31.900 32.258 -0.358 1
1 598 . 12 1 1 A 59 59 GLU N N 59 123.100 117.565 5.535 1
1 599 . 12 1 1 A 60 60 ASP H H 60 8.110 7.751 0.359 1
1 600 . 12 1 1 A 60 60 ASP HA H 60 4.270 4.462 -0.192 1
1 603 . 12 1 1 A 60 60 ASP CA C 60 57.100 54.934 2.166 1
1 604 . 12 1 1 A 60 60 ASP CB C 60 40.800 41.943 -1.143 1
1 605 . 12 1 1 A 60 60 ASP N N 60 120.300 120.199 0.101 1
1 606 . 12 1 1 A 61 61 GLY HA2 H 61 4.000 4.087 -0.087 1
1 607 . 12 1 1 A 61 61 GLY HA3 H 61 3.830 4.104 -0.274 1
1 608 . 12 1 1 A 61 61 GLY CA C 61 45.000 46.161 -1.161 1
1 609 . 12 1 1 A 62 62 ARG H H 62 7.350 8.620 -1.270 1
1 610 . 12 1 1 A 62 62 ARG HA H 62 4.640 4.980 -0.340 1
1 615 . 12 1 1 A 62 62 ARG CA C 62 54.400 53.886 0.514 1
1 616 . 12 1 1 A 62 62 ARG CB C 62 32.600 34.443 -1.843 1
1 618 . 12 1 1 A 62 62 ARG N N 62 119.300 122.728 -3.428 1
1 619 . 12 1 1 A 63 63 THR H H 63 8.460 8.611 -0.151 1
1 620 . 12 1 1 A 63 63 THR HA H 63 5.060 4.584 0.476 1
1 625 . 12 1 1 A 63 63 THR CA C 63 59.700 60.828 -1.128 1
1 626 . 12 1 1 A 63 63 THR CB C 63 72.000 70.857 1.143 1
1 628 . 12 1 1 A 63 63 THR N N 63 109.100 112.735 -3.635 1
1 629 . 12 1 1 A 64 64 LEU H H 64 8.190 8.816 -0.626 1
1 630 . 12 1 1 A 64 64 LEU HA H 64 3.920 3.990 -0.070 1
1 640 . 12 1 1 A 64 64 LEU CA C 64 58.400 57.949 0.451 1
1 641 . 12 1 1 A 64 64 LEU CB C 64 40.200 41.272 -1.072 1
1 645 . 12 1 1 A 64 64 LEU N N 64 118.100 123.415 -5.315 1
1 646 . 12 1 1 A 65 65 SER H H 65 8.370 7.894 0.476 1
1 647 . 12 1 1 A 65 65 SER HA H 65 4.150 4.186 -0.036 1
1 650 . 12 1 1 A 65 65 SER CA C 65 60.900 60.550 0.350 1
1 651 . 12 1 1 A 65 65 SER CB C 65 62.500 63.367 -0.867 1
1 652 . 12 1 1 A 65 65 SER N N 65 112.200 114.176 -1.976 1
1 653 . 12 1 1 A 66 66 GLU H H 66 7.780 7.800 -0.020 1
1 654 . 12 1 1 A 66 66 GLU HA H 66 3.890 4.147 -0.257 1
1 659 . 12 1 1 A 66 66 GLU CA C 66 59.200 58.909 0.291 1
1 660 . 12 1 1 A 66 66 GLU CB C 66 29.400 29.491 -0.091 1
1 662 . 12 1 1 A 66 66 GLU N N 66 123.600 121.803 1.797 1
1 663 . 12 1 1 A 67 67 TYR H H 67 7.290 8.155 -0.865 1
1 664 . 12 1 1 A 67 67 TYR HA H 67 4.590 4.550 0.040 1
1 669 . 12 1 1 A 67 67 TYR CA C 67 58.400 59.601 -1.201 1
1 670 . 12 1 1 A 67 67 TYR CB C 67 39.800 39.261 0.539 1
1 671 . 12 1 1 A 67 67 TYR N N 67 116.400 122.498 -6.098 1
1 672 . 12 1 1 A 68 68 ASN H H 68 8.040 8.039 0.001 1
1 673 . 12 1 1 A 68 68 ASN HA H 68 4.240 4.335 -0.095 1
1 676 . 12 1 1 A 68 68 ASN CA C 68 54.100 54.605 -0.505 1
1 677 . 12 1 1 A 68 68 ASN CB C 68 37.200 38.113 -0.913 1
1 678 . 12 1 1 A 68 68 ASN N N 68 115.600 118.204 -2.604 1
1 679 . 12 1 1 A 69 69 ILE H H 69 7.200 7.703 -0.503 1
1 680 . 12 1 1 A 69 69 ILE HA H 69 3.280 4.459 -1.179 1
1 690 . 12 1 1 A 69 69 ILE CA C 69 59.800 59.763 0.037 1
1 691 . 12 1 1 A 69 69 ILE CB C 69 36.600 39.210 -2.610 1
1 695 . 12 1 1 A 69 69 ILE N N 69 119.100 116.388 2.712 1
1 696 . 12 1 1 A 70 70 GLN H H 70 7.570 8.553 -0.983 1
1 697 . 12 1 1 A 70 70 GLN HA H 70 4.410 4.926 -0.516 1
1 702 . 12 1 1 A 70 70 GLN CA C 70 53.500 54.052 -0.552 1
1 703 . 12 1 1 A 70 70 GLN CB C 70 31.500 31.252 0.248 1
1 705 . 12 1 1 A 70 70 GLN N N 70 124.800 120.841 3.959 1
1 706 . 12 1 1 A 71 71 LYS H H 71 8.370 8.581 -0.211 1
1 707 . 12 1 1 A 71 71 LYS HA H 71 3.870 4.348 -0.478 1
1 716 . 12 1 1 A 71 71 LYS CA C 71 58.000 55.555 2.445 1
1 717 . 12 1 1 A 71 71 LYS CB C 71 32.500 32.855 -0.355 1
1 720 . 12 1 1 A 71 71 LYS N N 71 120.200 123.878 -3.678 1
1 721 . 12 1 1 A 72 72 GLU H H 72 9.230 8.002 1.228 1
1 722 . 12 1 1 A 72 72 GLU HA H 72 3.240 4.173 -0.933 1
1 727 . 12 1 1 A 72 72 GLU CA C 72 58.300 56.691 1.609 1
1 728 . 12 1 1 A 72 72 GLU CB C 72 26.000 28.872 -2.872 1
1 730 . 12 1 1 A 72 72 GLU N N 72 115.100 119.475 -4.375 1
1 731 . 12 1 1 A 73 73 SER H H 73 7.690 8.387 -0.697 1
1 732 . 12 1 1 A 73 73 SER HA H 73 4.520 4.704 -0.184 1
1 735 . 12 1 1 A 73 73 SER CA C 73 61.100 59.176 1.924 1
1 736 . 12 1 1 A 73 73 SER CB C 73 64.800 63.964 0.836 1
1 737 . 12 1 1 A 73 73 SER N N 73 115.300 114.035 1.265 1
1 738 . 12 1 1 A 74 74 THR H H 74 8.620 7.856 0.764 1
1 739 . 12 1 1 A 74 74 THR HA H 74 5.200 5.008 0.192 1
1 744 . 12 1 1 A 74 74 THR CA C 74 62.400 61.699 0.701 1
1 745 . 12 1 1 A 74 74 THR CB C 74 70.200 70.828 -0.628 1
1 747 . 12 1 1 A 74 74 THR N N 74 117.500 112.904 4.596 1
1 748 . 12 1 1 A 75 75 LEU H H 75 9.350 9.000 0.350 1
1 749 . 12 1 1 A 75 75 LEU HA H 75 4.990 4.924 0.066 1
1 759 . 12 1 1 A 75 75 LEU CA C 75 53.800 53.428 0.372 1
1 760 . 12 1 1 A 75 75 LEU CB C 75 44.400 46.249 -1.849 1
1 764 . 12 1 1 A 75 75 LEU N N 75 128.000 127.770 0.230 1
1 765 . 12 1 1 A 76 76 HIS H H 76 9.140 8.155 0.985 1
1 766 . 12 1 1 A 76 76 HIS HA H 76 5.040 5.168 -0.128 1
1 769 . 12 1 1 A 76 76 HIS CA C 76 56.200 54.139 2.061 1
1 770 . 12 1 1 A 76 76 HIS CB C 76 32.500 31.512 0.988 1
1 771 . 12 1 1 A 76 76 HIS N N 76 119.600 123.078 -3.478 1
1 772 . 12 1 1 A 77 77 LEU H H 77 8.240 8.913 -0.673 1
1 773 . 12 1 1 A 77 77 LEU HA H 77 5.080 5.388 -0.308 1
1 783 . 12 1 1 A 77 77 LEU CA C 77 53.600 53.795 -0.195 1
1 784 . 12 1 1 A 77 77 LEU CB C 77 44.100 43.413 0.687 1
1 788 . 12 1 1 A 77 77 LEU N N 77 123.800 121.096 2.704 1
1 789 . 12 1 1 A 78 78 VAL H H 78 9.110 8.832 0.278 1
1 790 . 12 1 1 A 78 78 VAL HA H 78 4.260 4.986 -0.726 1
1 798 . 12 1 1 A 78 78 VAL CA C 78 60.400 60.400 0.000 1
1 799 . 12 1 1 A 78 78 VAL CB C 78 34.700 36.012 -1.312 1
1 802 . 12 1 1 A 78 78 VAL N N 78 127.100 124.259 2.841 1
1 803 . 12 1 1 A 79 79 LEU H H 79 8.050 8.488 -0.438 1
1 804 . 12 1 1 A 79 79 LEU HA H 79 4.950 4.801 0.149 1
1 813 . 12 1 1 A 79 79 LEU CA C 79 53.800 54.035 -0.235 1
1 814 . 12 1 1 A 79 79 LEU CB C 79 42.700 43.689 -0.989 1
1 818 . 12 1 1 A 79 79 LEU N N 79 123.400 127.389 -3.989 1
1 819 . 12 1 1 A 80 80 ARG H H 80 8.540 8.048 0.492 1
1 820 . 12 1 1 A 80 80 ARG HA H 80 4.170 4.144 0.026 1
1 827 . 12 1 1 A 80 80 ARG CA C 80 55.800 57.324 -1.524 1
1 828 . 12 1 1 A 80 80 ARG CB C 80 31.100 30.369 0.731 1
1 830 . 12 1 1 A 80 80 ARG N N 80 123.500 126.640 -3.140 1
1 831 . 12 1 1 A 81 81 LEU H H 81 8.250 8.889 -0.639 1
1 832 . 12 1 1 A 81 81 LEU HA H 81 4.270 4.558 -0.288 1
1 842 . 12 1 1 A 81 81 LEU CA C 81 55.000 54.700 0.300 1
1 843 . 12 1 1 A 81 81 LEU CB C 81 42.200 40.703 1.497 1
1 847 . 12 1 1 A 81 81 LEU N N 81 124.100 128.785 -4.685 1
1 848 . 12 1 1 A 82 82 ARG H H 82 8.310 8.401 -0.091 1
1 849 . 12 1 1 A 82 82 ARG HA H 82 4.200 4.520 -0.320 1
1 852 . 12 1 1 A 82 82 ARG CA C 82 56.300 56.880 -0.580 1
1 853 . 12 1 1 A 82 82 ARG CB C 82 30.700 33.296 -2.596 1
1 855 . 12 1 1 A 82 82 ARG N N 82 121.500 128.132 -6.632 1
1 856 . 12 1 1 A 83 83 GLY H H 83 8.410 7.676 0.734 1
1 857 . 12 1 1 A 83 83 GLY HA2 H 83 3.750 3.811 -0.061 1
1 858 . 12 1 1 A 83 83 GLY HA3 H 83 3.754 3.888 -0.134 1
1 859 . 12 1 1 A 83 83 GLY CA C 83 45.100 44.312 0.788 1
1 860 . 12 1 1 A 83 83 GLY N N 83 110.200 107.936 2.264 1
1 861 . 12 1 1 A 84 84 TYR H H 84 7.950 8.183 -0.233 1
1 862 . 12 1 1 A 84 84 TYR HA H 84 4.400 4.898 -0.498 1
1 865 . 12 1 1 A 84 84 TYR CA C 84 58.100 58.268 -0.168 1
1 866 . 12 1 1 A 84 84 TYR CB C 84 38.800 40.020 -1.220 1
1 867 . 12 1 1 A 84 84 TYR N N 84 119.900 119.129 0.771 1
1 868 . 12 1 1 A 85 85 ALA H H 85 8.150 8.813 -0.663 1
1 869 . 12 1 1 A 85 85 ALA HA H 85 4.150 5.070 -0.920 1
1 873 . 12 1 1 A 85 85 ALA CA C 85 52.600 51.728 0.872 1
1 874 . 12 1 1 A 85 85 ALA CB C 85 19.200 23.218 -4.018 1
1 875 . 12 1 1 A 85 85 ALA N N 85 124.800 123.034 1.766 1
1 876 . 12 1 1 A 86 86 ASP H H 86 8.020 8.161 -0.141 1
1 877 . 12 1 1 A 86 86 ASP HA H 86 4.450 4.976 -0.526 1
1 880 . 12 1 1 A 86 86 ASP CA C 86 54.100 53.282 0.818 1
1 881 . 12 1 1 A 86 86 ASP CB C 86 41.100 44.556 -3.456 1
1 882 . 12 1 1 A 86 86 ASP N N 86 118.900 119.719 -0.819 1
1 883 . 12 1 1 A 87 87 LEU H H 87 8.010 8.771 -0.761 1
1 884 . 12 1 1 A 87 87 LEU HA H 87 4.210 4.218 -0.008 1
1 893 . 12 1 1 A 87 87 LEU CA C 87 55.300 55.629 -0.329 1
1 894 . 12 1 1 A 87 87 LEU CB C 87 42.000 41.550 0.450 1
1 898 . 12 1 1 A 87 87 LEU N N 87 122.400 123.011 -0.611 1
1 899 . 12 1 1 A 88 88 ARG H H 88 8.170 7.972 0.198 1
1 900 . 12 1 1 A 88 88 ARG HA H 88 4.210 4.404 -0.194 1
1 903 . 12 1 1 A 88 88 ARG CA C 88 56.300 56.013 0.287 1
1 904 . 12 1 1 A 88 88 ARG CB C 88 30.600 31.160 -0.560 1
1 905 . 12 1 1 A 88 88 ARG N N 88 121.200 123.357 -2.157 1
1 906 . 12 1 1 A 91 91 PRO HA H 91 4.290 4.689 -0.399 1
1 911 . 12 1 1 A 91 91 PRO CA C 91 63.800 62.442 1.358 1
1 912 . 12 1 1 A 91 91 PRO CB C 91 32.100 29.453 2.647 1
1 915 . 12 1 1 A 92 92 ASP H H 92 8.280 8.462 -0.182 1
1 916 . 12 1 1 A 92 92 ASP HA H 92 4.540 4.920 -0.380 1
1 919 . 12 1 1 A 92 92 ASP CA C 92 54.600 53.570 1.030 1
1 920 . 12 1 1 A 92 92 ASP CB C 92 41.000 44.661 -3.661 1
1 921 . 12 1 1 A 92 92 ASP N N 92 118.700 123.356 -4.656 1
1 922 . 12 1 1 A 93 93 ARG H H 93 7.780 8.416 -0.636 1
1 923 . 12 1 1 A 93 93 ARG HA H 93 4.190 4.154 0.036 1
1 930 . 12 1 1 A 93 93 ARG CA C 93 56.300 56.468 -0.168 1
1 931 . 12 1 1 A 93 93 ARG CB C 93 30.700 30.434 0.266 1
1 934 . 12 1 1 A 93 93 ARG N N 93 120.700 122.159 -1.459 1
1 935 . 12 1 1 A 94 94 GLN H H 94 8.280 8.360 -0.080 1
1 936 . 12 1 1 A 94 94 GLN HA H 94 4.210 4.143 0.067 1
1 941 . 12 1 1 A 94 94 GLN CA C 94 55.800 55.990 -0.190 1
1 942 . 12 1 1 A 94 94 GLN CB C 94 29.300 29.195 0.105 1
1 944 . 12 1 1 A 94 94 GLN N N 94 121.000 122.132 -1.132 1
1 945 . 12 1 1 A 95 95 ASP H H 95 8.270 8.694 -0.424 1
1 946 . 12 1 1 A 95 95 ASP HA H 95 4.450 5.111 -0.661 1
1 949 . 12 1 1 A 95 95 ASP CA C 95 54.300 53.593 0.707 1
1 950 . 12 1 1 A 95 95 ASP CB C 95 41.000 43.513 -2.513 1
1 951 . 12 1 1 A 95 95 ASP N N 95 121.000 118.092 2.908 1
1 952 . 12 1 1 A 96 96 HIS H H 96 8.090 8.589 -0.499 1
1 953 . 12 1 1 A 96 96 HIS HA H 96 4.470 5.482 -1.012 1
1 956 . 12 1 1 A 96 96 HIS CA C 96 55.900 54.161 1.739 1
1 957 . 12 1 1 A 96 96 HIS CB C 96 30.500 33.103 -2.603 1
1 958 . 12 1 1 A 96 96 HIS N N 96 119.300 118.063 1.237 1
1 959 . 12 1 1 A 97 97 HIS H H 97 8.240 8.936 -0.696 1
1 960 . 12 1 1 A 97 97 HIS HA H 97 4.470 4.891 -0.421 1
1 963 . 12 1 1 A 97 97 HIS CA C 97 56.200 54.925 1.275 1
1 964 . 12 1 1 A 97 97 HIS CB C 97 30.400 30.350 0.050 1
1 965 . 12 1 1 A 97 97 HIS N N 97 121.300 118.788 2.512 1
1 966 . 12 1 1 A 98 98 PRO HA H 98 4.340 4.367 -0.027 1
1 973 . 12 1 1 A 98 98 PRO CA C 98 63.700 63.107 0.593 1
1 974 . 12 1 1 A 98 98 PRO CB C 98 31.900 33.080 -1.180 1
1 977 . 12 1 1 A 99 99 GLY H H 99 8.660 8.226 0.434 1
1 978 . 12 1 1 A 99 99 GLY HA2 H 99 3.920 4.054 -0.134 1
1 979 . 12 1 1 A 99 99 GLY HA3 H 99 3.920 4.107 -0.187 1
1 980 . 12 1 1 A 99 99 GLY CA C 99 45.200 44.934 0.266 1
1 981 . 12 1 1 A 99 99 GLY N N 99 110.000 108.973 1.027 1
1 982 . 12 1 1 A 100 100 SER H H 100 8.170 8.714 -0.544 1
1 983 . 12 1 1 A 100 100 SER HA H 100 4.360 5.085 -0.725 1
1 986 . 12 1 1 A 100 100 SER CA C 100 58.500 57.317 1.183 1
1 987 . 12 1 1 A 100 100 SER CB C 100 64.000 67.386 -3.386 1
1 988 . 12 1 1 A 100 100 SER N N 100 115.600 118.830 -3.230 1
1 989 . 12 1 1 A 101 101 GLY H H 101 8.420 8.546 -0.126 1
1 990 . 12 1 1 A 101 101 GLY HA2 H 101 3.890 4.167 -0.277 1
1 991 . 12 1 1 A 101 101 GLY HA3 H 101 3.920 4.169 -0.249 1
1 992 . 12 1 1 A 101 101 GLY CA C 101 45.200 44.917 0.283 1
1 993 . 12 1 1 A 101 101 GLY N N 101 111.000 109.424 1.576 1
1 994 . 12 1 1 A 102 102 ALA H H 102 8.030 8.466 -0.436 1
1 995 . 12 1 1 A 102 102 ALA HA H 102 4.250 4.843 -0.593 1
1 999 . 12 1 1 A 102 102 ALA CA C 102 52.500 51.325 1.175 1
1 1000 . 12 1 1 A 102 102 ALA CB C 102 19.200 22.355 -3.155 1
1 4 . 13 1 1 A 2 2 SER H H 2 8.160 8.319 -0.159 1
1 5 . 13 1 1 A 2 2 SER HA H 2 4.370 5.291 -0.921 1
1 9 . 13 1 1 A 2 2 SER CA C 2 58.300 56.546 1.754 1
1 10 . 13 1 1 A 2 2 SER CB C 2 63.900 65.593 -1.693 1
1 11 . 13 1 1 A 2 2 SER N N 2 115.600 115.446 0.154 1
1 12 . 13 1 1 A 3 3 LEU H H 3 8.250 8.427 -0.177 1
1 13 . 13 1 1 A 3 3 LEU HA H 3 4.280 4.169 0.111 1
1 17 . 13 1 1 A 3 3 LEU CA C 3 55.200 55.210 -0.010 1
1 18 . 13 1 1 A 3 3 LEU CB C 3 42.100 42.539 -0.439 1
1 19 . 13 1 1 A 3 3 LEU N N 3 124.100 123.472 0.628 1
1 20 . 13 1 1 A 4 4 VAL H H 4 7.950 8.850 -0.900 1
1 21 . 13 1 1 A 4 4 VAL HA H 4 4.680 4.847 -0.167 1
1 26 . 13 1 1 A 4 4 VAL CA C 4 59.800 58.091 1.709 1
1 27 . 13 1 1 A 4 4 VAL CB C 4 32.500 33.623 -1.123 1
1 28 . 13 1 1 A 4 4 VAL N N 4 122.600 118.154 4.446 1
1 29 . 13 1 1 A 5 5 PRO CA C 5 63.100 62.802 0.298 1
1 30 . 13 1 1 A 5 5 PRO CB C 5 32.000 32.221 -0.221 1
1 32 . 13 1 1 A 6 6 ARG H H 6 8.360 8.704 -0.344 1
1 33 . 13 1 1 A 6 6 ARG HA H 6 4.250 4.952 -0.702 1
1 36 . 13 1 1 A 6 6 ARG CA C 6 56.000 54.988 1.012 1
1 37 . 13 1 1 A 6 6 ARG CB C 6 30.900 33.391 -2.491 1
1 38 . 13 1 1 A 6 6 ARG N N 6 121.800 123.912 -2.112 1
1 39 . 13 1 1 A 7 7 GLY H H 7 8.460 8.384 0.076 1
1 40 . 13 1 1 A 7 7 GLY HA2 H 7 3.940 4.232 -0.292 1
1 41 . 13 1 1 A 7 7 GLY HA3 H 7 3.760 4.234 -0.474 1
1 42 . 13 1 1 A 7 7 GLY CA C 7 45.000 45.438 -0.438 1
1 43 . 13 1 1 A 7 7 GLY N N 7 110.700 114.426 -3.726 1
1 44 . 13 1 1 A 8 8 SER H H 8 7.990 8.901 -0.911 1
1 45 . 13 1 1 A 8 8 SER HA H 8 4.450 4.560 -0.110 1
1 48 . 13 1 1 A 8 8 SER CA C 8 58.900 59.395 -0.495 1
1 49 . 13 1 1 A 8 8 SER CB C 8 64.200 64.428 -0.228 1
1 50 . 13 1 1 A 8 8 SER N N 8 115.500 115.240 0.260 1
1 51 . 13 1 1 A 9 9 MET H H 9 9.040 7.611 1.429 1
1 52 . 13 1 1 A 9 9 MET HA H 9 4.610 5.076 -0.466 1
1 60 . 13 1 1 A 9 9 MET CA C 9 54.400 53.399 1.001 1
1 61 . 13 1 1 A 9 9 MET CB C 9 35.400 33.565 1.835 1
1 64 . 13 1 1 A 9 9 MET N N 9 120.500 119.241 1.259 1
1 65 . 13 1 1 A 10 10 GLN H H 10 8.270 8.936 -0.666 1
1 66 . 13 1 1 A 10 10 GLN HA H 10 5.270 5.331 -0.061 1
1 71 . 13 1 1 A 10 10 GLN CA C 10 54.200 54.347 -0.147 1
1 72 . 13 1 1 A 10 10 GLN CB C 10 30.500 32.420 -1.920 1
1 74 . 13 1 1 A 10 10 GLN N N 10 121.000 122.553 -1.553 1
1 75 . 13 1 1 A 11 11 ILE H H 11 8.270 8.807 -0.537 1
1 76 . 13 1 1 A 11 11 ILE HA H 11 4.100 4.809 -0.709 1
1 86 . 13 1 1 A 11 11 ILE CA C 11 59.400 59.344 0.056 1
1 87 . 13 1 1 A 11 11 ILE CB C 11 41.800 40.320 1.480 1
1 91 . 13 1 1 A 11 11 ILE N N 11 114.600 121.410 -6.810 1
1 92 . 13 1 1 A 12 12 PHE H H 12 8.520 8.794 -0.274 1
1 93 . 13 1 1 A 12 12 PHE HA H 12 5.540 5.337 0.203 1
1 96 . 13 1 1 A 12 12 PHE CA C 12 55.000 56.876 -1.876 1
1 97 . 13 1 1 A 12 12 PHE CB C 12 41.200 40.970 0.230 1
1 98 . 13 1 1 A 12 12 PHE N N 12 118.600 123.147 -4.547 1
1 99 . 13 1 1 A 13 13 VAL H H 13 9.230 8.868 0.362 1
1 100 . 13 1 1 A 13 13 VAL HA H 13 4.740 4.961 -0.221 1
1 108 . 13 1 1 A 13 13 VAL CA C 13 60.300 60.669 -0.369 1
1 109 . 13 1 1 A 13 13 VAL CB C 13 34.100 35.053 -0.953 1
1 112 . 13 1 1 A 13 13 VAL N N 13 121.400 122.920 -1.520 1
1 113 . 13 1 1 A 14 14 LYS H H 14 8.910 8.870 0.040 1
1 114 . 13 1 1 A 14 14 LYS HA H 14 5.190 4.865 0.325 1
1 122 . 13 1 1 A 14 14 LYS CA C 14 54.600 54.809 -0.209 1
1 123 . 13 1 1 A 14 14 LYS CB C 14 34.300 34.707 -0.407 1
1 126 . 13 1 1 A 14 14 LYS N N 14 128.000 126.776 1.224 1
1 127 . 13 1 1 A 15 15 THR H H 15 8.650 8.957 -0.307 1
1 128 . 13 1 1 A 15 15 THR HA H 15 4.870 4.443 0.427 1
1 133 . 13 1 1 A 15 15 THR CA C 15 60.300 60.760 -0.460 1
1 134 . 13 1 1 A 15 15 THR CB C 15 70.600 71.121 -0.521 1
1 136 . 13 1 1 A 15 15 THR N N 15 115.300 117.519 -2.219 1
1 137 . 13 1 1 A 16 16 LEU H H 16 9.070 8.836 0.234 1
1 138 . 13 1 1 A 16 16 LEU HA H 16 4.210 3.967 0.243 1
1 148 . 13 1 1 A 16 16 LEU CA C 16 57.400 57.797 -0.397 1
1 149 . 13 1 1 A 16 16 LEU CB C 16 41.800 41.387 0.413 1
1 153 . 13 1 1 A 16 16 LEU N N 16 121.400 122.412 -1.012 1
1 154 . 13 1 1 A 17 17 THR H H 17 7.560 7.384 0.176 1
1 155 . 13 1 1 A 17 17 THR HA H 17 4.330 4.339 -0.009 1
1 160 . 13 1 1 A 17 17 THR CA C 17 61.400 62.979 -1.579 1
1 161 . 13 1 1 A 17 17 THR CB C 17 68.900 69.304 -0.404 1
1 163 . 13 1 1 A 17 17 THR N N 17 105.900 111.689 -5.789 1
1 164 . 13 1 1 A 18 18 GLY H H 18 7.750 7.618 0.132 1
1 165 . 13 1 1 A 18 18 GLY HA2 H 18 4.250 3.976 0.274 1
1 166 . 13 1 1 A 18 18 GLY HA3 H 18 3.520 3.998 -0.478 1
1 167 . 13 1 1 A 18 18 GLY CA C 18 45.300 44.971 0.329 1
1 168 . 13 1 1 A 18 18 GLY N N 18 109.300 109.643 -0.343 1
1 169 . 13 1 1 A 19 19 LYS H H 19 7.210 7.783 -0.573 1
1 170 . 13 1 1 A 19 19 LYS HA H 19 4.260 4.336 -0.076 1
1 175 . 13 1 1 A 19 19 LYS CA C 19 56.300 56.069 0.231 1
1 176 . 13 1 1 A 19 19 LYS CB C 19 33.200 33.544 -0.344 1
1 179 . 13 1 1 A 19 19 LYS N N 19 122.000 119.973 2.027 1
1 180 . 13 1 1 A 20 20 THR H H 20 8.570 8.716 -0.146 1
1 181 . 13 1 1 A 20 20 THR HA H 20 4.950 5.599 -0.649 1
1 186 . 13 1 1 A 20 20 THR CA C 20 62.200 60.414 1.786 1
1 187 . 13 1 1 A 20 20 THR CB C 20 69.700 70.668 -0.968 1
1 189 . 13 1 1 A 20 20 THR N N 20 120.700 113.018 7.682 1
1 190 . 13 1 1 A 21 21 ILE H H 21 9.510 8.464 1.046 1
1 191 . 13 1 1 A 21 21 ILE HA H 21 4.390 4.861 -0.471 1
1 201 . 13 1 1 A 21 21 ILE CA C 21 60.000 59.072 0.928 1
1 202 . 13 1 1 A 21 21 ILE CB C 21 40.700 41.727 -1.027 1
1 206 . 13 1 1 A 21 21 ILE N N 21 128.200 122.841 5.359 1
1 207 . 13 1 1 A 22 22 THR H H 22 8.700 8.700 0.000 1
1 208 . 13 1 1 A 22 22 THR HA H 22 4.860 4.493 0.367 1
1 213 . 13 1 1 A 22 22 THR CA C 22 62.100 62.825 -0.725 1
1 214 . 13 1 1 A 22 22 THR CB C 22 69.500 68.959 0.541 1
1 216 . 13 1 1 A 22 22 THR N N 22 122.300 121.362 0.938 1
1 217 . 13 1 1 A 23 23 LEU H H 23 8.720 8.996 -0.276 1
1 218 . 13 1 1 A 23 23 LEU HA H 23 4.690 5.065 -0.375 1
1 228 . 13 1 1 A 23 23 LEU CA C 23 52.700 53.146 -0.446 1
1 229 . 13 1 1 A 23 23 LEU CB C 23 46.600 44.892 1.708 1
1 233 . 13 1 1 A 23 23 LEU N N 23 125.400 127.637 -2.237 1
1 234 . 13 1 1 A 24 24 GLU H H 24 8.080 8.667 -0.587 1
1 235 . 13 1 1 A 24 24 GLU HA H 24 4.800 4.741 0.059 1
1 238 . 13 1 1 A 24 24 GLU CA C 24 55.400 55.778 -0.378 1
1 239 . 13 1 1 A 24 24 GLU CB C 24 30.100 30.819 -0.719 1
1 241 . 13 1 1 A 24 24 GLU N N 24 121.800 123.029 -1.229 1
1 242 . 13 1 1 A 25 25 VAL H H 25 8.800 8.901 -0.101 1
1 243 . 13 1 1 A 25 25 VAL HA H 25 4.640 4.914 -0.274 1
1 251 . 13 1 1 A 25 25 VAL CA C 25 58.600 59.502 -0.902 1
1 252 . 13 1 1 A 25 25 VAL CB C 25 36.300 36.070 0.230 1
1 255 . 13 1 1 A 25 25 VAL N N 25 116.700 117.214 -0.514 1
1 256 . 13 1 1 A 26 26 GLU H H 26 8.500 8.352 0.148 1
1 257 . 13 1 1 A 26 26 GLU HA H 26 4.900 4.750 0.150 1
1 260 . 13 1 1 A 26 26 GLU CA C 26 53.000 53.313 -0.313 1
1 261 . 13 1 1 A 26 26 GLU CB C 26 31.200 32.604 -1.404 1
1 262 . 13 1 1 A 26 26 GLU N N 26 117.900 121.821 -3.921 1
1 263 . 13 1 1 A 27 27 PRO HA H 27 4.040 4.416 -0.376 1
1 270 . 13 1 1 A 27 27 PRO CA C 27 65.400 64.394 1.006 1
1 271 . 13 1 1 A 27 27 PRO CB C 27 31.700 31.854 -0.154 1
1 274 . 13 1 1 A 28 28 SER H H 28 7.010 8.089 -1.079 1
1 275 . 13 1 1 A 28 28 SER HA H 28 4.280 4.602 -0.322 1
1 278 . 13 1 1 A 28 28 SER CA C 28 57.400 58.970 -1.570 1
1 279 . 13 1 1 A 28 28 SER CB C 28 63.400 64.411 -1.011 1
1 280 . 13 1 1 A 28 28 SER N N 28 103.800 112.083 -8.283 1
1 281 . 13 1 1 A 29 29 ASP H H 29 7.960 7.925 0.035 1
1 282 . 13 1 1 A 29 29 ASP HA H 29 4.600 5.082 -0.482 1
1 285 . 13 1 1 A 29 29 ASP CA C 29 55.900 53.143 2.757 1
1 286 . 13 1 1 A 29 29 ASP CB C 29 41.000 42.942 -1.942 1
1 287 . 13 1 1 A 29 29 ASP N N 29 123.700 121.666 2.034 1
1 288 . 13 1 1 A 30 30 THR H H 30 7.780 8.560 -0.780 1
1 289 . 13 1 1 A 30 30 THR HA H 30 4.850 4.701 0.149 1
1 294 . 13 1 1 A 30 30 THR CA C 30 59.400 59.977 -0.577 1
1 295 . 13 1 1 A 30 30 THR CB C 30 71.100 71.356 -0.256 1
1 297 . 13 1 1 A 30 30 THR N N 30 108.800 117.177 -8.377 1
1 298 . 13 1 1 A 31 31 ILE H H 31 8.320 9.019 -0.699 1
1 299 . 13 1 1 A 31 31 ILE HA H 31 3.580 3.741 -0.161 1
1 309 . 13 1 1 A 31 31 ILE CA C 31 62.200 64.810 -2.610 1
1 310 . 13 1 1 A 31 31 ILE CB C 31 34.300 37.541 -3.241 1
1 314 . 13 1 1 A 31 31 ILE N N 31 121.300 126.882 -5.582 1
1 315 . 13 1 1 A 32 32 GLU H H 32 9.850 8.357 1.493 1
1 316 . 13 1 1 A 32 32 GLU HA H 32 3.780 3.908 -0.128 1
1 321 . 13 1 1 A 32 32 GLU CA C 32 60.500 59.931 0.569 1
1 322 . 13 1 1 A 32 32 GLU CB C 32 28.800 29.255 -0.455 1
1 324 . 13 1 1 A 32 32 GLU N N 32 121.600 122.122 -0.522 1
1 325 . 13 1 1 A 33 33 ASN H H 33 7.810 7.584 0.226 1
1 326 . 13 1 1 A 33 33 ASN HA H 33 4.440 4.656 -0.216 1
1 329 . 13 1 1 A 33 33 ASN CA C 33 55.800 55.887 -0.087 1
1 330 . 13 1 1 A 33 33 ASN CB C 33 38.100 38.800 -0.700 1
1 331 . 13 1 1 A 33 33 ASN N N 33 121.000 118.090 2.910 1
1 332 . 13 1 1 A 34 34 VAL H H 34 8.000 8.015 -0.015 1
1 333 . 13 1 1 A 34 34 VAL HA H 34 3.300 3.849 -0.549 1
1 341 . 13 1 1 A 34 34 VAL CA C 34 67.600 66.529 1.071 1
1 342 . 13 1 1 A 34 34 VAL CB C 34 30.700 31.621 -0.921 1
1 345 . 13 1 1 A 34 34 VAL N N 34 122.200 120.381 1.819 1
1 346 . 13 1 1 A 35 35 LYS H H 35 8.490 8.321 0.169 1
1 347 . 13 1 1 A 35 35 LYS HA H 35 4.500 4.054 0.446 1
1 352 . 13 1 1 A 35 35 LYS CA C 35 59.300 58.630 0.670 1
1 353 . 13 1 1 A 35 35 LYS CB C 35 33.500 31.907 1.593 1
1 354 . 13 1 1 A 35 35 LYS N N 35 119.200 120.179 -0.979 1
1 355 . 13 1 1 A 36 36 ALA H H 36 7.880 8.445 -0.565 1
1 356 . 13 1 1 A 36 36 ALA HA H 36 4.060 3.991 0.069 1
1 360 . 13 1 1 A 36 36 ALA CA C 36 55.300 55.487 -0.187 1
1 361 . 13 1 1 A 36 36 ALA CB C 36 17.600 18.416 -0.816 1
1 362 . 13 1 1 A 36 36 ALA N N 36 123.300 122.293 1.007 1
1 363 . 13 1 1 A 37 37 LYS H H 37 7.790 7.825 -0.035 1
1 364 . 13 1 1 A 37 37 LYS HA H 37 4.110 3.913 0.197 1
1 373 . 13 1 1 A 37 37 LYS CA C 37 59.700 59.980 -0.280 1
1 374 . 13 1 1 A 37 37 LYS CB C 37 33.100 32.184 0.916 1
1 378 . 13 1 1 A 37 37 LYS N N 37 120.400 117.317 3.083 1
1 379 . 13 1 1 A 38 38 ILE H H 38 8.240 7.618 0.622 1
1 380 . 13 1 1 A 38 38 ILE HA H 38 3.410 3.989 -0.579 1
1 390 . 13 1 1 A 38 38 ILE CA C 38 66.200 62.219 3.981 1
1 391 . 13 1 1 A 38 38 ILE CB C 38 36.800 37.599 -0.799 1
1 395 . 13 1 1 A 38 38 ILE N N 38 121.400 119.884 1.516 1
1 396 . 13 1 1 A 39 39 GLN H H 39 8.460 8.589 -0.129 1
1 397 . 13 1 1 A 39 39 GLN HA H 39 3.730 3.910 -0.180 1
1 402 . 13 1 1 A 39 39 GLN CA C 39 60.000 59.254 0.746 1
1 403 . 13 1 1 A 39 39 GLN CB C 39 27.600 28.279 -0.679 1
1 405 . 13 1 1 A 39 39 GLN N N 39 123.500 121.960 1.540 1
1 406 . 13 1 1 A 40 40 ASP H H 40 7.970 7.668 0.302 1
1 407 . 13 1 1 A 40 40 ASP HA H 40 4.240 4.345 -0.105 1
1 410 . 13 1 1 A 40 40 ASP CA C 40 57.400 56.616 0.784 1
1 411 . 13 1 1 A 40 40 ASP CB C 40 41.000 40.675 0.325 1
1 412 . 13 1 1 A 40 40 ASP N N 40 119.900 119.080 0.820 1
1 413 . 13 1 1 A 41 41 LYS H H 41 7.420 7.790 -0.370 1
1 414 . 13 1 1 A 41 41 LYS HA H 41 4.200 4.073 0.127 1
1 423 . 13 1 1 A 41 41 LYS CA C 41 58.200 59.361 -1.161 1
1 424 . 13 1 1 A 41 41 LYS CB C 41 33.900 32.703 1.197 1
1 427 . 13 1 1 A 41 41 LYS N N 41 115.700 119.161 -3.461 1
1 428 . 13 1 1 A 42 42 GLU H H 42 8.650 8.168 0.482 1
1 429 . 13 1 1 A 42 42 GLU HA H 42 4.470 4.525 -0.055 1
1 434 . 13 1 1 A 42 42 GLU CA C 42 55.300 55.706 -0.406 1
1 435 . 13 1 1 A 42 42 GLU CB C 42 33.200 31.995 1.205 1
1 437 . 13 1 1 A 42 42 GLU N N 42 114.200 113.633 0.567 1
1 438 . 13 1 1 A 43 43 GLY H H 43 8.400 8.044 0.356 1
1 439 . 13 1 1 A 43 43 GLY HA2 H 43 4.040 3.770 0.270 1
1 440 . 13 1 1 A 43 43 GLY HA3 H 43 3.820 3.819 0.001 1
1 441 . 13 1 1 A 43 43 GLY CA C 43 45.900 45.761 0.139 1
1 442 . 13 1 1 A 43 43 GLY N N 43 109.000 109.829 -0.829 1
1 443 . 13 1 1 A 44 44 ILE H H 44 6.080 7.857 -1.777 1
1 444 . 13 1 1 A 44 44 ILE HA H 44 4.290 4.233 0.057 1
1 446 . 13 1 1 A 44 44 ILE CA C 44 57.700 59.552 -1.852 1
1 447 . 13 1 1 A 44 44 ILE CB C 44 40.400 38.519 1.881 1
1 448 . 13 1 1 A 44 44 ILE N N 44 120.500 122.522 -2.022 1
1 449 . 13 1 1 A 46 46 PRO HA H 46 4.030 4.275 -0.245 1
1 454 . 13 1 1 A 46 46 PRO CA C 46 66.100 65.066 1.034 1
1 455 . 13 1 1 A 46 46 PRO CB C 46 32.600 31.862 0.738 1
1 458 . 13 1 1 A 47 47 ASP H H 47 8.470 8.495 -0.025 1
1 459 . 13 1 1 A 47 47 ASP HA H 47 4.310 4.345 -0.035 1
1 462 . 13 1 1 A 47 47 ASP CA C 47 55.700 56.981 -1.281 1
1 463 . 13 1 1 A 47 47 ASP CB C 47 39.700 40.366 -0.666 1
1 464 . 13 1 1 A 47 47 ASP N N 47 113.700 117.727 -4.027 1
1 465 . 13 1 1 A 48 48 GLN H H 48 7.720 7.423 0.297 1
1 466 . 13 1 1 A 48 48 GLN HA H 48 4.340 4.400 -0.060 1
1 471 . 13 1 1 A 48 48 GLN CA C 48 55.500 55.037 0.463 1
1 472 . 13 1 1 A 48 48 GLN CB C 48 29.900 30.313 -0.413 1
1 474 . 13 1 1 A 48 48 GLN N N 48 116.900 114.886 2.014 1
1 475 . 13 1 1 A 49 49 GLN H H 49 7.410 7.669 -0.259 1
1 476 . 13 1 1 A 49 49 GLN HA H 49 4.110 4.082 0.028 1
1 481 . 13 1 1 A 49 49 GLN CA C 49 56.600 56.396 0.204 1
1 482 . 13 1 1 A 49 49 GLN CB C 49 31.300 29.189 2.111 1
1 484 . 13 1 1 A 49 49 GLN N N 49 118.000 121.940 -3.940 1
1 485 . 13 1 1 A 50 50 ARG H H 50 8.400 8.176 0.224 1
1 486 . 13 1 1 A 50 50 ARG HA H 50 4.380 4.619 -0.239 1
1 491 . 13 1 1 A 50 50 ARG CA C 50 55.100 55.637 -0.537 1
1 492 . 13 1 1 A 50 50 ARG CB C 50 31.600 31.558 0.042 1
1 494 . 13 1 1 A 50 50 ARG N N 50 123.100 123.620 -0.520 1
1 495 . 13 1 1 A 51 51 LEU H H 51 8.710 8.489 0.221 1
1 496 . 13 1 1 A 51 51 LEU HA H 51 5.300 5.118 0.182 1
1 506 . 13 1 1 A 51 51 LEU CA C 51 52.900 53.384 -0.484 1
1 507 . 13 1 1 A 51 51 LEU CB C 51 45.700 45.636 0.064 1
1 511 . 13 1 1 A 51 51 LEU N N 51 124.400 120.648 3.752 1
1 512 . 13 1 1 A 52 52 ILE H H 52 9.060 8.987 0.073 1
1 513 . 13 1 1 A 52 52 ILE HA H 52 4.840 5.030 -0.190 1
1 523 . 13 1 1 A 52 52 ILE CA C 52 58.900 60.022 -1.122 1
1 524 . 13 1 1 A 52 52 ILE CB C 52 41.200 40.977 0.223 1
1 528 . 13 1 1 A 52 52 ILE N N 52 122.500 123.040 -0.540 1
1 529 . 13 1 1 A 53 53 PHE H H 53 8.730 9.504 -0.774 1
1 530 . 13 1 1 A 53 53 PHE HA H 53 5.100 4.894 0.206 1
1 535 . 13 1 1 A 53 53 PHE CA C 53 56.300 57.576 -1.276 1
1 536 . 13 1 1 A 53 53 PHE CB C 53 43.500 42.121 1.379 1
1 537 . 13 1 1 A 53 53 PHE N N 53 124.800 127.555 -2.755 1
1 538 . 13 1 1 A 54 54 ALA H H 54 8.940 9.182 -0.242 1
1 539 . 13 1 1 A 54 54 ALA HA H 54 3.610 3.917 -0.307 1
1 543 . 13 1 1 A 54 54 ALA CA C 54 52.500 53.041 -0.541 1
1 544 . 13 1 1 A 54 54 ALA CB C 54 16.300 17.412 -1.112 1
1 545 . 13 1 1 A 54 54 ALA N N 54 133.100 130.353 2.747 1
1 546 . 13 1 1 A 55 55 GLY H H 55 8.070 8.407 -0.337 1
1 547 . 13 1 1 A 55 55 GLY HA2 H 55 4.000 3.812 0.188 1
1 548 . 13 1 1 A 55 55 GLY HA3 H 55 3.340 3.846 -0.506 1
1 549 . 13 1 1 A 55 55 GLY CA C 55 45.200 45.222 -0.022 1
1 550 . 13 1 1 A 55 55 GLY N N 55 102.500 102.699 -0.199 1
1 551 . 13 1 1 A 56 56 LYS H H 56 7.860 8.023 -0.163 1
1 552 . 13 1 1 A 56 56 LYS HA H 56 4.510 4.601 -0.091 1
1 558 . 13 1 1 A 56 56 LYS CA C 56 54.500 54.794 -0.294 1
1 559 . 13 1 1 A 56 56 LYS CB C 56 34.400 33.918 0.482 1
1 561 . 13 1 1 A 56 56 LYS N N 56 121.800 122.010 -0.210 1
1 562 . 13 1 1 A 57 57 GLN H H 57 8.600 8.567 0.033 1
1 563 . 13 1 1 A 57 57 GLN HA H 57 4.410 4.906 -0.496 1
1 568 . 13 1 1 A 57 57 GLN CA C 57 55.900 55.297 0.603 1
1 569 . 13 1 1 A 57 57 GLN CB C 57 28.800 30.021 -1.221 1
1 571 . 13 1 1 A 57 57 GLN N N 57 123.200 124.695 -1.495 1
1 572 . 13 1 1 A 58 58 LEU H H 58 8.480 7.948 0.532 1
1 573 . 13 1 1 A 58 58 LEU HA H 58 4.060 5.055 -0.995 1
1 583 . 13 1 1 A 58 58 LEU CA C 58 54.100 53.276 0.824 1
1 584 . 13 1 1 A 58 58 LEU CB C 58 41.500 44.495 -2.995 1
1 588 . 13 1 1 A 58 58 LEU N N 58 125.900 122.049 3.851 1
1 589 . 13 1 1 A 59 59 GLU H H 59 8.400 8.607 -0.207 1
1 590 . 13 1 1 A 59 59 GLU HA H 59 4.400 4.480 -0.080 1
1 595 . 13 1 1 A 59 59 GLU CA C 59 55.900 57.836 -1.936 1
1 596 . 13 1 1 A 59 59 GLU CB C 59 31.900 32.315 -0.415 1
1 598 . 13 1 1 A 59 59 GLU N N 59 123.100 120.392 2.708 1
1 599 . 13 1 1 A 60 60 ASP H H 60 8.110 7.758 0.352 1
1 600 . 13 1 1 A 60 60 ASP HA H 60 4.270 4.416 -0.146 1
1 603 . 13 1 1 A 60 60 ASP CA C 60 57.100 54.810 2.290 1
1 604 . 13 1 1 A 60 60 ASP CB C 60 40.800 41.476 -0.676 1
1 605 . 13 1 1 A 60 60 ASP N N 60 120.300 120.000 0.300 1
1 606 . 13 1 1 A 61 61 GLY HA2 H 61 4.000 3.950 0.050 1
1 607 . 13 1 1 A 61 61 GLY HA3 H 61 3.830 4.002 -0.172 1
1 608 . 13 1 1 A 61 61 GLY CA C 61 45.000 46.094 -1.094 1
1 609 . 13 1 1 A 62 62 ARG H H 62 7.350 8.355 -1.005 1
1 610 . 13 1 1 A 62 62 ARG HA H 62 4.640 4.892 -0.252 1
1 615 . 13 1 1 A 62 62 ARG CA C 62 54.400 53.754 0.646 1
1 616 . 13 1 1 A 62 62 ARG CB C 62 32.600 34.335 -1.735 1
1 618 . 13 1 1 A 62 62 ARG N N 62 119.300 122.956 -3.656 1
1 619 . 13 1 1 A 63 63 THR H H 63 8.460 8.788 -0.328 1
1 620 . 13 1 1 A 63 63 THR HA H 63 5.060 4.547 0.513 1
1 625 . 13 1 1 A 63 63 THR CA C 63 59.700 60.871 -1.171 1
1 626 . 13 1 1 A 63 63 THR CB C 63 72.000 71.041 0.959 1
1 628 . 13 1 1 A 63 63 THR N N 63 109.100 112.839 -3.739 1
1 629 . 13 1 1 A 64 64 LEU H H 64 8.190 8.737 -0.547 1
1 630 . 13 1 1 A 64 64 LEU HA H 64 3.920 4.075 -0.155 1
1 640 . 13 1 1 A 64 64 LEU CA C 64 58.400 58.191 0.209 1
1 641 . 13 1 1 A 64 64 LEU CB C 64 40.200 41.686 -1.486 1
1 645 . 13 1 1 A 64 64 LEU N N 64 118.100 123.696 -5.596 1
1 646 . 13 1 1 A 65 65 SER H H 65 8.370 7.895 0.475 1
1 647 . 13 1 1 A 65 65 SER HA H 65 4.150 4.176 -0.026 1
1 650 . 13 1 1 A 65 65 SER CA C 65 60.900 60.460 0.440 1
1 651 . 13 1 1 A 65 65 SER CB C 65 62.500 63.438 -0.938 1
1 652 . 13 1 1 A 65 65 SER N N 65 112.200 114.164 -1.964 1
1 653 . 13 1 1 A 66 66 GLU H H 66 7.780 7.926 -0.146 1
1 654 . 13 1 1 A 66 66 GLU HA H 66 3.890 4.115 -0.225 1
1 659 . 13 1 1 A 66 66 GLU CA C 66 59.200 59.026 0.174 1
1 660 . 13 1 1 A 66 66 GLU CB C 66 29.400 29.323 0.077 1
1 662 . 13 1 1 A 66 66 GLU N N 66 123.600 121.943 1.657 1
1 663 . 13 1 1 A 67 67 TYR H H 67 7.290 7.953 -0.663 1
1 664 . 13 1 1 A 67 67 TYR HA H 67 4.590 4.565 0.025 1
1 669 . 13 1 1 A 67 67 TYR CA C 67 58.400 58.890 -0.490 1
1 670 . 13 1 1 A 67 67 TYR CB C 67 39.800 38.840 0.960 1
1 671 . 13 1 1 A 67 67 TYR N N 67 116.400 119.252 -2.852 1
1 672 . 13 1 1 A 68 68 ASN H H 68 8.040 8.168 -0.128 1
1 673 . 13 1 1 A 68 68 ASN HA H 68 4.240 4.324 -0.084 1
1 676 . 13 1 1 A 68 68 ASN CA C 68 54.100 54.134 -0.034 1
1 677 . 13 1 1 A 68 68 ASN CB C 68 37.200 37.356 -0.156 1
1 678 . 13 1 1 A 68 68 ASN N N 68 115.600 116.527 -0.927 1
1 679 . 13 1 1 A 69 69 ILE H H 69 7.200 7.487 -0.287 1
1 680 . 13 1 1 A 69 69 ILE HA H 69 3.280 4.632 -1.352 1
1 690 . 13 1 1 A 69 69 ILE CA C 69 59.800 59.159 0.641 1
1 691 . 13 1 1 A 69 69 ILE CB C 69 36.600 40.570 -3.970 1
1 695 . 13 1 1 A 69 69 ILE N N 69 119.100 114.576 4.524 1
1 696 . 13 1 1 A 70 70 GLN H H 70 7.570 8.434 -0.864 1
1 697 . 13 1 1 A 70 70 GLN HA H 70 4.410 3.955 0.455 1
1 702 . 13 1 1 A 70 70 GLN CA C 70 53.500 58.136 -4.636 1
1 703 . 13 1 1 A 70 70 GLN CB C 70 31.500 28.583 2.917 1
1 705 . 13 1 1 A 70 70 GLN N N 70 124.800 122.361 2.439 1
1 706 . 13 1 1 A 71 71 LYS H H 71 8.370 7.483 0.887 1
1 707 . 13 1 1 A 71 71 LYS HA H 71 3.870 3.766 0.104 1
1 716 . 13 1 1 A 71 71 LYS CA C 71 58.000 57.305 0.695 1
1 717 . 13 1 1 A 71 71 LYS CB C 71 32.500 31.457 1.043 1
1 720 . 13 1 1 A 71 71 LYS N N 71 120.200 118.694 1.506 1
1 721 . 13 1 1 A 72 72 GLU H H 72 9.230 8.216 1.014 1
1 722 . 13 1 1 A 72 72 GLU HA H 72 3.240 4.615 -1.375 1
1 727 . 13 1 1 A 72 72 GLU CA C 72 58.300 55.754 2.546 1
1 728 . 13 1 1 A 72 72 GLU CB C 72 26.000 30.199 -4.199 1
1 730 . 13 1 1 A 72 72 GLU N N 72 115.100 118.290 -3.190 1
1 731 . 13 1 1 A 73 73 SER H H 73 7.690 8.003 -0.313 1
1 732 . 13 1 1 A 73 73 SER HA H 73 4.520 4.782 -0.262 1
1 735 . 13 1 1 A 73 73 SER CA C 73 61.100 59.037 2.063 1
1 736 . 13 1 1 A 73 73 SER CB C 73 64.800 65.028 -0.228 1
1 737 . 13 1 1 A 73 73 SER N N 73 115.300 115.852 -0.552 1
1 738 . 13 1 1 A 74 74 THR H H 74 8.620 7.926 0.694 1
1 739 . 13 1 1 A 74 74 THR HA H 74 5.200 5.132 0.068 1
1 744 . 13 1 1 A 74 74 THR CA C 74 62.400 61.861 0.539 1
1 745 . 13 1 1 A 74 74 THR CB C 74 70.200 70.836 -0.636 1
1 747 . 13 1 1 A 74 74 THR N N 74 117.500 111.172 6.328 1
1 748 . 13 1 1 A 75 75 LEU H H 75 9.350 8.687 0.663 1
1 749 . 13 1 1 A 75 75 LEU HA H 75 4.990 5.314 -0.324 1
1 759 . 13 1 1 A 75 75 LEU CA C 75 53.800 53.970 -0.170 1
1 760 . 13 1 1 A 75 75 LEU CB C 75 44.400 45.661 -1.261 1
1 764 . 13 1 1 A 75 75 LEU N N 75 128.000 126.932 1.068 1
1 765 . 13 1 1 A 76 76 HIS H H 76 9.140 8.607 0.533 1
1 766 . 13 1 1 A 76 76 HIS HA H 76 5.040 5.339 -0.299 1
1 769 . 13 1 1 A 76 76 HIS CA C 76 56.200 53.974 2.226 1
1 770 . 13 1 1 A 76 76 HIS CB C 76 32.500 33.037 -0.537 1
1 771 . 13 1 1 A 76 76 HIS N N 76 119.600 124.499 -4.899 1
1 772 . 13 1 1 A 77 77 LEU H H 77 8.240 8.929 -0.689 1
1 773 . 13 1 1 A 77 77 LEU HA H 77 5.080 4.860 0.220 1
1 783 . 13 1 1 A 77 77 LEU CA C 77 53.600 53.471 0.129 1
1 784 . 13 1 1 A 77 77 LEU CB C 77 44.100 43.231 0.869 1
1 788 . 13 1 1 A 77 77 LEU N N 77 123.800 123.586 0.214 1
1 789 . 13 1 1 A 78 78 VAL H H 78 9.110 8.392 0.718 1
1 790 . 13 1 1 A 78 78 VAL HA H 78 4.260 4.636 -0.376 1
1 798 . 13 1 1 A 78 78 VAL CA C 78 60.400 61.185 -0.785 1
1 799 . 13 1 1 A 78 78 VAL CB C 78 34.700 35.373 -0.673 1
1 802 . 13 1 1 A 78 78 VAL N N 78 127.100 124.303 2.797 1
1 803 . 13 1 1 A 79 79 LEU H H 79 8.050 8.867 -0.817 1
1 804 . 13 1 1 A 79 79 LEU HA H 79 4.950 4.894 0.056 1
1 813 . 13 1 1 A 79 79 LEU CA C 79 53.800 53.188 0.612 1
1 814 . 13 1 1 A 79 79 LEU CB C 79 42.700 44.305 -1.605 1
1 818 . 13 1 1 A 79 79 LEU N N 79 123.400 129.283 -5.883 1
1 819 . 13 1 1 A 80 80 ARG H H 80 8.540 9.144 -0.604 1
1 820 . 13 1 1 A 80 80 ARG HA H 80 4.170 3.988 0.182 1
1 827 . 13 1 1 A 80 80 ARG CA C 80 55.800 56.831 -1.031 1
1 828 . 13 1 1 A 80 80 ARG CB C 80 31.100 28.690 2.410 1
1 830 . 13 1 1 A 80 80 ARG N N 80 123.500 126.682 -3.182 1
1 831 . 13 1 1 A 81 81 LEU H H 81 8.250 8.098 0.152 1
1 832 . 13 1 1 A 81 81 LEU HA H 81 4.270 4.048 0.222 1
1 842 . 13 1 1 A 81 81 LEU CA C 81 55.000 57.156 -2.156 1
1 843 . 13 1 1 A 81 81 LEU CB C 81 42.200 41.634 0.566 1
1 847 . 13 1 1 A 81 81 LEU N N 81 124.100 122.766 1.334 1
1 848 . 13 1 1 A 82 82 ARG H H 82 8.310 7.643 0.667 1
1 849 . 13 1 1 A 82 82 ARG HA H 82 4.200 4.061 0.139 1
1 852 . 13 1 1 A 82 82 ARG CA C 82 56.300 58.017 -1.717 1
1 853 . 13 1 1 A 82 82 ARG CB C 82 30.700 30.003 0.697 1
1 855 . 13 1 1 A 82 82 ARG N N 82 121.500 121.479 0.021 1
1 856 . 13 1 1 A 83 83 GLY H H 83 8.410 8.257 0.153 1
1 857 . 13 1 1 A 83 83 GLY HA2 H 83 3.750 4.282 -0.532 1
1 858 . 13 1 1 A 83 83 GLY HA3 H 83 3.754 4.359 -0.605 1
1 859 . 13 1 1 A 83 83 GLY CA C 83 45.100 46.239 -1.139 1
1 860 . 13 1 1 A 83 83 GLY N N 83 110.200 113.225 -3.025 1
1 861 . 13 1 1 A 84 84 TYR H H 84 7.950 8.769 -0.819 1
1 862 . 13 1 1 A 84 84 TYR HA H 84 4.400 5.258 -0.858 1
1 865 . 13 1 1 A 84 84 TYR CA C 84 58.100 56.537 1.563 1
1 866 . 13 1 1 A 84 84 TYR CB C 84 38.800 40.633 -1.833 1
1 867 . 13 1 1 A 84 84 TYR N N 84 119.900 119.562 0.338 1
1 868 . 13 1 1 A 85 85 ALA H H 85 8.150 8.799 -0.649 1
1 869 . 13 1 1 A 85 85 ALA HA H 85 4.150 4.642 -0.492 1
1 873 . 13 1 1 A 85 85 ALA CA C 85 52.600 51.350 1.250 1
1 874 . 13 1 1 A 85 85 ALA CB C 85 19.200 22.987 -3.787 1
1 875 . 13 1 1 A 85 85 ALA N N 85 124.800 121.920 2.880 1
1 876 . 13 1 1 A 86 86 ASP H H 86 8.020 8.685 -0.665 1
1 877 . 13 1 1 A 86 86 ASP HA H 86 4.450 5.079 -0.629 1
1 880 . 13 1 1 A 86 86 ASP CA C 86 54.100 53.421 0.679 1
1 881 . 13 1 1 A 86 86 ASP CB C 86 41.100 44.232 -3.132 1
1 882 . 13 1 1 A 86 86 ASP N N 86 118.900 118.129 0.771 1
1 883 . 13 1 1 A 87 87 LEU H H 87 8.010 8.489 -0.479 1
1 884 . 13 1 1 A 87 87 LEU HA H 87 4.210 4.347 -0.137 1
1 893 . 13 1 1 A 87 87 LEU CA C 87 55.300 55.766 -0.466 1
1 894 . 13 1 1 A 87 87 LEU CB C 87 42.000 42.180 -0.180 1
1 898 . 13 1 1 A 87 87 LEU N N 87 122.400 123.538 -1.138 1
1 899 . 13 1 1 A 88 88 ARG H H 88 8.170 8.415 -0.245 1
1 900 . 13 1 1 A 88 88 ARG HA H 88 4.210 4.717 -0.507 1
1 903 . 13 1 1 A 88 88 ARG CA C 88 56.300 55.313 0.987 1
1 904 . 13 1 1 A 88 88 ARG CB C 88 30.600 32.859 -2.259 1
1 905 . 13 1 1 A 88 88 ARG N N 88 121.200 121.985 -0.785 1
1 906 . 13 1 1 A 91 91 PRO HA H 91 4.290 4.400 -0.110 1
1 911 . 13 1 1 A 91 91 PRO CA C 91 63.800 63.056 0.744 1
1 912 . 13 1 1 A 91 91 PRO CB C 91 32.100 32.393 -0.293 1
1 915 . 13 1 1 A 92 92 ASP H H 92 8.280 8.999 -0.719 1
1 916 . 13 1 1 A 92 92 ASP HA H 92 4.540 4.220 0.320 1
1 919 . 13 1 1 A 92 92 ASP CA C 92 54.600 55.108 -0.508 1
1 920 . 13 1 1 A 92 92 ASP CB C 92 41.000 39.727 1.273 1
1 921 . 13 1 1 A 92 92 ASP N N 92 118.700 121.695 -2.995 1
1 922 . 13 1 1 A 93 93 ARG H H 93 7.780 7.370 0.410 1
1 923 . 13 1 1 A 93 93 ARG HA H 93 4.190 4.896 -0.706 1
1 930 . 13 1 1 A 93 93 ARG CA C 93 56.300 54.372 1.928 1
1 931 . 13 1 1 A 93 93 ARG CB C 93 30.700 32.810 -2.110 1
1 934 . 13 1 1 A 93 93 ARG N N 93 120.700 113.986 6.714 1
1 935 . 13 1 1 A 94 94 GLN H H 94 8.280 8.418 -0.138 1
1 936 . 13 1 1 A 94 94 GLN HA H 94 4.210 4.443 -0.233 1
1 941 . 13 1 1 A 94 94 GLN CA C 94 55.800 55.388 0.412 1
1 942 . 13 1 1 A 94 94 GLN CB C 94 29.300 29.781 -0.481 1
1 944 . 13 1 1 A 94 94 GLN N N 94 121.000 118.915 2.085 1
1 945 . 13 1 1 A 95 95 ASP H H 95 8.270 8.457 -0.187 1
1 946 . 13 1 1 A 95 95 ASP HA H 95 4.450 4.436 0.014 1
1 949 . 13 1 1 A 95 95 ASP CA C 95 54.300 54.597 -0.297 1
1 950 . 13 1 1 A 95 95 ASP CB C 95 41.000 40.909 0.091 1
1 951 . 13 1 1 A 95 95 ASP N N 95 121.000 121.508 -0.508 1
1 952 . 13 1 1 A 96 96 HIS H H 96 8.090 8.793 -0.703 1
1 953 . 13 1 1 A 96 96 HIS HA H 96 4.470 4.936 -0.466 1
1 956 . 13 1 1 A 96 96 HIS CA C 96 55.900 54.539 1.361 1
1 957 . 13 1 1 A 96 96 HIS CB C 96 30.500 34.989 -4.489 1
1 958 . 13 1 1 A 96 96 HIS N N 96 119.300 119.088 0.212 1
1 959 . 13 1 1 A 97 97 HIS H H 97 8.240 8.781 -0.541 1
1 960 . 13 1 1 A 97 97 HIS HA H 97 4.470 5.188 -0.718 1
1 963 . 13 1 1 A 97 97 HIS CA C 97 56.200 53.194 3.006 1
1 964 . 13 1 1 A 97 97 HIS CB C 97 30.400 30.239 0.161 1
1 965 . 13 1 1 A 97 97 HIS N N 97 121.300 117.332 3.968 1
1 966 . 13 1 1 A 98 98 PRO HA H 98 4.340 4.517 -0.177 1
1 973 . 13 1 1 A 98 98 PRO CA C 98 63.700 62.454 1.246 1
1 974 . 13 1 1 A 98 98 PRO CB C 98 31.900 33.113 -1.213 1
1 977 . 13 1 1 A 99 99 GLY H H 99 8.660 8.367 0.293 1
1 978 . 13 1 1 A 99 99 GLY HA2 H 99 3.920 4.246 -0.326 1
1 979 . 13 1 1 A 99 99 GLY HA3 H 99 3.920 4.247 -0.327 1
1 980 . 13 1 1 A 99 99 GLY CA C 99 45.200 45.699 -0.499 1
1 981 . 13 1 1 A 99 99 GLY N N 99 110.000 106.794 3.206 1
1 982 . 13 1 1 A 100 100 SER H H 100 8.170 8.576 -0.406 1
1 983 . 13 1 1 A 100 100 SER HA H 100 4.360 4.814 -0.454 1
1 986 . 13 1 1 A 100 100 SER CA C 100 58.500 57.659 0.841 1
1 987 . 13 1 1 A 100 100 SER CB C 100 64.000 66.040 -2.040 1
1 988 . 13 1 1 A 100 100 SER N N 100 115.600 113.605 1.995 1
1 989 . 13 1 1 A 101 101 GLY H H 101 8.420 8.346 0.074 1
1 990 . 13 1 1 A 101 101 GLY HA2 H 101 3.890 4.235 -0.345 1
1 991 . 13 1 1 A 101 101 GLY HA3 H 101 3.920 4.236 -0.316 1
1 992 . 13 1 1 A 101 101 GLY CA C 101 45.200 45.838 -0.638 1
1 993 . 13 1 1 A 101 101 GLY N N 101 111.000 107.287 3.713 1
1 994 . 13 1 1 A 102 102 ALA H H 102 8.030 8.472 -0.442 1
1 995 . 13 1 1 A 102 102 ALA HA H 102 4.250 4.760 -0.510 1
1 999 . 13 1 1 A 102 102 ALA CA C 102 52.500 51.215 1.285 1
1 1000 . 13 1 1 A 102 102 ALA CB C 102 19.200 22.933 -3.733 1
1 4 . 14 1 1 A 2 2 SER H H 2 8.160 7.686 0.474 1
1 5 . 14 1 1 A 2 2 SER HA H 2 4.370 4.890 -0.520 1
1 9 . 14 1 1 A 2 2 SER CA C 2 58.300 57.378 0.922 1
1 10 . 14 1 1 A 2 2 SER CB C 2 63.900 65.013 -1.113 1
1 11 . 14 1 1 A 2 2 SER N N 2 115.600 114.314 1.286 1
1 12 . 14 1 1 A 3 3 LEU H H 3 8.250 8.601 -0.351 1
1 13 . 14 1 1 A 3 3 LEU HA H 3 4.280 5.249 -0.969 1
1 17 . 14 1 1 A 3 3 LEU CA C 3 55.200 52.824 2.376 1
1 18 . 14 1 1 A 3 3 LEU CB C 3 42.100 46.147 -4.047 1
1 19 . 14 1 1 A 3 3 LEU N N 3 124.100 120.495 3.605 1
1 20 . 14 1 1 A 4 4 VAL H H 4 7.950 8.802 -0.852 1
1 21 . 14 1 1 A 4 4 VAL HA H 4 4.680 4.864 -0.184 1
1 26 . 14 1 1 A 4 4 VAL CA C 4 59.800 58.083 1.717 1
1 27 . 14 1 1 A 4 4 VAL CB C 4 32.500 33.522 -1.022 1
1 28 . 14 1 1 A 4 4 VAL N N 4 122.600 113.938 8.662 1
1 29 . 14 1 1 A 5 5 PRO CA C 5 63.100 62.637 0.463 1
1 30 . 14 1 1 A 5 5 PRO CB C 5 32.000 31.578 0.422 1
1 32 . 14 1 1 A 6 6 ARG H H 6 8.360 8.598 -0.238 1
1 33 . 14 1 1 A 6 6 ARG HA H 6 4.250 4.988 -0.738 1
1 36 . 14 1 1 A 6 6 ARG CA C 6 56.000 54.637 1.363 1
1 37 . 14 1 1 A 6 6 ARG CB C 6 30.900 33.584 -2.684 1
1 38 . 14 1 1 A 6 6 ARG N N 6 121.800 118.055 3.745 1
1 39 . 14 1 1 A 7 7 GLY H H 7 8.460 8.461 -0.001 1
1 40 . 14 1 1 A 7 7 GLY HA2 H 7 3.940 4.191 -0.251 1
1 41 . 14 1 1 A 7 7 GLY HA3 H 7 3.760 4.192 -0.432 1
1 42 . 14 1 1 A 7 7 GLY CA C 7 45.000 45.710 -0.710 1
1 43 . 14 1 1 A 7 7 GLY N N 7 110.700 107.919 2.781 1
1 44 . 14 1 1 A 8 8 SER H H 8 7.990 8.873 -0.883 1
1 45 . 14 1 1 A 8 8 SER HA H 8 4.450 4.420 0.030 1
1 48 . 14 1 1 A 8 8 SER CA C 8 58.900 61.602 -2.702 1
1 49 . 14 1 1 A 8 8 SER CB C 8 64.200 63.403 0.797 1
1 50 . 14 1 1 A 8 8 SER N N 8 115.500 117.450 -1.950 1
1 51 . 14 1 1 A 9 9 MET H H 9 9.040 7.803 1.237 1
1 52 . 14 1 1 A 9 9 MET HA H 9 4.610 5.015 -0.405 1
1 60 . 14 1 1 A 9 9 MET CA C 9 54.400 53.679 0.721 1
1 61 . 14 1 1 A 9 9 MET CB C 9 35.400 33.511 1.889 1
1 64 . 14 1 1 A 9 9 MET N N 9 120.500 119.254 1.246 1
1 65 . 14 1 1 A 10 10 GLN H H 10 8.270 8.926 -0.656 1
1 66 . 14 1 1 A 10 10 GLN HA H 10 5.270 5.234 0.036 1
1 71 . 14 1 1 A 10 10 GLN CA C 10 54.200 54.339 -0.139 1
1 72 . 14 1 1 A 10 10 GLN CB C 10 30.500 32.277 -1.777 1
1 74 . 14 1 1 A 10 10 GLN N N 10 121.000 122.049 -1.049 1
1 75 . 14 1 1 A 11 11 ILE H H 11 8.270 8.739 -0.469 1
1 76 . 14 1 1 A 11 11 ILE HA H 11 4.100 4.776 -0.676 1
1 86 . 14 1 1 A 11 11 ILE CA C 11 59.400 59.132 0.268 1
1 87 . 14 1 1 A 11 11 ILE CB C 11 41.800 40.849 0.951 1
1 91 . 14 1 1 A 11 11 ILE N N 11 114.600 121.326 -6.726 1
1 92 . 14 1 1 A 12 12 PHE H H 12 8.520 8.849 -0.329 1
1 93 . 14 1 1 A 12 12 PHE HA H 12 5.540 5.363 0.177 1
1 96 . 14 1 1 A 12 12 PHE CA C 12 55.000 56.450 -1.450 1
1 97 . 14 1 1 A 12 12 PHE CB C 12 41.200 41.035 0.165 1
1 98 . 14 1 1 A 12 12 PHE N N 12 118.600 123.562 -4.962 1
1 99 . 14 1 1 A 13 13 VAL H H 13 9.230 9.105 0.125 1
1 100 . 14 1 1 A 13 13 VAL HA H 13 4.740 5.006 -0.266 1
1 108 . 14 1 1 A 13 13 VAL CA C 13 60.300 60.544 -0.244 1
1 109 . 14 1 1 A 13 13 VAL CB C 13 34.100 35.382 -1.282 1
1 112 . 14 1 1 A 13 13 VAL N N 13 121.400 124.816 -3.416 1
1 113 . 14 1 1 A 14 14 LYS H H 14 8.910 8.900 0.010 1
1 114 . 14 1 1 A 14 14 LYS HA H 14 5.190 4.817 0.373 1
1 122 . 14 1 1 A 14 14 LYS CA C 14 54.600 54.900 -0.300 1
1 123 . 14 1 1 A 14 14 LYS CB C 14 34.300 34.516 -0.216 1
1 126 . 14 1 1 A 14 14 LYS N N 14 128.000 126.796 1.204 1
1 127 . 14 1 1 A 15 15 THR H H 15 8.650 9.045 -0.395 1
1 128 . 14 1 1 A 15 15 THR HA H 15 4.870 4.525 0.345 1
1 133 . 14 1 1 A 15 15 THR CA C 15 60.300 60.877 -0.577 1
1 134 . 14 1 1 A 15 15 THR CB C 15 70.600 71.141 -0.541 1
1 136 . 14 1 1 A 15 15 THR N N 15 115.300 117.854 -2.554 1
1 137 . 14 1 1 A 16 16 LEU H H 16 9.070 8.850 0.220 1
1 138 . 14 1 1 A 16 16 LEU HA H 16 4.210 4.000 0.210 1
1 148 . 14 1 1 A 16 16 LEU CA C 16 57.400 57.766 -0.366 1
1 149 . 14 1 1 A 16 16 LEU CB C 16 41.800 41.540 0.260 1
1 153 . 14 1 1 A 16 16 LEU N N 16 121.400 122.439 -1.039 1
1 154 . 14 1 1 A 17 17 THR H H 17 7.560 7.803 -0.243 1
1 155 . 14 1 1 A 17 17 THR HA H 17 4.330 4.293 0.037 1
1 160 . 14 1 1 A 17 17 THR CA C 17 61.400 63.562 -2.162 1
1 161 . 14 1 1 A 17 17 THR CB C 17 68.900 69.444 -0.544 1
1 163 . 14 1 1 A 17 17 THR N N 17 105.900 112.215 -6.315 1
1 164 . 14 1 1 A 18 18 GLY H H 18 7.750 7.740 0.010 1
1 165 . 14 1 1 A 18 18 GLY HA2 H 18 4.250 4.027 0.223 1
1 166 . 14 1 1 A 18 18 GLY HA3 H 18 3.520 4.042 -0.522 1
1 167 . 14 1 1 A 18 18 GLY CA C 18 45.300 45.150 0.150 1
1 168 . 14 1 1 A 18 18 GLY N N 18 109.300 109.244 0.056 1
1 169 . 14 1 1 A 19 19 LYS H H 19 7.210 7.650 -0.440 1
1 170 . 14 1 1 A 19 19 LYS HA H 19 4.260 4.308 -0.048 1
1 175 . 14 1 1 A 19 19 LYS CA C 19 56.300 56.840 -0.540 1
1 176 . 14 1 1 A 19 19 LYS CB C 19 33.200 33.883 -0.683 1
1 179 . 14 1 1 A 19 19 LYS N N 19 122.000 120.538 1.462 1
1 180 . 14 1 1 A 20 20 THR H H 20 8.570 8.612 -0.042 1
1 181 . 14 1 1 A 20 20 THR HA H 20 4.950 5.345 -0.395 1
1 186 . 14 1 1 A 20 20 THR CA C 20 62.200 62.044 0.156 1
1 187 . 14 1 1 A 20 20 THR CB C 20 69.700 70.593 -0.893 1
1 189 . 14 1 1 A 20 20 THR N N 20 120.700 116.937 3.763 1
1 190 . 14 1 1 A 21 21 ILE H H 21 9.510 9.026 0.484 1
1 191 . 14 1 1 A 21 21 ILE HA H 21 4.390 4.859 -0.469 1
1 201 . 14 1 1 A 21 21 ILE CA C 21 60.000 59.035 0.965 1
1 202 . 14 1 1 A 21 21 ILE CB C 21 40.700 41.373 -0.673 1
1 206 . 14 1 1 A 21 21 ILE N N 21 128.200 122.573 5.627 1
1 207 . 14 1 1 A 22 22 THR H H 22 8.700 8.703 -0.003 1
1 208 . 14 1 1 A 22 22 THR HA H 22 4.860 4.450 0.410 1
1 213 . 14 1 1 A 22 22 THR CA C 22 62.100 62.941 -0.841 1
1 214 . 14 1 1 A 22 22 THR CB C 22 69.500 68.787 0.713 1
1 216 . 14 1 1 A 22 22 THR N N 22 122.300 121.275 1.025 1
1 217 . 14 1 1 A 23 23 LEU H H 23 8.720 8.866 -0.146 1
1 218 . 14 1 1 A 23 23 LEU HA H 23 4.690 4.986 -0.296 1
1 228 . 14 1 1 A 23 23 LEU CA C 23 52.700 53.638 -0.938 1
1 229 . 14 1 1 A 23 23 LEU CB C 23 46.600 45.312 1.288 1
1 233 . 14 1 1 A 23 23 LEU N N 23 125.400 127.595 -2.195 1
1 234 . 14 1 1 A 24 24 GLU H H 24 8.080 8.485 -0.405 1
1 235 . 14 1 1 A 24 24 GLU HA H 24 4.800 4.889 -0.089 1
1 238 . 14 1 1 A 24 24 GLU CA C 24 55.400 55.612 -0.212 1
1 239 . 14 1 1 A 24 24 GLU CB C 24 30.100 31.063 -0.963 1
1 241 . 14 1 1 A 24 24 GLU N N 24 121.800 119.656 2.144 1
1 242 . 14 1 1 A 25 25 VAL H H 25 8.800 8.816 -0.016 1
1 243 . 14 1 1 A 25 25 VAL HA H 25 4.640 4.990 -0.350 1
1 251 . 14 1 1 A 25 25 VAL CA C 25 58.600 59.458 -0.858 1
1 252 . 14 1 1 A 25 25 VAL CB C 25 36.300 36.383 -0.083 1
1 255 . 14 1 1 A 25 25 VAL N N 25 116.700 117.696 -0.996 1
1 256 . 14 1 1 A 26 26 GLU H H 26 8.500 8.480 0.020 1
1 257 . 14 1 1 A 26 26 GLU HA H 26 4.900 4.615 0.285 1
1 260 . 14 1 1 A 26 26 GLU CA C 26 53.000 53.943 -0.943 1
1 261 . 14 1 1 A 26 26 GLU CB C 26 31.200 33.633 -2.433 1
1 262 . 14 1 1 A 26 26 GLU N N 26 117.900 121.054 -3.154 1
1 263 . 14 1 1 A 27 27 PRO HA H 27 4.040 4.390 -0.350 1
1 270 . 14 1 1 A 27 27 PRO CA C 27 65.400 64.835 0.565 1
1 271 . 14 1 1 A 27 27 PRO CB C 27 31.700 32.019 -0.319 1
1 274 . 14 1 1 A 28 28 SER H H 28 7.010 8.203 -1.193 1
1 275 . 14 1 1 A 28 28 SER HA H 28 4.280 4.640 -0.360 1
1 278 . 14 1 1 A 28 28 SER CA C 28 57.400 58.753 -1.353 1
1 279 . 14 1 1 A 28 28 SER CB C 28 63.400 64.225 -0.825 1
1 280 . 14 1 1 A 28 28 SER N N 28 103.800 110.851 -7.051 1
1 281 . 14 1 1 A 29 29 ASP H H 29 7.960 7.757 0.203 1
1 282 . 14 1 1 A 29 29 ASP HA H 29 4.600 4.856 -0.256 1
1 285 . 14 1 1 A 29 29 ASP CA C 29 55.900 52.988 2.912 1
1 286 . 14 1 1 A 29 29 ASP CB C 29 41.000 41.662 -0.662 1
1 287 . 14 1 1 A 29 29 ASP N N 29 123.700 122.043 1.657 1
1 288 . 14 1 1 A 30 30 THR H H 30 7.780 8.657 -0.877 1
1 289 . 14 1 1 A 30 30 THR HA H 30 4.850 4.609 0.241 1
1 294 . 14 1 1 A 30 30 THR CA C 30 59.400 61.301 -1.901 1
1 295 . 14 1 1 A 30 30 THR CB C 30 71.100 70.355 0.745 1
1 297 . 14 1 1 A 30 30 THR N N 30 108.800 121.447 -12.647 1
1 298 . 14 1 1 A 31 31 ILE H H 31 8.320 8.909 -0.589 1
1 299 . 14 1 1 A 31 31 ILE HA H 31 3.580 3.728 -0.148 1
1 309 . 14 1 1 A 31 31 ILE CA C 31 62.200 64.684 -2.484 1
1 310 . 14 1 1 A 31 31 ILE CB C 31 34.300 37.602 -3.302 1
1 314 . 14 1 1 A 31 31 ILE N N 31 121.300 123.953 -2.653 1
1 315 . 14 1 1 A 32 32 GLU H H 32 9.850 8.342 1.508 1
1 316 . 14 1 1 A 32 32 GLU HA H 32 3.780 3.939 -0.159 1
1 321 . 14 1 1 A 32 32 GLU CA C 32 60.500 60.011 0.489 1
1 322 . 14 1 1 A 32 32 GLU CB C 32 28.800 29.421 -0.621 1
1 324 . 14 1 1 A 32 32 GLU N N 32 121.600 122.395 -0.795 1
1 325 . 14 1 1 A 33 33 ASN H H 33 7.810 7.614 0.196 1
1 326 . 14 1 1 A 33 33 ASN HA H 33 4.440 4.471 -0.031 1
1 329 . 14 1 1 A 33 33 ASN CA C 33 55.800 55.872 -0.072 1
1 330 . 14 1 1 A 33 33 ASN CB C 33 38.100 38.185 -0.085 1
1 331 . 14 1 1 A 33 33 ASN N N 33 121.000 118.864 2.136 1
1 332 . 14 1 1 A 34 34 VAL H H 34 8.000 7.812 0.188 1
1 333 . 14 1 1 A 34 34 VAL HA H 34 3.300 3.498 -0.198 1
1 341 . 14 1 1 A 34 34 VAL CA C 34 67.600 67.152 0.448 1
1 342 . 14 1 1 A 34 34 VAL CB C 34 30.700 31.412 -0.712 1
1 345 . 14 1 1 A 34 34 VAL N N 34 122.200 120.002 2.198 1
1 346 . 14 1 1 A 35 35 LYS H H 35 8.490 8.432 0.058 1
1 347 . 14 1 1 A 35 35 LYS HA H 35 4.500 4.060 0.440 1
1 352 . 14 1 1 A 35 35 LYS CA C 35 59.300 58.615 0.685 1
1 353 . 14 1 1 A 35 35 LYS CB C 35 33.500 31.981 1.519 1
1 354 . 14 1 1 A 35 35 LYS N N 35 119.200 120.342 -1.142 1
1 355 . 14 1 1 A 36 36 ALA H H 36 7.880 7.941 -0.061 1
1 356 . 14 1 1 A 36 36 ALA HA H 36 4.060 4.093 -0.033 1
1 360 . 14 1 1 A 36 36 ALA CA C 36 55.300 54.731 0.569 1
1 361 . 14 1 1 A 36 36 ALA CB C 36 17.600 18.220 -0.620 1
1 362 . 14 1 1 A 36 36 ALA N N 36 123.300 121.778 1.522 1
1 363 . 14 1 1 A 37 37 LYS H H 37 7.790 7.810 -0.020 1
1 364 . 14 1 1 A 37 37 LYS HA H 37 4.110 4.099 0.011 1
1 373 . 14 1 1 A 37 37 LYS CA C 37 59.700 59.460 0.240 1
1 374 . 14 1 1 A 37 37 LYS CB C 37 33.100 32.353 0.747 1
1 378 . 14 1 1 A 37 37 LYS N N 37 120.400 117.120 3.280 1
1 379 . 14 1 1 A 38 38 ILE H H 38 8.240 8.221 0.019 1
1 380 . 14 1 1 A 38 38 ILE HA H 38 3.410 3.907 -0.497 1
1 390 . 14 1 1 A 38 38 ILE CA C 38 66.200 62.495 3.705 1
1 391 . 14 1 1 A 38 38 ILE CB C 38 36.800 37.720 -0.920 1
1 395 . 14 1 1 A 38 38 ILE N N 38 121.400 119.952 1.448 1
1 396 . 14 1 1 A 39 39 GLN H H 39 8.460 8.020 0.440 1
1 397 . 14 1 1 A 39 39 GLN HA H 39 3.730 3.981 -0.251 1
1 402 . 14 1 1 A 39 39 GLN CA C 39 60.000 58.621 1.379 1
1 403 . 14 1 1 A 39 39 GLN CB C 39 27.600 28.503 -0.903 1
1 405 . 14 1 1 A 39 39 GLN N N 39 123.500 121.172 2.328 1
1 406 . 14 1 1 A 40 40 ASP H H 40 7.970 7.993 -0.023 1
1 407 . 14 1 1 A 40 40 ASP HA H 40 4.240 4.376 -0.136 1
1 410 . 14 1 1 A 40 40 ASP CA C 40 57.400 56.750 0.650 1
1 411 . 14 1 1 A 40 40 ASP CB C 40 41.000 40.674 0.326 1
1 412 . 14 1 1 A 40 40 ASP N N 40 119.900 119.333 0.567 1
1 413 . 14 1 1 A 41 41 LYS H H 41 7.420 7.616 -0.196 1
1 414 . 14 1 1 A 41 41 LYS HA H 41 4.200 4.140 0.060 1
1 423 . 14 1 1 A 41 41 LYS CA C 41 58.200 59.200 -1.000 1
1 424 . 14 1 1 A 41 41 LYS CB C 41 33.900 32.654 1.246 1
1 427 . 14 1 1 A 41 41 LYS N N 41 115.700 119.035 -3.335 1
1 428 . 14 1 1 A 42 42 GLU H H 42 8.650 7.541 1.109 1
1 429 . 14 1 1 A 42 42 GLU HA H 42 4.470 4.521 -0.051 1
1 434 . 14 1 1 A 42 42 GLU CA C 42 55.300 55.621 -0.321 1
1 435 . 14 1 1 A 42 42 GLU CB C 42 33.200 32.015 1.185 1
1 437 . 14 1 1 A 42 42 GLU N N 42 114.200 113.657 0.543 1
1 438 . 14 1 1 A 43 43 GLY H H 43 8.400 7.729 0.671 1
1 439 . 14 1 1 A 43 43 GLY HA2 H 43 4.040 3.926 0.114 1
1 440 . 14 1 1 A 43 43 GLY HA3 H 43 3.820 3.927 -0.107 1
1 441 . 14 1 1 A 43 43 GLY CA C 43 45.900 46.509 -0.609 1
1 442 . 14 1 1 A 43 43 GLY N N 43 109.000 109.890 -0.890 1
1 443 . 14 1 1 A 44 44 ILE H H 44 6.080 8.067 -1.987 1
1 444 . 14 1 1 A 44 44 ILE HA H 44 4.290 4.494 -0.204 1
1 446 . 14 1 1 A 44 44 ILE CA C 44 57.700 59.144 -1.444 1
1 447 . 14 1 1 A 44 44 ILE CB C 44 40.400 38.078 2.322 1
1 448 . 14 1 1 A 44 44 ILE N N 44 120.500 121.063 -0.563 1
1 449 . 14 1 1 A 46 46 PRO HA H 46 4.030 4.308 -0.278 1
1 454 . 14 1 1 A 46 46 PRO CA C 46 66.100 65.107 0.993 1
1 455 . 14 1 1 A 46 46 PRO CB C 46 32.600 32.009 0.591 1
1 458 . 14 1 1 A 47 47 ASP H H 47 8.470 8.423 0.047 1
1 459 . 14 1 1 A 47 47 ASP HA H 47 4.310 4.450 -0.140 1
1 462 . 14 1 1 A 47 47 ASP CA C 47 55.700 55.619 0.081 1
1 463 . 14 1 1 A 47 47 ASP CB C 47 39.700 40.591 -0.891 1
1 464 . 14 1 1 A 47 47 ASP N N 47 113.700 116.789 -3.089 1
1 465 . 14 1 1 A 48 48 GLN H H 48 7.720 7.283 0.437 1
1 466 . 14 1 1 A 48 48 GLN HA H 48 4.340 4.395 -0.055 1
1 471 . 14 1 1 A 48 48 GLN CA C 48 55.500 55.858 -0.358 1
1 472 . 14 1 1 A 48 48 GLN CB C 48 29.900 30.654 -0.754 1
1 474 . 14 1 1 A 48 48 GLN N N 48 116.900 117.219 -0.319 1
1 475 . 14 1 1 A 49 49 GLN H H 49 7.410 7.710 -0.300 1
1 476 . 14 1 1 A 49 49 GLN HA H 49 4.110 4.356 -0.246 1
1 481 . 14 1 1 A 49 49 GLN CA C 49 56.600 55.973 0.627 1
1 482 . 14 1 1 A 49 49 GLN CB C 49 31.300 29.034 2.266 1
1 484 . 14 1 1 A 49 49 GLN N N 49 118.000 118.643 -0.643 1
1 485 . 14 1 1 A 50 50 ARG H H 50 8.400 8.929 -0.529 1
1 486 . 14 1 1 A 50 50 ARG HA H 50 4.380 4.963 -0.583 1
1 491 . 14 1 1 A 50 50 ARG CA C 50 55.100 54.691 0.409 1
1 492 . 14 1 1 A 50 50 ARG CB C 50 31.600 33.531 -1.931 1
1 494 . 14 1 1 A 50 50 ARG N N 50 123.100 120.015 3.085 1
1 495 . 14 1 1 A 51 51 LEU H H 51 8.710 8.589 0.121 1
1 496 . 14 1 1 A 51 51 LEU HA H 51 5.300 5.028 0.272 1
1 506 . 14 1 1 A 51 51 LEU CA C 51 52.900 53.500 -0.600 1
1 507 . 14 1 1 A 51 51 LEU CB C 51 45.700 43.191 2.509 1
1 511 . 14 1 1 A 51 51 LEU N N 51 124.400 124.055 0.345 1
1 512 . 14 1 1 A 52 52 ILE H H 52 9.060 8.458 0.602 1
1 513 . 14 1 1 A 52 52 ILE HA H 52 4.840 4.982 -0.142 1
1 523 . 14 1 1 A 52 52 ILE CA C 52 58.900 60.069 -1.169 1
1 524 . 14 1 1 A 52 52 ILE CB C 52 41.200 40.342 0.858 1
1 528 . 14 1 1 A 52 52 ILE N N 52 122.500 124.273 -1.773 1
1 529 . 14 1 1 A 53 53 PHE H H 53 8.730 9.400 -0.670 1
1 530 . 14 1 1 A 53 53 PHE HA H 53 5.100 4.778 0.322 1
1 535 . 14 1 1 A 53 53 PHE CA C 53 56.300 57.567 -1.267 1
1 536 . 14 1 1 A 53 53 PHE CB C 53 43.500 41.219 2.281 1
1 537 . 14 1 1 A 53 53 PHE N N 53 124.800 127.906 -3.106 1
1 538 . 14 1 1 A 54 54 ALA H H 54 8.940 9.207 -0.267 1
1 539 . 14 1 1 A 54 54 ALA HA H 54 3.610 3.923 -0.313 1
1 543 . 14 1 1 A 54 54 ALA CA C 54 52.500 53.054 -0.554 1
1 544 . 14 1 1 A 54 54 ALA CB C 54 16.300 17.399 -1.099 1
1 545 . 14 1 1 A 54 54 ALA N N 54 133.100 130.188 2.912 1
1 546 . 14 1 1 A 55 55 GLY H H 55 8.070 8.455 -0.385 1
1 547 . 14 1 1 A 55 55 GLY HA2 H 55 4.000 3.811 0.189 1
1 548 . 14 1 1 A 55 55 GLY HA3 H 55 3.340 3.852 -0.512 1
1 549 . 14 1 1 A 55 55 GLY CA C 55 45.200 45.237 -0.037 1
1 550 . 14 1 1 A 55 55 GLY N N 55 102.500 102.700 -0.200 1
1 551 . 14 1 1 A 56 56 LYS H H 56 7.860 7.904 -0.044 1
1 552 . 14 1 1 A 56 56 LYS HA H 56 4.510 4.568 -0.058 1
1 558 . 14 1 1 A 56 56 LYS CA C 56 54.500 54.678 -0.178 1
1 559 . 14 1 1 A 56 56 LYS CB C 56 34.400 33.887 0.513 1
1 561 . 14 1 1 A 56 56 LYS N N 56 121.800 121.908 -0.108 1
1 562 . 14 1 1 A 57 57 GLN H H 57 8.600 8.800 -0.200 1
1 563 . 14 1 1 A 57 57 GLN HA H 57 4.410 4.889 -0.479 1
1 568 . 14 1 1 A 57 57 GLN CA C 57 55.900 56.406 -0.506 1
1 569 . 14 1 1 A 57 57 GLN CB C 57 28.800 29.567 -0.767 1
1 571 . 14 1 1 A 57 57 GLN N N 57 123.200 128.326 -5.126 1
1 572 . 14 1 1 A 58 58 LEU H H 58 8.480 8.761 -0.281 1
1 573 . 14 1 1 A 58 58 LEU HA H 58 4.060 5.243 -1.183 1
1 583 . 14 1 1 A 58 58 LEU CA C 58 54.100 52.549 1.551 1
1 584 . 14 1 1 A 58 58 LEU CB C 58 41.500 45.914 -4.414 1
1 588 . 14 1 1 A 58 58 LEU N N 58 125.900 121.530 4.370 1
1 589 . 14 1 1 A 59 59 GLU H H 59 8.400 8.312 0.088 1
1 590 . 14 1 1 A 59 59 GLU HA H 59 4.400 4.851 -0.451 1
1 595 . 14 1 1 A 59 59 GLU CA C 59 55.900 54.803 1.097 1
1 596 . 14 1 1 A 59 59 GLU CB C 59 31.900 32.708 -0.808 1
1 598 . 14 1 1 A 59 59 GLU N N 59 123.100 117.978 5.122 1
1 599 . 14 1 1 A 60 60 ASP H H 60 8.110 8.571 -0.461 1
1 600 . 14 1 1 A 60 60 ASP HA H 60 4.270 5.108 -0.838 1
1 603 . 14 1 1 A 60 60 ASP CA C 60 57.100 52.697 4.403 1
1 604 . 14 1 1 A 60 60 ASP CB C 60 40.800 43.861 -3.061 1
1 605 . 14 1 1 A 60 60 ASP N N 60 120.300 120.429 -0.129 1
1 606 . 14 1 1 A 61 61 GLY HA2 H 61 4.000 4.013 -0.013 1
1 607 . 14 1 1 A 61 61 GLY HA3 H 61 3.830 4.055 -0.225 1
1 608 . 14 1 1 A 61 61 GLY CA C 61 45.000 45.705 -0.705 1
1 609 . 14 1 1 A 62 62 ARG H H 62 7.350 8.110 -0.760 1
1 610 . 14 1 1 A 62 62 ARG HA H 62 4.640 4.642 -0.002 1
1 615 . 14 1 1 A 62 62 ARG CA C 62 54.400 55.366 -0.966 1
1 616 . 14 1 1 A 62 62 ARG CB C 62 32.600 31.998 0.602 1
1 618 . 14 1 1 A 62 62 ARG N N 62 119.300 120.808 -1.508 1
1 619 . 14 1 1 A 63 63 THR H H 63 8.460 8.706 -0.246 1
1 620 . 14 1 1 A 63 63 THR HA H 63 5.060 4.683 0.377 1
1 625 . 14 1 1 A 63 63 THR CA C 63 59.700 60.797 -1.097 1
1 626 . 14 1 1 A 63 63 THR CB C 63 72.000 71.121 0.879 1
1 628 . 14 1 1 A 63 63 THR N N 63 109.100 112.698 -3.598 1
1 629 . 14 1 1 A 64 64 LEU H H 64 8.190 8.890 -0.700 1
1 630 . 14 1 1 A 64 64 LEU HA H 64 3.920 3.975 -0.055 1
1 640 . 14 1 1 A 64 64 LEU CA C 64 58.400 57.916 0.484 1
1 641 . 14 1 1 A 64 64 LEU CB C 64 40.200 41.326 -1.126 1
1 645 . 14 1 1 A 64 64 LEU N N 64 118.100 123.491 -5.391 1
1 646 . 14 1 1 A 65 65 SER H H 65 8.370 8.119 0.251 1
1 647 . 14 1 1 A 65 65 SER HA H 65 4.150 4.177 -0.027 1
1 650 . 14 1 1 A 65 65 SER CA C 65 60.900 60.225 0.675 1
1 651 . 14 1 1 A 65 65 SER CB C 65 62.500 63.627 -1.127 1
1 652 . 14 1 1 A 65 65 SER N N 65 112.200 114.263 -2.063 1
1 653 . 14 1 1 A 66 66 GLU H H 66 7.780 7.709 0.071 1
1 654 . 14 1 1 A 66 66 GLU HA H 66 3.890 4.168 -0.278 1
1 659 . 14 1 1 A 66 66 GLU CA C 66 59.200 58.672 0.528 1
1 660 . 14 1 1 A 66 66 GLU CB C 66 29.400 29.677 -0.277 1
1 662 . 14 1 1 A 66 66 GLU N N 66 123.600 121.786 1.814 1
1 663 . 14 1 1 A 67 67 TYR H H 67 7.290 7.895 -0.605 1
1 664 . 14 1 1 A 67 67 TYR HA H 67 4.590 4.591 -0.001 1
1 669 . 14 1 1 A 67 67 TYR CA C 67 58.400 58.539 -0.139 1
1 670 . 14 1 1 A 67 67 TYR CB C 67 39.800 38.489 1.311 1
1 671 . 14 1 1 A 67 67 TYR N N 67 116.400 118.923 -2.523 1
1 672 . 14 1 1 A 68 68 ASN H H 68 8.040 8.062 -0.022 1
1 673 . 14 1 1 A 68 68 ASN HA H 68 4.240 4.270 -0.030 1
1 676 . 14 1 1 A 68 68 ASN CA C 68 54.100 54.618 -0.518 1
1 677 . 14 1 1 A 68 68 ASN CB C 68 37.200 36.930 0.270 1
1 678 . 14 1 1 A 68 68 ASN N N 68 115.600 116.094 -0.494 1
1 679 . 14 1 1 A 69 69 ILE H H 69 7.200 7.390 -0.190 1
1 680 . 14 1 1 A 69 69 ILE HA H 69 3.280 4.642 -1.362 1
1 690 . 14 1 1 A 69 69 ILE CA C 69 59.800 58.958 0.842 1
1 691 . 14 1 1 A 69 69 ILE CB C 69 36.600 39.921 -3.321 1
1 695 . 14 1 1 A 69 69 ILE N N 69 119.100 114.380 4.720 1
1 696 . 14 1 1 A 70 70 GLN H H 70 7.570 8.533 -0.963 1
1 697 . 14 1 1 A 70 70 GLN HA H 70 4.410 4.475 -0.065 1
1 702 . 14 1 1 A 70 70 GLN CA C 70 53.500 55.154 -1.654 1
1 703 . 14 1 1 A 70 70 GLN CB C 70 31.500 29.075 2.425 1
1 705 . 14 1 1 A 70 70 GLN N N 70 124.800 120.332 4.468 1
1 706 . 14 1 1 A 71 71 LYS H H 71 8.370 7.464 0.906 1
1 707 . 14 1 1 A 71 71 LYS HA H 71 3.870 3.731 0.139 1
1 716 . 14 1 1 A 71 71 LYS CA C 71 58.000 58.180 -0.180 1
1 717 . 14 1 1 A 71 71 LYS CB C 71 32.500 32.137 0.363 1
1 720 . 14 1 1 A 71 71 LYS N N 71 120.200 120.996 -0.796 1
1 721 . 14 1 1 A 72 72 GLU H H 72 9.230 8.248 0.982 1
1 722 . 14 1 1 A 72 72 GLU HA H 72 3.240 4.237 -0.997 1
1 727 . 14 1 1 A 72 72 GLU CA C 72 58.300 56.627 1.673 1
1 728 . 14 1 1 A 72 72 GLU CB C 72 26.000 29.396 -3.396 1
1 730 . 14 1 1 A 72 72 GLU N N 72 115.100 116.136 -1.036 1
1 731 . 14 1 1 A 73 73 SER H H 73 7.690 8.050 -0.360 1
1 732 . 14 1 1 A 73 73 SER HA H 73 4.520 4.782 -0.262 1
1 735 . 14 1 1 A 73 73 SER CA C 73 61.100 59.342 1.758 1
1 736 . 14 1 1 A 73 73 SER CB C 73 64.800 64.418 0.382 1
1 737 . 14 1 1 A 73 73 SER N N 73 115.300 113.444 1.856 1
1 738 . 14 1 1 A 74 74 THR H H 74 8.620 7.945 0.675 1
1 739 . 14 1 1 A 74 74 THR HA H 74 5.200 5.118 0.082 1
1 744 . 14 1 1 A 74 74 THR CA C 74 62.400 61.810 0.590 1
1 745 . 14 1 1 A 74 74 THR CB C 74 70.200 70.829 -0.629 1
1 747 . 14 1 1 A 74 74 THR N N 74 117.500 112.404 5.096 1
1 748 . 14 1 1 A 75 75 LEU H H 75 9.350 9.168 0.182 1
1 749 . 14 1 1 A 75 75 LEU HA H 75 4.990 5.164 -0.174 1
1 759 . 14 1 1 A 75 75 LEU CA C 75 53.800 53.723 0.077 1
1 760 . 14 1 1 A 75 75 LEU CB C 75 44.400 46.387 -1.987 1
1 764 . 14 1 1 A 75 75 LEU N N 75 128.000 126.928 1.072 1
1 765 . 14 1 1 A 76 76 HIS H H 76 9.140 8.720 0.420 1
1 766 . 14 1 1 A 76 76 HIS HA H 76 5.040 5.247 -0.207 1
1 769 . 14 1 1 A 76 76 HIS CA C 76 56.200 54.337 1.863 1
1 770 . 14 1 1 A 76 76 HIS CB C 76 32.500 32.837 -0.337 1
1 771 . 14 1 1 A 76 76 HIS N N 76 119.600 123.301 -3.701 1
1 772 . 14 1 1 A 77 77 LEU H H 77 8.240 8.932 -0.692 1
1 773 . 14 1 1 A 77 77 LEU HA H 77 5.080 5.103 -0.023 1
1 783 . 14 1 1 A 77 77 LEU CA C 77 53.600 53.665 -0.065 1
1 784 . 14 1 1 A 77 77 LEU CB C 77 44.100 43.378 0.722 1
1 788 . 14 1 1 A 77 77 LEU N N 77 123.800 123.947 -0.147 1
1 789 . 14 1 1 A 78 78 VAL H H 78 9.110 8.754 0.356 1
1 790 . 14 1 1 A 78 78 VAL HA H 78 4.260 4.666 -0.406 1
1 798 . 14 1 1 A 78 78 VAL CA C 78 60.400 60.863 -0.463 1
1 799 . 14 1 1 A 78 78 VAL CB C 78 34.700 36.074 -1.374 1
1 802 . 14 1 1 A 78 78 VAL N N 78 127.100 124.612 2.488 1
1 803 . 14 1 1 A 79 79 LEU H H 79 8.050 8.924 -0.874 1
1 804 . 14 1 1 A 79 79 LEU HA H 79 4.950 4.923 0.027 1
1 813 . 14 1 1 A 79 79 LEU CA C 79 53.800 53.203 0.597 1
1 814 . 14 1 1 A 79 79 LEU CB C 79 42.700 44.351 -1.651 1
1 818 . 14 1 1 A 79 79 LEU N N 79 123.400 128.631 -5.231 1
1 819 . 14 1 1 A 80 80 ARG H H 80 8.540 9.097 -0.557 1
1 820 . 14 1 1 A 80 80 ARG HA H 80 4.170 3.956 0.214 1
1 827 . 14 1 1 A 80 80 ARG CA C 80 55.800 56.965 -1.165 1
1 828 . 14 1 1 A 80 80 ARG CB C 80 31.100 28.797 2.303 1
1 830 . 14 1 1 A 80 80 ARG N N 80 123.500 126.400 -2.900 1
1 831 . 14 1 1 A 81 81 LEU H H 81 8.250 7.737 0.513 1
1 832 . 14 1 1 A 81 81 LEU HA H 81 4.270 4.309 -0.039 1
1 842 . 14 1 1 A 81 81 LEU CA C 81 55.000 54.453 0.547 1
1 843 . 14 1 1 A 81 81 LEU CB C 81 42.200 43.624 -1.424 1
1 847 . 14 1 1 A 81 81 LEU N N 81 124.100 118.605 5.495 1
1 848 . 14 1 1 A 82 82 ARG H H 82 8.310 9.118 -0.808 1
1 849 . 14 1 1 A 82 82 ARG HA H 82 4.200 4.497 -0.297 1
1 852 . 14 1 1 A 82 82 ARG CA C 82 56.300 57.186 -0.886 1
1 853 . 14 1 1 A 82 82 ARG CB C 82 30.700 32.559 -1.859 1
1 855 . 14 1 1 A 82 82 ARG N N 82 121.500 121.615 -0.115 1
1 856 . 14 1 1 A 83 83 GLY H H 83 8.410 8.029 0.381 1
1 857 . 14 1 1 A 83 83 GLY HA2 H 83 3.750 4.129 -0.379 1
1 858 . 14 1 1 A 83 83 GLY HA3 H 83 3.754 4.138 -0.384 1
1 859 . 14 1 1 A 83 83 GLY CA C 83 45.100 44.672 0.428 1
1 860 . 14 1 1 A 83 83 GLY N N 83 110.200 106.748 3.452 1
1 861 . 14 1 1 A 84 84 TYR H H 84 7.950 8.946 -0.996 1
1 862 . 14 1 1 A 84 84 TYR HA H 84 4.400 4.245 0.155 1
1 865 . 14 1 1 A 84 84 TYR CA C 84 58.100 58.686 -0.586 1
1 866 . 14 1 1 A 84 84 TYR CB C 84 38.800 37.088 1.712 1
1 867 . 14 1 1 A 84 84 TYR N N 84 119.900 120.235 -0.335 1
1 868 . 14 1 1 A 85 85 ALA H H 85 8.150 7.818 0.332 1
1 869 . 14 1 1 A 85 85 ALA HA H 85 4.150 4.538 -0.388 1
1 873 . 14 1 1 A 85 85 ALA CA C 85 52.600 51.168 1.432 1
1 874 . 14 1 1 A 85 85 ALA CB C 85 19.200 21.110 -1.910 1
1 875 . 14 1 1 A 85 85 ALA N N 85 124.800 120.543 4.257 1
1 876 . 14 1 1 A 86 86 ASP H H 86 8.020 8.963 -0.943 1
1 877 . 14 1 1 A 86 86 ASP HA H 86 4.450 4.985 -0.535 1
1 880 . 14 1 1 A 86 86 ASP CA C 86 54.100 53.265 0.835 1
1 881 . 14 1 1 A 86 86 ASP CB C 86 41.100 43.920 -2.820 1
1 882 . 14 1 1 A 86 86 ASP N N 86 118.900 115.515 3.385 1
1 883 . 14 1 1 A 87 87 LEU H H 87 8.010 8.506 -0.496 1
1 884 . 14 1 1 A 87 87 LEU HA H 87 4.210 4.939 -0.729 1
1 893 . 14 1 1 A 87 87 LEU CA C 87 55.300 54.346 0.954 1
1 894 . 14 1 1 A 87 87 LEU CB C 87 42.000 43.585 -1.585 1
1 898 . 14 1 1 A 87 87 LEU N N 87 122.400 120.545 1.855 1
1 899 . 14 1 1 A 88 88 ARG H H 88 8.170 8.793 -0.623 1
1 900 . 14 1 1 A 88 88 ARG HA H 88 4.210 4.524 -0.314 1
1 903 . 14 1 1 A 88 88 ARG CA C 88 56.300 57.025 -0.725 1
1 904 . 14 1 1 A 88 88 ARG CB C 88 30.600 32.134 -1.534 1
1 905 . 14 1 1 A 88 88 ARG N N 88 121.200 124.951 -3.751 1
1 906 . 14 1 1 A 91 91 PRO HA H 91 4.290 4.411 -0.121 1
1 911 . 14 1 1 A 91 91 PRO CA C 91 63.800 63.945 -0.145 1
1 912 . 14 1 1 A 91 91 PRO CB C 91 32.100 31.956 0.144 1
1 915 . 14 1 1 A 92 92 ASP H H 92 8.280 7.744 0.536 1
1 916 . 14 1 1 A 92 92 ASP HA H 92 4.540 4.999 -0.459 1
1 919 . 14 1 1 A 92 92 ASP CA C 92 54.600 53.109 1.491 1
1 920 . 14 1 1 A 92 92 ASP CB C 92 41.000 44.864 -3.864 1
1 921 . 14 1 1 A 92 92 ASP N N 92 118.700 118.544 0.156 1
1 922 . 14 1 1 A 93 93 ARG H H 93 7.780 8.451 -0.671 1
1 923 . 14 1 1 A 93 93 ARG HA H 93 4.190 4.292 -0.102 1
1 930 . 14 1 1 A 93 93 ARG CA C 93 56.300 56.860 -0.560 1
1 931 . 14 1 1 A 93 93 ARG CB C 93 30.700 31.145 -0.445 1
1 934 . 14 1 1 A 93 93 ARG N N 93 120.700 122.149 -1.449 1
1 935 . 14 1 1 A 94 94 GLN H H 94 8.280 8.310 -0.030 1
1 936 . 14 1 1 A 94 94 GLN HA H 94 4.210 4.462 -0.252 1
1 941 . 14 1 1 A 94 94 GLN CA C 94 55.800 54.267 1.533 1
1 942 . 14 1 1 A 94 94 GLN CB C 94 29.300 29.180 0.120 1
1 944 . 14 1 1 A 94 94 GLN N N 94 121.000 119.598 1.402 1
1 945 . 14 1 1 A 95 95 ASP H H 95 8.270 8.476 -0.206 1
1 946 . 14 1 1 A 95 95 ASP HA H 95 4.450 4.433 0.017 1
1 949 . 14 1 1 A 95 95 ASP CA C 95 54.300 54.205 0.095 1
1 950 . 14 1 1 A 95 95 ASP CB C 95 41.000 41.852 -0.852 1
1 951 . 14 1 1 A 95 95 ASP N N 95 121.000 120.383 0.617 1
1 952 . 14 1 1 A 96 96 HIS H H 96 8.090 8.124 -0.034 1
1 953 . 14 1 1 A 96 96 HIS HA H 96 4.470 4.868 -0.398 1
1 956 . 14 1 1 A 96 96 HIS CA C 96 55.900 55.628 0.272 1
1 957 . 14 1 1 A 96 96 HIS CB C 96 30.500 31.245 -0.745 1
1 958 . 14 1 1 A 96 96 HIS N N 96 119.300 116.567 2.733 1
1 959 . 14 1 1 A 97 97 HIS H H 97 8.240 7.300 0.940 1
1 960 . 14 1 1 A 97 97 HIS HA H 97 4.470 4.769 -0.299 1
1 963 . 14 1 1 A 97 97 HIS CA C 97 56.200 54.343 1.857 1
1 964 . 14 1 1 A 97 97 HIS CB C 97 30.400 30.458 -0.058 1
1 965 . 14 1 1 A 97 97 HIS N N 97 121.300 114.774 6.526 1
1 966 . 14 1 1 A 98 98 PRO HA H 98 4.340 4.559 -0.219 1
1 973 . 14 1 1 A 98 98 PRO CA C 98 63.700 62.488 1.212 1
1 974 . 14 1 1 A 98 98 PRO CB C 98 31.900 33.605 -1.705 1
1 977 . 14 1 1 A 99 99 GLY H H 99 8.660 8.319 0.341 1
1 978 . 14 1 1 A 99 99 GLY HA2 H 99 3.920 4.202 -0.282 1
1 979 . 14 1 1 A 99 99 GLY HA3 H 99 3.920 4.212 -0.292 1
1 980 . 14 1 1 A 99 99 GLY CA C 99 45.200 45.331 -0.131 1
1 981 . 14 1 1 A 99 99 GLY N N 99 110.000 107.212 2.788 1
1 982 . 14 1 1 A 100 100 SER H H 100 8.170 8.950 -0.780 1
1 983 . 14 1 1 A 100 100 SER HA H 100 4.360 5.172 -0.812 1
1 986 . 14 1 1 A 100 100 SER CA C 100 58.500 57.361 1.139 1
1 987 . 14 1 1 A 100 100 SER CB C 100 64.000 67.639 -3.639 1
1 988 . 14 1 1 A 100 100 SER N N 100 115.600 120.964 -5.364 1
1 989 . 14 1 1 A 101 101 GLY H H 101 8.420 8.407 0.013 1
1 990 . 14 1 1 A 101 101 GLY HA2 H 101 3.890 4.125 -0.235 1
1 991 . 14 1 1 A 101 101 GLY HA3 H 101 3.920 4.125 -0.205 1
1 992 . 14 1 1 A 101 101 GLY CA C 101 45.200 44.391 0.809 1
1 993 . 14 1 1 A 101 101 GLY N N 101 111.000 108.166 2.834 1
1 994 . 14 1 1 A 102 102 ALA H H 102 8.030 8.397 -0.367 1
1 995 . 14 1 1 A 102 102 ALA HA H 102 4.250 4.767 -0.517 1
1 999 . 14 1 1 A 102 102 ALA CA C 102 52.500 51.229 1.271 1
1 1000 . 14 1 1 A 102 102 ALA CB C 102 19.200 22.298 -3.098 1
1 4 . 15 1 1 A 2 2 SER H H 2 8.160 8.773 -0.613 1
1 5 . 15 1 1 A 2 2 SER HA H 2 4.370 5.077 -0.707 1
1 9 . 15 1 1 A 2 2 SER CA C 2 58.300 56.933 1.367 1
1 10 . 15 1 1 A 2 2 SER CB C 2 63.900 64.480 -0.580 1
1 11 . 15 1 1 A 2 2 SER N N 2 115.600 119.429 -3.829 1
1 12 . 15 1 1 A 3 3 LEU H H 3 8.250 8.550 -0.300 1
1 13 . 15 1 1 A 3 3 LEU HA H 3 4.280 4.205 0.075 1
1 17 . 15 1 1 A 3 3 LEU CA C 3 55.200 54.894 0.306 1
1 18 . 15 1 1 A 3 3 LEU CB C 3 42.100 43.153 -1.053 1
1 19 . 15 1 1 A 3 3 LEU N N 3 124.100 123.536 0.564 1
1 20 . 15 1 1 A 4 4 VAL H H 4 7.950 8.318 -0.368 1
1 21 . 15 1 1 A 4 4 VAL HA H 4 4.680 4.759 -0.079 1
1 26 . 15 1 1 A 4 4 VAL CA C 4 59.800 57.875 1.925 1
1 27 . 15 1 1 A 4 4 VAL CB C 4 32.500 34.894 -2.394 1
1 28 . 15 1 1 A 4 4 VAL N N 4 122.600 119.585 3.015 1
1 29 . 15 1 1 A 5 5 PRO CA C 5 63.100 62.655 0.445 1
1 30 . 15 1 1 A 5 5 PRO CB C 5 32.000 31.737 0.263 1
1 32 . 15 1 1 A 6 6 ARG H H 6 8.360 8.505 -0.145 1
1 33 . 15 1 1 A 6 6 ARG HA H 6 4.250 5.112 -0.862 1
1 36 . 15 1 1 A 6 6 ARG CA C 6 56.000 54.668 1.332 1
1 37 . 15 1 1 A 6 6 ARG CB C 6 30.900 34.529 -3.629 1
1 38 . 15 1 1 A 6 6 ARG N N 6 121.800 124.906 -3.106 1
1 39 . 15 1 1 A 7 7 GLY H H 7 8.460 8.459 0.001 1
1 40 . 15 1 1 A 7 7 GLY HA2 H 7 3.940 4.279 -0.339 1
1 41 . 15 1 1 A 7 7 GLY HA3 H 7 3.760 4.282 -0.522 1
1 42 . 15 1 1 A 7 7 GLY CA C 7 45.000 45.452 -0.452 1
1 43 . 15 1 1 A 7 7 GLY N N 7 110.700 108.994 1.706 1
1 44 . 15 1 1 A 8 8 SER H H 8 7.990 8.584 -0.594 1
1 45 . 15 1 1 A 8 8 SER HA H 8 4.450 4.616 -0.166 1
1 48 . 15 1 1 A 8 8 SER CA C 8 58.900 59.298 -0.398 1
1 49 . 15 1 1 A 8 8 SER CB C 8 64.200 65.001 -0.801 1
1 50 . 15 1 1 A 8 8 SER N N 8 115.500 114.655 0.845 1
1 51 . 15 1 1 A 9 9 MET H H 9 9.040 7.518 1.522 1
1 52 . 15 1 1 A 9 9 MET HA H 9 4.610 5.125 -0.515 1
1 60 . 15 1 1 A 9 9 MET CA C 9 54.400 53.673 0.727 1
1 61 . 15 1 1 A 9 9 MET CB C 9 35.400 34.085 1.315 1
1 64 . 15 1 1 A 9 9 MET N N 9 120.500 119.378 1.122 1
1 65 . 15 1 1 A 10 10 GLN H H 10 8.270 8.970 -0.700 1
1 66 . 15 1 1 A 10 10 GLN HA H 10 5.270 5.308 -0.038 1
1 71 . 15 1 1 A 10 10 GLN CA C 10 54.200 54.442 -0.242 1
1 72 . 15 1 1 A 10 10 GLN CB C 10 30.500 32.140 -1.640 1
1 74 . 15 1 1 A 10 10 GLN N N 10 121.000 122.165 -1.165 1
1 75 . 15 1 1 A 11 11 ILE H H 11 8.270 8.839 -0.569 1
1 76 . 15 1 1 A 11 11 ILE HA H 11 4.100 4.796 -0.696 1
1 86 . 15 1 1 A 11 11 ILE CA C 11 59.400 59.226 0.174 1
1 87 . 15 1 1 A 11 11 ILE CB C 11 41.800 40.627 1.173 1
1 91 . 15 1 1 A 11 11 ILE N N 11 114.600 121.581 -6.981 1
1 92 . 15 1 1 A 12 12 PHE H H 12 8.520 8.907 -0.387 1
1 93 . 15 1 1 A 12 12 PHE HA H 12 5.540 5.395 0.145 1
1 96 . 15 1 1 A 12 12 PHE CA C 12 55.000 56.487 -1.487 1
1 97 . 15 1 1 A 12 12 PHE CB C 12 41.200 41.099 0.101 1
1 98 . 15 1 1 A 12 12 PHE N N 12 118.600 123.567 -4.967 1
1 99 . 15 1 1 A 13 13 VAL H H 13 9.230 8.844 0.386 1
1 100 . 15 1 1 A 13 13 VAL HA H 13 4.740 4.913 -0.173 1
1 108 . 15 1 1 A 13 13 VAL CA C 13 60.300 60.565 -0.265 1
1 109 . 15 1 1 A 13 13 VAL CB C 13 34.100 35.025 -0.925 1
1 112 . 15 1 1 A 13 13 VAL N N 13 121.400 124.694 -3.294 1
1 113 . 15 1 1 A 14 14 LYS H H 14 8.910 8.802 0.108 1
1 114 . 15 1 1 A 14 14 LYS HA H 14 5.190 4.669 0.521 1
1 122 . 15 1 1 A 14 14 LYS CA C 14 54.600 54.695 -0.095 1
1 123 . 15 1 1 A 14 14 LYS CB C 14 34.300 34.485 -0.185 1
1 126 . 15 1 1 A 14 14 LYS N N 14 128.000 126.626 1.374 1
1 127 . 15 1 1 A 15 15 THR H H 15 8.650 8.883 -0.233 1
1 128 . 15 1 1 A 15 15 THR HA H 15 4.870 4.613 0.257 1
1 133 . 15 1 1 A 15 15 THR CA C 15 60.300 60.807 -0.507 1
1 134 . 15 1 1 A 15 15 THR CB C 15 70.600 71.144 -0.544 1
1 136 . 15 1 1 A 15 15 THR N N 15 115.300 117.794 -2.494 1
1 137 . 15 1 1 A 16 16 LEU H H 16 9.070 8.814 0.256 1
1 138 . 15 1 1 A 16 16 LEU HA H 16 4.210 4.047 0.163 1
1 148 . 15 1 1 A 16 16 LEU CA C 16 57.400 57.590 -0.190 1
1 149 . 15 1 1 A 16 16 LEU CB C 16 41.800 41.576 0.224 1
1 153 . 15 1 1 A 16 16 LEU N N 16 121.400 119.248 2.152 1
1 154 . 15 1 1 A 17 17 THR H H 17 7.560 7.821 -0.261 1
1 155 . 15 1 1 A 17 17 THR HA H 17 4.330 4.311 0.019 1
1 160 . 15 1 1 A 17 17 THR CA C 17 61.400 63.438 -2.038 1
1 161 . 15 1 1 A 17 17 THR CB C 17 68.900 69.526 -0.626 1
1 163 . 15 1 1 A 17 17 THR N N 17 105.900 113.602 -7.702 1
1 164 . 15 1 1 A 18 18 GLY H H 18 7.750 7.741 0.009 1
1 165 . 15 1 1 A 18 18 GLY HA2 H 18 4.250 4.004 0.246 1
1 166 . 15 1 1 A 18 18 GLY HA3 H 18 3.520 4.027 -0.507 1
1 167 . 15 1 1 A 18 18 GLY CA C 18 45.300 45.100 0.200 1
1 168 . 15 1 1 A 18 18 GLY N N 18 109.300 109.239 0.061 1
1 169 . 15 1 1 A 19 19 LYS H H 19 7.210 7.654 -0.444 1
1 170 . 15 1 1 A 19 19 LYS HA H 19 4.260 4.305 -0.045 1
1 175 . 15 1 1 A 19 19 LYS CA C 19 56.300 56.804 -0.504 1
1 176 . 15 1 1 A 19 19 LYS CB C 19 33.200 33.847 -0.647 1
1 179 . 15 1 1 A 19 19 LYS N N 19 122.000 120.448 1.552 1
1 180 . 15 1 1 A 20 20 THR H H 20 8.570 8.587 -0.017 1
1 181 . 15 1 1 A 20 20 THR HA H 20 4.950 5.219 -0.269 1
1 186 . 15 1 1 A 20 20 THR CA C 20 62.200 61.964 0.236 1
1 187 . 15 1 1 A 20 20 THR CB C 20 69.700 70.467 -0.767 1
1 189 . 15 1 1 A 20 20 THR N N 20 120.700 116.779 3.921 1
1 190 . 15 1 1 A 21 21 ILE H H 21 9.510 8.845 0.665 1
1 191 . 15 1 1 A 21 21 ILE HA H 21 4.390 4.923 -0.533 1
1 201 . 15 1 1 A 21 21 ILE CA C 21 60.000 59.102 0.898 1
1 202 . 15 1 1 A 21 21 ILE CB C 21 40.700 41.724 -1.024 1
1 206 . 15 1 1 A 21 21 ILE N N 21 128.200 122.268 5.932 1
1 207 . 15 1 1 A 22 22 THR H H 22 8.700 8.706 -0.006 1
1 208 . 15 1 1 A 22 22 THR HA H 22 4.860 4.491 0.369 1
1 213 . 15 1 1 A 22 22 THR CA C 22 62.100 63.040 -0.940 1
1 214 . 15 1 1 A 22 22 THR CB C 22 69.500 69.157 0.343 1
1 216 . 15 1 1 A 22 22 THR N N 22 122.300 121.090 1.210 1
1 217 . 15 1 1 A 23 23 LEU H H 23 8.720 9.086 -0.366 1
1 218 . 15 1 1 A 23 23 LEU HA H 23 4.690 5.019 -0.329 1
1 228 . 15 1 1 A 23 23 LEU CA C 23 52.700 53.146 -0.446 1
1 229 . 15 1 1 A 23 23 LEU CB C 23 46.600 44.886 1.714 1
1 233 . 15 1 1 A 23 23 LEU N N 23 125.400 128.021 -2.621 1
1 234 . 15 1 1 A 24 24 GLU H H 24 8.080 8.704 -0.624 1
1 235 . 15 1 1 A 24 24 GLU HA H 24 4.800 4.782 0.018 1
1 238 . 15 1 1 A 24 24 GLU CA C 24 55.400 55.863 -0.463 1
1 239 . 15 1 1 A 24 24 GLU CB C 24 30.100 30.943 -0.843 1
1 241 . 15 1 1 A 24 24 GLU N N 24 121.800 122.446 -0.646 1
1 242 . 15 1 1 A 25 25 VAL H H 25 8.800 8.611 0.189 1
1 243 . 15 1 1 A 25 25 VAL HA H 25 4.640 4.816 -0.176 1
1 251 . 15 1 1 A 25 25 VAL CA C 25 58.600 60.082 -1.482 1
1 252 . 15 1 1 A 25 25 VAL CB C 25 36.300 36.059 0.241 1
1 255 . 15 1 1 A 25 25 VAL N N 25 116.700 125.738 -9.038 1
1 256 . 15 1 1 A 26 26 GLU H H 26 8.500 8.467 0.033 1
1 257 . 15 1 1 A 26 26 GLU HA H 26 4.900 4.608 0.292 1
1 260 . 15 1 1 A 26 26 GLU CA C 26 53.000 54.614 -1.614 1
1 261 . 15 1 1 A 26 26 GLU CB C 26 31.200 34.061 -2.861 1
1 262 . 15 1 1 A 26 26 GLU N N 26 117.900 124.948 -7.048 1
1 263 . 15 1 1 A 27 27 PRO HA H 27 4.040 4.397 -0.357 1
1 270 . 15 1 1 A 27 27 PRO CA C 27 65.400 64.854 0.546 1
1 271 . 15 1 1 A 27 27 PRO CB C 27 31.700 32.035 -0.335 1
1 274 . 15 1 1 A 28 28 SER H H 28 7.010 8.110 -1.100 1
1 275 . 15 1 1 A 28 28 SER HA H 28 4.280 4.440 -0.160 1
1 278 . 15 1 1 A 28 28 SER CA C 28 57.400 58.173 -0.773 1
1 279 . 15 1 1 A 28 28 SER CB C 28 63.400 64.406 -1.006 1
1 280 . 15 1 1 A 28 28 SER N N 28 103.800 110.659 -6.859 1
1 281 . 15 1 1 A 29 29 ASP H H 29 7.960 7.679 0.281 1
1 282 . 15 1 1 A 29 29 ASP HA H 29 4.600 5.014 -0.414 1
1 285 . 15 1 1 A 29 29 ASP CA C 29 55.900 52.977 2.923 1
1 286 . 15 1 1 A 29 29 ASP CB C 29 41.000 41.849 -0.849 1
1 287 . 15 1 1 A 29 29 ASP N N 29 123.700 122.812 0.888 1
1 288 . 15 1 1 A 30 30 THR H H 30 7.780 8.862 -1.082 1
1 289 . 15 1 1 A 30 30 THR HA H 30 4.850 4.582 0.268 1
1 294 . 15 1 1 A 30 30 THR CA C 30 59.400 60.983 -1.583 1
1 295 . 15 1 1 A 30 30 THR CB C 30 71.100 70.353 0.747 1
1 297 . 15 1 1 A 30 30 THR N N 30 108.800 120.518 -11.718 1
1 298 . 15 1 1 A 31 31 ILE H H 31 8.320 8.939 -0.619 1
1 299 . 15 1 1 A 31 31 ILE HA H 31 3.580 3.754 -0.174 1
1 309 . 15 1 1 A 31 31 ILE CA C 31 62.200 64.724 -2.524 1
1 310 . 15 1 1 A 31 31 ILE CB C 31 34.300 37.535 -3.235 1
1 314 . 15 1 1 A 31 31 ILE N N 31 121.300 127.270 -5.970 1
1 315 . 15 1 1 A 32 32 GLU H H 32 9.850 8.366 1.484 1
1 316 . 15 1 1 A 32 32 GLU HA H 32 3.780 3.937 -0.157 1
1 321 . 15 1 1 A 32 32 GLU CA C 32 60.500 59.961 0.539 1
1 322 . 15 1 1 A 32 32 GLU CB C 32 28.800 29.342 -0.542 1
1 324 . 15 1 1 A 32 32 GLU N N 32 121.600 122.272 -0.672 1
1 325 . 15 1 1 A 33 33 ASN H H 33 7.810 7.576 0.234 1
1 326 . 15 1 1 A 33 33 ASN HA H 33 4.440 4.672 -0.232 1
1 329 . 15 1 1 A 33 33 ASN CA C 33 55.800 55.905 -0.105 1
1 330 . 15 1 1 A 33 33 ASN CB C 33 38.100 38.819 -0.719 1
1 331 . 15 1 1 A 33 33 ASN N N 33 121.000 118.101 2.899 1
1 332 . 15 1 1 A 34 34 VAL H H 34 8.000 7.975 0.025 1
1 333 . 15 1 1 A 34 34 VAL HA H 34 3.300 3.560 -0.260 1
1 341 . 15 1 1 A 34 34 VAL CA C 34 67.600 66.575 1.025 1
1 342 . 15 1 1 A 34 34 VAL CB C 34 30.700 31.648 -0.948 1
1 345 . 15 1 1 A 34 34 VAL N N 34 122.200 120.407 1.793 1
1 346 . 15 1 1 A 35 35 LYS H H 35 8.490 8.102 0.388 1
1 347 . 15 1 1 A 35 35 LYS HA H 35 4.500 4.051 0.449 1
1 352 . 15 1 1 A 35 35 LYS CA C 35 59.300 59.244 0.056 1
1 353 . 15 1 1 A 35 35 LYS CB C 35 33.500 32.136 1.364 1
1 354 . 15 1 1 A 35 35 LYS N N 35 119.200 119.314 -0.114 1
1 355 . 15 1 1 A 36 36 ALA H H 36 7.880 8.397 -0.517 1
1 356 . 15 1 1 A 36 36 ALA HA H 36 4.060 4.103 -0.043 1
1 360 . 15 1 1 A 36 36 ALA CA C 36 55.300 54.690 0.610 1
1 361 . 15 1 1 A 36 36 ALA CB C 36 17.600 18.129 -0.529 1
1 362 . 15 1 1 A 36 36 ALA N N 36 123.300 122.161 1.139 1
1 363 . 15 1 1 A 37 37 LYS H H 37 7.790 7.942 -0.152 1
1 364 . 15 1 1 A 37 37 LYS HA H 37 4.110 4.095 0.015 1
1 373 . 15 1 1 A 37 37 LYS CA C 37 59.700 59.303 0.397 1
1 374 . 15 1 1 A 37 37 LYS CB C 37 33.100 32.359 0.741 1
1 378 . 15 1 1 A 37 37 LYS N N 37 120.400 117.179 3.221 1
1 379 . 15 1 1 A 38 38 ILE H H 38 8.240 7.846 0.394 1
1 380 . 15 1 1 A 38 38 ILE HA H 38 3.410 4.002 -0.592 1
1 390 . 15 1 1 A 38 38 ILE CA C 38 66.200 62.076 4.124 1
1 391 . 15 1 1 A 38 38 ILE CB C 38 36.800 37.821 -1.021 1
1 395 . 15 1 1 A 38 38 ILE N N 38 121.400 120.111 1.289 1
1 396 . 15 1 1 A 39 39 GLN H H 39 8.460 8.512 -0.052 1
1 397 . 15 1 1 A 39 39 GLN HA H 39 3.730 3.901 -0.171 1
1 402 . 15 1 1 A 39 39 GLN CA C 39 60.000 59.242 0.758 1
1 403 . 15 1 1 A 39 39 GLN CB C 39 27.600 28.477 -0.877 1
1 405 . 15 1 1 A 39 39 GLN N N 39 123.500 121.325 2.175 1
1 406 . 15 1 1 A 40 40 ASP H H 40 7.970 8.088 -0.118 1
1 407 . 15 1 1 A 40 40 ASP HA H 40 4.240 4.370 -0.130 1
1 410 . 15 1 1 A 40 40 ASP CA C 40 57.400 56.621 0.779 1
1 411 . 15 1 1 A 40 40 ASP CB C 40 41.000 40.700 0.300 1
1 412 . 15 1 1 A 40 40 ASP N N 40 119.900 119.286 0.614 1
1 413 . 15 1 1 A 41 41 LYS H H 41 7.420 7.828 -0.408 1
1 414 . 15 1 1 A 41 41 LYS HA H 41 4.200 4.160 0.040 1
1 423 . 15 1 1 A 41 41 LYS CA C 41 58.200 59.333 -1.133 1
1 424 . 15 1 1 A 41 41 LYS CB C 41 33.900 32.743 1.157 1
1 427 . 15 1 1 A 41 41 LYS N N 41 115.700 119.037 -3.337 1
1 428 . 15 1 1 A 42 42 GLU H H 42 8.650 8.082 0.568 1
1 429 . 15 1 1 A 42 42 GLU HA H 42 4.470 4.414 0.056 1
1 434 . 15 1 1 A 42 42 GLU CA C 42 55.300 55.726 -0.426 1
1 435 . 15 1 1 A 42 42 GLU CB C 42 33.200 31.951 1.249 1
1 437 . 15 1 1 A 42 42 GLU N N 42 114.200 113.859 0.341 1
1 438 . 15 1 1 A 43 43 GLY H H 43 8.400 7.818 0.582 1
1 439 . 15 1 1 A 43 43 GLY HA2 H 43 4.040 3.893 0.147 1
1 440 . 15 1 1 A 43 43 GLY HA3 H 43 3.820 3.899 -0.079 1
1 441 . 15 1 1 A 43 43 GLY CA C 43 45.900 46.438 -0.538 1
1 442 . 15 1 1 A 43 43 GLY N N 43 109.000 109.822 -0.822 1
1 443 . 15 1 1 A 44 44 ILE H H 44 6.080 8.051 -1.971 1
1 444 . 15 1 1 A 44 44 ILE HA H 44 4.290 4.198 0.092 1
1 446 . 15 1 1 A 44 44 ILE CA C 44 57.700 58.830 -1.130 1
1 447 . 15 1 1 A 44 44 ILE CB C 44 40.400 38.053 2.347 1
1 448 . 15 1 1 A 44 44 ILE N N 44 120.500 121.326 -0.826 1
1 449 . 15 1 1 A 46 46 PRO HA H 46 4.030 4.300 -0.270 1
1 454 . 15 1 1 A 46 46 PRO CA C 46 66.100 65.041 1.059 1
1 455 . 15 1 1 A 46 46 PRO CB C 46 32.600 31.824 0.776 1
1 458 . 15 1 1 A 47 47 ASP H H 47 8.470 8.856 -0.386 1
1 459 . 15 1 1 A 47 47 ASP HA H 47 4.310 4.330 -0.020 1
1 462 . 15 1 1 A 47 47 ASP CA C 47 55.700 56.860 -1.160 1
1 463 . 15 1 1 A 47 47 ASP CB C 47 39.700 39.660 0.040 1
1 464 . 15 1 1 A 47 47 ASP N N 47 113.700 117.025 -3.325 1
1 465 . 15 1 1 A 48 48 GLN H H 48 7.720 7.635 0.085 1
1 466 . 15 1 1 A 48 48 GLN HA H 48 4.340 4.455 -0.115 1
1 471 . 15 1 1 A 48 48 GLN CA C 48 55.500 56.746 -1.246 1
1 472 . 15 1 1 A 48 48 GLN CB C 48 29.900 29.793 0.107 1
1 474 . 15 1 1 A 48 48 GLN N N 48 116.900 117.423 -0.523 1
1 475 . 15 1 1 A 49 49 GLN H H 49 7.410 7.528 -0.118 1
1 476 . 15 1 1 A 49 49 GLN HA H 49 4.110 4.111 -0.001 1
1 481 . 15 1 1 A 49 49 GLN CA C 49 56.600 56.339 0.261 1
1 482 . 15 1 1 A 49 49 GLN CB C 49 31.300 29.705 1.595 1
1 484 . 15 1 1 A 49 49 GLN N N 49 118.000 119.422 -1.422 1
1 485 . 15 1 1 A 50 50 ARG H H 50 8.400 8.519 -0.119 1
1 486 . 15 1 1 A 50 50 ARG HA H 50 4.380 5.030 -0.650 1
1 491 . 15 1 1 A 50 50 ARG CA C 50 55.100 54.319 0.781 1
1 492 . 15 1 1 A 50 50 ARG CB C 50 31.600 32.833 -1.233 1
1 494 . 15 1 1 A 50 50 ARG N N 50 123.100 122.364 0.736 1
1 495 . 15 1 1 A 51 51 LEU H H 51 8.710 8.587 0.123 1
1 496 . 15 1 1 A 51 51 LEU HA H 51 5.300 5.133 0.167 1
1 506 . 15 1 1 A 51 51 LEU CA C 51 52.900 53.488 -0.588 1
1 507 . 15 1 1 A 51 51 LEU CB C 51 45.700 45.373 0.327 1
1 511 . 15 1 1 A 51 51 LEU N N 51 124.400 120.349 4.051 1
1 512 . 15 1 1 A 52 52 ILE H H 52 9.060 9.002 0.058 1
1 513 . 15 1 1 A 52 52 ILE HA H 52 4.840 4.975 -0.135 1
1 523 . 15 1 1 A 52 52 ILE CA C 52 58.900 59.971 -1.071 1
1 524 . 15 1 1 A 52 52 ILE CB C 52 41.200 40.990 0.210 1
1 528 . 15 1 1 A 52 52 ILE N N 52 122.500 123.356 -0.856 1
1 529 . 15 1 1 A 53 53 PHE H H 53 8.730 9.389 -0.659 1
1 530 . 15 1 1 A 53 53 PHE HA H 53 5.100 4.869 0.231 1
1 535 . 15 1 1 A 53 53 PHE CA C 53 56.300 57.551 -1.251 1
1 536 . 15 1 1 A 53 53 PHE CB C 53 43.500 42.039 1.461 1
1 537 . 15 1 1 A 53 53 PHE N N 53 124.800 127.510 -2.710 1
1 538 . 15 1 1 A 54 54 ALA H H 54 8.940 9.207 -0.267 1
1 539 . 15 1 1 A 54 54 ALA HA H 54 3.610 3.934 -0.324 1
1 543 . 15 1 1 A 54 54 ALA CA C 54 52.500 53.053 -0.553 1
1 544 . 15 1 1 A 54 54 ALA CB C 54 16.300 17.433 -1.133 1
1 545 . 15 1 1 A 54 54 ALA N N 54 133.100 130.352 2.748 1
1 546 . 15 1 1 A 55 55 GLY H H 55 8.070 8.382 -0.312 1
1 547 . 15 1 1 A 55 55 GLY HA2 H 55 4.000 3.799 0.201 1
1 548 . 15 1 1 A 55 55 GLY HA3 H 55 3.340 3.832 -0.492 1
1 549 . 15 1 1 A 55 55 GLY CA C 55 45.200 45.249 -0.049 1
1 550 . 15 1 1 A 55 55 GLY N N 55 102.500 102.670 -0.170 1
1 551 . 15 1 1 A 56 56 LYS H H 56 7.860 7.945 -0.085 1
1 552 . 15 1 1 A 56 56 LYS HA H 56 4.510 4.572 -0.062 1
1 558 . 15 1 1 A 56 56 LYS CA C 56 54.500 54.694 -0.194 1
1 559 . 15 1 1 A 56 56 LYS CB C 56 34.400 33.777 0.623 1
1 561 . 15 1 1 A 56 56 LYS N N 56 121.800 121.939 -0.139 1
1 562 . 15 1 1 A 57 57 GLN H H 57 8.600 8.517 0.083 1
1 563 . 15 1 1 A 57 57 GLN HA H 57 4.410 4.875 -0.465 1
1 568 . 15 1 1 A 57 57 GLN CA C 57 55.900 55.401 0.499 1
1 569 . 15 1 1 A 57 57 GLN CB C 57 28.800 29.686 -0.886 1
1 571 . 15 1 1 A 57 57 GLN N N 57 123.200 123.873 -0.673 1
1 572 . 15 1 1 A 58 58 LEU H H 58 8.480 8.813 -0.333 1
1 573 . 15 1 1 A 58 58 LEU HA H 58 4.060 4.948 -0.888 1
1 583 . 15 1 1 A 58 58 LEU CA C 58 54.100 53.202 0.898 1
1 584 . 15 1 1 A 58 58 LEU CB C 58 41.500 45.136 -3.636 1
1 588 . 15 1 1 A 58 58 LEU N N 58 125.900 118.176 7.724 1
1 589 . 15 1 1 A 59 59 GLU H H 59 8.400 8.301 0.099 1
1 590 . 15 1 1 A 59 59 GLU HA H 59 4.400 4.887 -0.487 1
1 595 . 15 1 1 A 59 59 GLU CA C 59 55.900 54.752 1.148 1
1 596 . 15 1 1 A 59 59 GLU CB C 59 31.900 32.799 -0.899 1
1 598 . 15 1 1 A 59 59 GLU N N 59 123.100 118.010 5.090 1
1 599 . 15 1 1 A 60 60 ASP H H 60 8.110 8.645 -0.535 1
1 600 . 15 1 1 A 60 60 ASP HA H 60 4.270 5.420 -1.150 1
1 603 . 15 1 1 A 60 60 ASP CA C 60 57.100 52.526 4.574 1
1 604 . 15 1 1 A 60 60 ASP CB C 60 40.800 44.526 -3.726 1
1 605 . 15 1 1 A 60 60 ASP N N 60 120.300 120.359 -0.059 1
1 606 . 15 1 1 A 61 61 GLY HA2 H 61 4.000 4.031 -0.031 1
1 607 . 15 1 1 A 61 61 GLY HA3 H 61 3.830 4.068 -0.238 1
1 608 . 15 1 1 A 61 61 GLY CA C 61 45.000 45.525 -0.525 1
1 609 . 15 1 1 A 62 62 ARG H H 62 7.350 8.084 -0.734 1
1 610 . 15 1 1 A 62 62 ARG HA H 62 4.640 4.895 -0.255 1
1 615 . 15 1 1 A 62 62 ARG CA C 62 54.400 54.057 0.343 1
1 616 . 15 1 1 A 62 62 ARG CB C 62 32.600 33.078 -0.478 1
1 618 . 15 1 1 A 62 62 ARG N N 62 119.300 120.261 -0.961 1
1 619 . 15 1 1 A 63 63 THR H H 63 8.460 8.864 -0.404 1
1 620 . 15 1 1 A 63 63 THR HA H 63 5.060 4.653 0.407 1
1 625 . 15 1 1 A 63 63 THR CA C 63 59.700 60.858 -1.158 1
1 626 . 15 1 1 A 63 63 THR CB C 63 72.000 71.257 0.743 1
1 628 . 15 1 1 A 63 63 THR N N 63 109.100 112.673 -3.573 1
1 629 . 15 1 1 A 64 64 LEU H H 64 8.190 8.797 -0.607 1
1 630 . 15 1 1 A 64 64 LEU HA H 64 3.920 3.975 -0.055 1
1 640 . 15 1 1 A 64 64 LEU CA C 64 58.400 58.019 0.381 1
1 641 . 15 1 1 A 64 64 LEU CB C 64 40.200 41.505 -1.305 1
1 645 . 15 1 1 A 64 64 LEU N N 64 118.100 123.074 -4.974 1
1 646 . 15 1 1 A 65 65 SER H H 65 8.370 7.716 0.654 1
1 647 . 15 1 1 A 65 65 SER HA H 65 4.150 4.159 -0.009 1
1 650 . 15 1 1 A 65 65 SER CA C 65 60.900 60.940 -0.040 1
1 651 . 15 1 1 A 65 65 SER CB C 65 62.500 63.205 -0.705 1
1 652 . 15 1 1 A 65 65 SER N N 65 112.200 114.078 -1.878 1
1 653 . 15 1 1 A 66 66 GLU H H 66 7.780 7.683 0.097 1
1 654 . 15 1 1 A 66 66 GLU HA H 66 3.890 4.106 -0.216 1
1 659 . 15 1 1 A 66 66 GLU CA C 66 59.200 58.803 0.397 1
1 660 . 15 1 1 A 66 66 GLU CB C 66 29.400 29.602 -0.202 1
1 662 . 15 1 1 A 66 66 GLU N N 66 123.600 121.603 1.997 1
1 663 . 15 1 1 A 67 67 TYR H H 67 7.290 7.624 -0.334 1
1 664 . 15 1 1 A 67 67 TYR HA H 67 4.590 4.614 -0.024 1
1 669 . 15 1 1 A 67 67 TYR CA C 67 58.400 57.657 0.743 1
1 670 . 15 1 1 A 67 67 TYR CB C 67 39.800 38.726 1.074 1
1 671 . 15 1 1 A 67 67 TYR N N 67 116.400 116.873 -0.473 1
1 672 . 15 1 1 A 68 68 ASN H H 68 8.040 8.050 -0.010 1
1 673 . 15 1 1 A 68 68 ASN HA H 68 4.240 4.252 -0.012 1
1 676 . 15 1 1 A 68 68 ASN CA C 68 54.100 54.664 -0.564 1
1 677 . 15 1 1 A 68 68 ASN CB C 68 37.200 36.917 0.283 1
1 678 . 15 1 1 A 68 68 ASN N N 68 115.600 115.218 0.382 1
1 679 . 15 1 1 A 69 69 ILE H H 69 7.200 7.776 -0.576 1
1 680 . 15 1 1 A 69 69 ILE HA H 69 3.280 4.836 -1.556 1
1 690 . 15 1 1 A 69 69 ILE CA C 69 59.800 58.999 0.801 1
1 691 . 15 1 1 A 69 69 ILE CB C 69 36.600 40.466 -3.866 1
1 695 . 15 1 1 A 69 69 ILE N N 69 119.100 113.955 5.145 1
1 696 . 15 1 1 A 70 70 GLN H H 70 7.570 8.551 -0.981 1
1 697 . 15 1 1 A 70 70 GLN HA H 70 4.410 4.694 -0.284 1
1 702 . 15 1 1 A 70 70 GLN CA C 70 53.500 54.846 -1.346 1
1 703 . 15 1 1 A 70 70 GLN CB C 70 31.500 28.430 3.070 1
1 705 . 15 1 1 A 70 70 GLN N N 70 124.800 120.738 4.062 1
1 706 . 15 1 1 A 71 71 LYS H H 71 8.370 8.054 0.316 1
1 707 . 15 1 1 A 71 71 LYS HA H 71 3.870 3.908 -0.038 1
1 716 . 15 1 1 A 71 71 LYS CA C 71 58.000 56.446 1.554 1
1 717 . 15 1 1 A 71 71 LYS CB C 71 32.500 32.073 0.427 1
1 720 . 15 1 1 A 71 71 LYS N N 71 120.200 123.817 -3.617 1
1 721 . 15 1 1 A 72 72 GLU H H 72 9.230 8.211 1.019 1
1 722 . 15 1 1 A 72 72 GLU HA H 72 3.240 4.299 -1.059 1
1 727 . 15 1 1 A 72 72 GLU CA C 72 58.300 56.368 1.932 1
1 728 . 15 1 1 A 72 72 GLU CB C 72 26.000 29.171 -3.171 1
1 730 . 15 1 1 A 72 72 GLU N N 72 115.100 119.243 -4.143 1
1 731 . 15 1 1 A 73 73 SER H H 73 7.690 8.417 -0.727 1
1 732 . 15 1 1 A 73 73 SER HA H 73 4.520 4.776 -0.256 1
1 735 . 15 1 1 A 73 73 SER CA C 73 61.100 59.476 1.624 1
1 736 . 15 1 1 A 73 73 SER CB C 73 64.800 64.834 -0.034 1
1 737 . 15 1 1 A 73 73 SER N N 73 115.300 114.475 0.825 1
1 738 . 15 1 1 A 74 74 THR H H 74 8.620 7.847 0.773 1
1 739 . 15 1 1 A 74 74 THR HA H 74 5.200 5.123 0.077 1
1 744 . 15 1 1 A 74 74 THR CA C 74 62.400 61.791 0.609 1
1 745 . 15 1 1 A 74 74 THR CB C 74 70.200 70.730 -0.530 1
1 747 . 15 1 1 A 74 74 THR N N 74 117.500 112.123 5.377 1
1 748 . 15 1 1 A 75 75 LEU H H 75 9.350 9.234 0.116 1
1 749 . 15 1 1 A 75 75 LEU HA H 75 4.990 5.222 -0.232 1
1 759 . 15 1 1 A 75 75 LEU CA C 75 53.800 54.062 -0.262 1
1 760 . 15 1 1 A 75 75 LEU CB C 75 44.400 45.791 -1.391 1
1 764 . 15 1 1 A 75 75 LEU N N 75 128.000 126.596 1.404 1
1 765 . 15 1 1 A 76 76 HIS H H 76 9.140 8.667 0.473 1
1 766 . 15 1 1 A 76 76 HIS HA H 76 5.040 5.249 -0.209 1
1 769 . 15 1 1 A 76 76 HIS CA C 76 56.200 54.359 1.841 1
1 770 . 15 1 1 A 76 76 HIS CB C 76 32.500 33.145 -0.645 1
1 771 . 15 1 1 A 76 76 HIS N N 76 119.600 124.093 -4.493 1
1 772 . 15 1 1 A 77 77 LEU H H 77 8.240 9.198 -0.958 1
1 773 . 15 1 1 A 77 77 LEU HA H 77 5.080 4.578 0.502 1
1 783 . 15 1 1 A 77 77 LEU CA C 77 53.600 54.204 -0.604 1
1 784 . 15 1 1 A 77 77 LEU CB C 77 44.100 43.282 0.818 1
1 788 . 15 1 1 A 77 77 LEU N N 77 123.800 128.848 -5.048 1
1 789 . 15 1 1 A 78 78 VAL H H 78 9.110 8.572 0.538 1
1 790 . 15 1 1 A 78 78 VAL HA H 78 4.260 4.632 -0.372 1
1 798 . 15 1 1 A 78 78 VAL CA C 78 60.400 61.162 -0.762 1
1 799 . 15 1 1 A 78 78 VAL CB C 78 34.700 35.642 -0.942 1
1 802 . 15 1 1 A 78 78 VAL N N 78 127.100 124.190 2.910 1
1 803 . 15 1 1 A 79 79 LEU H H 79 8.050 8.880 -0.830 1
1 804 . 15 1 1 A 79 79 LEU HA H 79 4.950 4.901 0.049 1
1 813 . 15 1 1 A 79 79 LEU CA C 79 53.800 53.115 0.685 1
1 814 . 15 1 1 A 79 79 LEU CB C 79 42.700 44.533 -1.833 1
1 818 . 15 1 1 A 79 79 LEU N N 79 123.400 128.732 -5.332 1
1 819 . 15 1 1 A 80 80 ARG H H 80 8.540 9.072 -0.532 1
1 820 . 15 1 1 A 80 80 ARG HA H 80 4.170 3.942 0.228 1
1 827 . 15 1 1 A 80 80 ARG CA C 80 55.800 56.936 -1.136 1
1 828 . 15 1 1 A 80 80 ARG CB C 80 31.100 28.781 2.319 1
1 830 . 15 1 1 A 80 80 ARG N N 80 123.500 126.355 -2.855 1
1 831 . 15 1 1 A 81 81 LEU H H 81 8.250 7.699 0.551 1
1 832 . 15 1 1 A 81 81 LEU HA H 81 4.270 4.244 0.026 1
1 842 . 15 1 1 A 81 81 LEU CA C 81 55.000 54.507 0.493 1
1 843 . 15 1 1 A 81 81 LEU CB C 81 42.200 43.308 -1.108 1
1 847 . 15 1 1 A 81 81 LEU N N 81 124.100 118.188 5.912 1
1 848 . 15 1 1 A 82 82 ARG H H 82 8.310 8.943 -0.633 1
1 849 . 15 1 1 A 82 82 ARG HA H 82 4.200 4.434 -0.234 1
1 852 . 15 1 1 A 82 82 ARG CA C 82 56.300 57.416 -1.116 1
1 853 . 15 1 1 A 82 82 ARG CB C 82 30.700 32.976 -2.276 1
1 855 . 15 1 1 A 82 82 ARG N N 82 121.500 121.712 -0.212 1
1 856 . 15 1 1 A 83 83 GLY H H 83 8.410 7.319 1.091 1
1 857 . 15 1 1 A 83 83 GLY HA2 H 83 3.750 3.949 -0.199 1
1 858 . 15 1 1 A 83 83 GLY HA3 H 83 3.754 4.078 -0.324 1
1 859 . 15 1 1 A 83 83 GLY CA C 83 45.100 45.961 -0.861 1
1 860 . 15 1 1 A 83 83 GLY N N 83 110.200 104.123 6.077 1
1 861 . 15 1 1 A 84 84 TYR H H 84 7.950 8.614 -0.664 1
1 862 . 15 1 1 A 84 84 TYR HA H 84 4.400 5.542 -1.142 1
1 865 . 15 1 1 A 84 84 TYR CA C 84 58.100 56.543 1.557 1
1 866 . 15 1 1 A 84 84 TYR CB C 84 38.800 43.223 -4.423 1
1 867 . 15 1 1 A 84 84 TYR N N 84 119.900 120.280 -0.380 1
1 868 . 15 1 1 A 85 85 ALA H H 85 8.150 8.510 -0.360 1
1 869 . 15 1 1 A 85 85 ALA HA H 85 4.150 4.840 -0.690 1
1 873 . 15 1 1 A 85 85 ALA CA C 85 52.600 51.085 1.515 1
1 874 . 15 1 1 A 85 85 ALA CB C 85 19.200 23.137 -3.937 1
1 875 . 15 1 1 A 85 85 ALA N N 85 124.800 121.489 3.311 1
1 876 . 15 1 1 A 86 86 ASP H H 86 8.020 8.499 -0.479 1
1 877 . 15 1 1 A 86 86 ASP HA H 86 4.450 4.610 -0.160 1
1 880 . 15 1 1 A 86 86 ASP CA C 86 54.100 53.356 0.744 1
1 881 . 15 1 1 A 86 86 ASP CB C 86 41.100 41.581 -0.481 1
1 882 . 15 1 1 A 86 86 ASP N N 86 118.900 119.980 -1.080 1
1 883 . 15 1 1 A 87 87 LEU H H 87 8.010 8.579 -0.569 1
1 884 . 15 1 1 A 87 87 LEU HA H 87 4.210 5.174 -0.964 1
1 893 . 15 1 1 A 87 87 LEU CA C 87 55.300 52.611 2.689 1
1 894 . 15 1 1 A 87 87 LEU CB C 87 42.000 45.784 -3.784 1
1 898 . 15 1 1 A 87 87 LEU N N 87 122.400 115.008 7.392 1
1 899 . 15 1 1 A 88 88 ARG H H 88 8.170 9.061 -0.891 1
1 900 . 15 1 1 A 88 88 ARG HA H 88 4.210 4.614 -0.404 1
1 903 . 15 1 1 A 88 88 ARG CA C 88 56.300 56.996 -0.696 1
1 904 . 15 1 1 A 88 88 ARG CB C 88 30.600 32.541 -1.941 1
1 905 . 15 1 1 A 88 88 ARG N N 88 121.200 119.037 2.163 1
1 906 . 15 1 1 A 91 91 PRO HA H 91 4.290 4.757 -0.467 1
1 911 . 15 1 1 A 91 91 PRO CA C 91 63.800 62.783 1.017 1
1 912 . 15 1 1 A 91 91 PRO CB C 91 32.100 31.692 0.408 1
1 915 . 15 1 1 A 92 92 ASP H H 92 8.280 8.877 -0.597 1
1 916 . 15 1 1 A 92 92 ASP HA H 92 4.540 5.096 -0.556 1
1 919 . 15 1 1 A 92 92 ASP CA C 92 54.600 53.626 0.974 1
1 920 . 15 1 1 A 92 92 ASP CB C 92 41.000 44.063 -3.063 1
1 921 . 15 1 1 A 92 92 ASP N N 92 118.700 122.768 -4.068 1
1 922 . 15 1 1 A 93 93 ARG H H 93 7.780 8.586 -0.806 1
1 923 . 15 1 1 A 93 93 ARG HA H 93 4.190 4.919 -0.729 1
1 930 . 15 1 1 A 93 93 ARG CA C 93 56.300 53.992 2.308 1
1 931 . 15 1 1 A 93 93 ARG CB C 93 30.700 34.568 -3.868 1
1 934 . 15 1 1 A 93 93 ARG N N 93 120.700 124.622 -3.922 1
1 935 . 15 1 1 A 94 94 GLN H H 94 8.280 8.453 -0.173 1
1 936 . 15 1 1 A 94 94 GLN HA H 94 4.210 4.956 -0.746 1
1 941 . 15 1 1 A 94 94 GLN CA C 94 55.800 54.748 1.052 1
1 942 . 15 1 1 A 94 94 GLN CB C 94 29.300 31.655 -2.355 1
1 944 . 15 1 1 A 94 94 GLN N N 94 121.000 119.365 1.635 1
1 945 . 15 1 1 A 95 95 ASP H H 95 8.270 8.710 -0.440 1
1 946 . 15 1 1 A 95 95 ASP HA H 95 4.450 5.248 -0.798 1
1 949 . 15 1 1 A 95 95 ASP CA C 95 54.300 54.439 -0.139 1
1 950 . 15 1 1 A 95 95 ASP CB C 95 41.000 43.210 -2.210 1
1 951 . 15 1 1 A 95 95 ASP N N 95 121.000 120.304 0.696 1
1 952 . 15 1 1 A 96 96 HIS H H 96 8.090 8.848 -0.758 1
1 953 . 15 1 1 A 96 96 HIS HA H 96 4.470 5.289 -0.819 1
1 956 . 15 1 1 A 96 96 HIS CA C 96 55.900 55.739 0.161 1
1 957 . 15 1 1 A 96 96 HIS CB C 96 30.500 33.584 -3.084 1
1 958 . 15 1 1 A 96 96 HIS N N 96 119.300 125.204 -5.904 1
1 959 . 15 1 1 A 97 97 HIS H H 97 8.240 8.779 -0.539 1
1 960 . 15 1 1 A 97 97 HIS HA H 97 4.470 4.877 -0.407 1
1 963 . 15 1 1 A 97 97 HIS CA C 97 56.200 53.842 2.358 1
1 964 . 15 1 1 A 97 97 HIS CB C 97 30.400 32.001 -1.601 1
1 965 . 15 1 1 A 97 97 HIS N N 97 121.300 122.976 -1.676 1
1 966 . 15 1 1 A 98 98 PRO HA H 98 4.340 4.240 0.100 1
1 973 . 15 1 1 A 98 98 PRO CA C 98 63.700 62.949 0.751 1
1 974 . 15 1 1 A 98 98 PRO CB C 98 31.900 33.066 -1.166 1
1 977 . 15 1 1 A 99 99 GLY H H 99 8.660 8.250 0.410 1
1 978 . 15 1 1 A 99 99 GLY HA2 H 99 3.920 4.173 -0.253 1
1 979 . 15 1 1 A 99 99 GLY HA3 H 99 3.920 4.180 -0.260 1
1 980 . 15 1 1 A 99 99 GLY CA C 99 45.200 45.349 -0.149 1
1 981 . 15 1 1 A 99 99 GLY N N 99 110.000 109.736 0.264 1
1 982 . 15 1 1 A 100 100 SER H H 100 8.170 8.706 -0.536 1
1 983 . 15 1 1 A 100 100 SER HA H 100 4.360 4.983 -0.623 1
1 986 . 15 1 1 A 100 100 SER CA C 100 58.500 57.590 0.910 1
1 987 . 15 1 1 A 100 100 SER CB C 100 64.000 66.058 -2.058 1
1 988 . 15 1 1 A 100 100 SER N N 100 115.600 115.615 -0.015 1
1 989 . 15 1 1 A 101 101 GLY H H 101 8.420 8.925 -0.505 1
1 990 . 15 1 1 A 101 101 GLY HA2 H 101 3.890 4.268 -0.378 1
1 991 . 15 1 1 A 101 101 GLY HA3 H 101 3.920 4.269 -0.349 1
1 992 . 15 1 1 A 101 101 GLY CA C 101 45.200 44.035 1.165 1
1 993 . 15 1 1 A 101 101 GLY N N 101 111.000 111.130 -0.130 1
1 994 . 15 1 1 A 102 102 ALA H H 102 8.030 8.594 -0.564 1
1 995 . 15 1 1 A 102 102 ALA HA H 102 4.250 4.968 -0.718 1
1 999 . 15 1 1 A 102 102 ALA CA C 102 52.500 51.596 0.904 1
1 1000 . 15 1 1 A 102 102 ALA CB C 102 19.200 22.704 -3.504 1
1 4 . 16 1 1 A 2 2 SER H H 2 8.160 8.328 -0.168 1
1 5 . 16 1 1 A 2 2 SER HA H 2 4.370 4.972 -0.602 1
1 9 . 16 1 1 A 2 2 SER CA C 2 58.300 57.596 0.704 1
1 10 . 16 1 1 A 2 2 SER CB C 2 63.900 67.279 -3.379 1
1 11 . 16 1 1 A 2 2 SER N N 2 115.600 118.150 -2.550 1
1 12 . 16 1 1 A 3 3 LEU H H 3 8.250 8.523 -0.273 1
1 13 . 16 1 1 A 3 3 LEU HA H 3 4.280 5.183 -0.903 1
1 17 . 16 1 1 A 3 3 LEU CA C 3 55.200 52.924 2.276 1
1 18 . 16 1 1 A 3 3 LEU CB C 3 42.100 46.164 -4.064 1
1 19 . 16 1 1 A 3 3 LEU N N 3 124.100 118.411 5.689 1
1 20 . 16 1 1 A 4 4 VAL H H 4 7.950 8.760 -0.810 1
1 21 . 16 1 1 A 4 4 VAL HA H 4 4.680 4.533 0.147 1
1 26 . 16 1 1 A 4 4 VAL CA C 4 59.800 58.747 1.053 1
1 27 . 16 1 1 A 4 4 VAL CB C 4 32.500 33.021 -0.521 1
1 28 . 16 1 1 A 4 4 VAL N N 4 122.600 121.320 1.280 1
1 29 . 16 1 1 A 5 5 PRO CA C 5 63.100 62.443 0.657 1
1 30 . 16 1 1 A 5 5 PRO CB C 5 32.000 30.013 1.987 1
1 32 . 16 1 1 A 6 6 ARG H H 6 8.360 8.431 -0.071 1
1 33 . 16 1 1 A 6 6 ARG HA H 6 4.250 5.060 -0.810 1
1 36 . 16 1 1 A 6 6 ARG CA C 6 56.000 54.750 1.250 1
1 37 . 16 1 1 A 6 6 ARG CB C 6 30.900 32.089 -1.189 1
1 38 . 16 1 1 A 6 6 ARG N N 6 121.800 124.168 -2.368 1
1 39 . 16 1 1 A 7 7 GLY H H 7 8.460 8.390 0.070 1
1 40 . 16 1 1 A 7 7 GLY HA2 H 7 3.940 4.267 -0.327 1
1 41 . 16 1 1 A 7 7 GLY HA3 H 7 3.760 4.268 -0.508 1
1 42 . 16 1 1 A 7 7 GLY CA C 7 45.000 45.496 -0.496 1
1 43 . 16 1 1 A 7 7 GLY N N 7 110.700 110.696 0.004 1
1 44 . 16 1 1 A 8 8 SER H H 8 7.990 8.606 -0.616 1
1 45 . 16 1 1 A 8 8 SER HA H 8 4.450 4.646 -0.196 1
1 48 . 16 1 1 A 8 8 SER CA C 8 58.900 59.382 -0.482 1
1 49 . 16 1 1 A 8 8 SER CB C 8 64.200 65.448 -1.248 1
1 50 . 16 1 1 A 8 8 SER N N 8 115.500 113.780 1.720 1
1 51 . 16 1 1 A 9 9 MET H H 9 9.040 7.717 1.323 1
1 52 . 16 1 1 A 9 9 MET HA H 9 4.610 5.143 -0.533 1
1 60 . 16 1 1 A 9 9 MET CA C 9 54.400 53.514 0.886 1
1 61 . 16 1 1 A 9 9 MET CB C 9 35.400 33.454 1.946 1
1 64 . 16 1 1 A 9 9 MET N N 9 120.500 119.437 1.063 1
1 65 . 16 1 1 A 10 10 GLN H H 10 8.270 8.934 -0.664 1
1 66 . 16 1 1 A 10 10 GLN HA H 10 5.270 5.329 -0.059 1
1 71 . 16 1 1 A 10 10 GLN CA C 10 54.200 54.415 -0.215 1
1 72 . 16 1 1 A 10 10 GLN CB C 10 30.500 32.429 -1.929 1
1 74 . 16 1 1 A 10 10 GLN N N 10 121.000 122.413 -1.413 1
1 75 . 16 1 1 A 11 11 ILE H H 11 8.270 8.773 -0.503 1
1 76 . 16 1 1 A 11 11 ILE HA H 11 4.100 4.806 -0.706 1
1 86 . 16 1 1 A 11 11 ILE CA C 11 59.400 59.212 0.188 1
1 87 . 16 1 1 A 11 11 ILE CB C 11 41.800 40.598 1.202 1
1 91 . 16 1 1 A 11 11 ILE N N 11 114.600 121.425 -6.825 1
1 92 . 16 1 1 A 12 12 PHE H H 12 8.520 8.822 -0.302 1
1 93 . 16 1 1 A 12 12 PHE HA H 12 5.540 5.332 0.208 1
1 96 . 16 1 1 A 12 12 PHE CA C 12 55.000 56.973 -1.973 1
1 97 . 16 1 1 A 12 12 PHE CB C 12 41.200 41.046 0.154 1
1 98 . 16 1 1 A 12 12 PHE N N 12 118.600 123.386 -4.786 1
1 99 . 16 1 1 A 13 13 VAL H H 13 9.230 8.907 0.323 1
1 100 . 16 1 1 A 13 13 VAL HA H 13 4.740 5.298 -0.558 1
1 108 . 16 1 1 A 13 13 VAL CA C 13 60.300 60.556 -0.256 1
1 109 . 16 1 1 A 13 13 VAL CB C 13 34.100 35.155 -1.055 1
1 112 . 16 1 1 A 13 13 VAL N N 13 121.400 123.324 -1.924 1
1 113 . 16 1 1 A 14 14 LYS H H 14 8.910 8.782 0.128 1
1 114 . 16 1 1 A 14 14 LYS HA H 14 5.190 4.840 0.350 1
1 122 . 16 1 1 A 14 14 LYS CA C 14 54.600 54.981 -0.381 1
1 123 . 16 1 1 A 14 14 LYS CB C 14 34.300 34.738 -0.438 1
1 126 . 16 1 1 A 14 14 LYS N N 14 128.000 126.601 1.399 1
1 127 . 16 1 1 A 15 15 THR H H 15 8.650 8.799 -0.149 1
1 128 . 16 1 1 A 15 15 THR HA H 15 4.870 4.697 0.173 1
1 133 . 16 1 1 A 15 15 THR CA C 15 60.300 60.730 -0.430 1
1 134 . 16 1 1 A 15 15 THR CB C 15 70.600 71.320 -0.720 1
1 136 . 16 1 1 A 15 15 THR N N 15 115.300 117.884 -2.584 1
1 137 . 16 1 1 A 16 16 LEU H H 16 9.070 8.689 0.381 1
1 138 . 16 1 1 A 16 16 LEU HA H 16 4.210 4.180 0.030 1
1 148 . 16 1 1 A 16 16 LEU CA C 16 57.400 56.505 0.895 1
1 149 . 16 1 1 A 16 16 LEU CB C 16 41.800 41.784 0.016 1
1 153 . 16 1 1 A 16 16 LEU N N 16 121.400 119.142 2.258 1
1 154 . 16 1 1 A 17 17 THR H H 17 7.560 7.795 -0.235 1
1 155 . 16 1 1 A 17 17 THR HA H 17 4.330 4.433 -0.103 1
1 160 . 16 1 1 A 17 17 THR CA C 17 61.400 63.191 -1.791 1
1 161 . 16 1 1 A 17 17 THR CB C 17 68.900 70.573 -1.673 1
1 163 . 16 1 1 A 17 17 THR N N 17 105.900 113.075 -7.175 1
1 164 . 16 1 1 A 18 18 GLY H H 18 7.750 7.828 -0.078 1
1 165 . 16 1 1 A 18 18 GLY HA2 H 18 4.250 4.028 0.222 1
1 166 . 16 1 1 A 18 18 GLY HA3 H 18 3.520 4.034 -0.514 1
1 167 . 16 1 1 A 18 18 GLY CA C 18 45.300 45.156 0.144 1
1 168 . 16 1 1 A 18 18 GLY N N 18 109.300 109.497 -0.197 1
1 169 . 16 1 1 A 19 19 LYS H H 19 7.210 7.791 -0.581 1
1 170 . 16 1 1 A 19 19 LYS HA H 19 4.260 4.245 0.015 1
1 175 . 16 1 1 A 19 19 LYS CA C 19 56.300 56.709 -0.409 1
1 176 . 16 1 1 A 19 19 LYS CB C 19 33.200 34.016 -0.816 1
1 179 . 16 1 1 A 19 19 LYS N N 19 122.000 120.775 1.225 1
1 180 . 16 1 1 A 20 20 THR H H 20 8.570 8.757 -0.187 1
1 181 . 16 1 1 A 20 20 THR HA H 20 4.950 5.476 -0.526 1
1 186 . 16 1 1 A 20 20 THR CA C 20 62.200 60.282 1.918 1
1 187 . 16 1 1 A 20 20 THR CB C 20 69.700 70.792 -1.092 1
1 189 . 16 1 1 A 20 20 THR N N 20 120.700 112.952 7.748 1
1 190 . 16 1 1 A 21 21 ILE H H 21 9.510 8.832 0.678 1
1 191 . 16 1 1 A 21 21 ILE HA H 21 4.390 4.855 -0.465 1
1 201 . 16 1 1 A 21 21 ILE CA C 21 60.000 59.074 0.926 1
1 202 . 16 1 1 A 21 21 ILE CB C 21 40.700 41.678 -0.978 1
1 206 . 16 1 1 A 21 21 ILE N N 21 128.200 122.827 5.373 1
1 207 . 16 1 1 A 22 22 THR H H 22 8.700 8.660 0.040 1
1 208 . 16 1 1 A 22 22 THR HA H 22 4.860 4.461 0.399 1
1 213 . 16 1 1 A 22 22 THR CA C 22 62.100 62.742 -0.642 1
1 214 . 16 1 1 A 22 22 THR CB C 22 69.500 69.028 0.472 1
1 216 . 16 1 1 A 22 22 THR N N 22 122.300 120.995 1.305 1
1 217 . 16 1 1 A 23 23 LEU H H 23 8.720 8.918 -0.198 1
1 218 . 16 1 1 A 23 23 LEU HA H 23 4.690 5.015 -0.325 1
1 228 . 16 1 1 A 23 23 LEU CA C 23 52.700 53.453 -0.753 1
1 229 . 16 1 1 A 23 23 LEU CB C 23 46.600 45.349 1.251 1
1 233 . 16 1 1 A 23 23 LEU N N 23 125.400 127.148 -1.748 1
1 234 . 16 1 1 A 24 24 GLU H H 24 8.080 8.671 -0.591 1
1 235 . 16 1 1 A 24 24 GLU HA H 24 4.800 4.965 -0.165 1
1 238 . 16 1 1 A 24 24 GLU CA C 24 55.400 55.581 -0.181 1
1 239 . 16 1 1 A 24 24 GLU CB C 24 30.100 31.521 -1.421 1
1 241 . 16 1 1 A 24 24 GLU N N 24 121.800 119.458 2.342 1
1 242 . 16 1 1 A 25 25 VAL H H 25 8.800 8.914 -0.114 1
1 243 . 16 1 1 A 25 25 VAL HA H 25 4.640 4.854 -0.214 1
1 251 . 16 1 1 A 25 25 VAL CA C 25 58.600 59.704 -1.104 1
1 252 . 16 1 1 A 25 25 VAL CB C 25 36.300 34.742 1.558 1
1 255 . 16 1 1 A 25 25 VAL N N 25 116.700 117.335 -0.635 1
1 256 . 16 1 1 A 26 26 GLU H H 26 8.500 8.368 0.132 1
1 257 . 16 1 1 A 26 26 GLU HA H 26 4.900 4.632 0.268 1
1 260 . 16 1 1 A 26 26 GLU CA C 26 53.000 54.242 -1.242 1
1 261 . 16 1 1 A 26 26 GLU CB C 26 31.200 33.132 -1.932 1
1 262 . 16 1 1 A 26 26 GLU N N 26 117.900 121.921 -4.021 1
1 263 . 16 1 1 A 27 27 PRO HA H 27 4.040 4.430 -0.390 1
1 270 . 16 1 1 A 27 27 PRO CA C 27 65.400 64.369 1.031 1
1 271 . 16 1 1 A 27 27 PRO CB C 27 31.700 31.799 -0.099 1
1 274 . 16 1 1 A 28 28 SER H H 28 7.010 8.016 -1.006 1
1 275 . 16 1 1 A 28 28 SER HA H 28 4.280 4.587 -0.307 1
1 278 . 16 1 1 A 28 28 SER CA C 28 57.400 58.803 -1.403 1
1 279 . 16 1 1 A 28 28 SER CB C 28 63.400 64.376 -0.976 1
1 280 . 16 1 1 A 28 28 SER N N 28 103.800 111.640 -7.840 1
1 281 . 16 1 1 A 29 29 ASP H H 29 7.960 7.704 0.256 1
1 282 . 16 1 1 A 29 29 ASP HA H 29 4.600 5.101 -0.501 1
1 285 . 16 1 1 A 29 29 ASP CA C 29 55.900 53.413 2.487 1
1 286 . 16 1 1 A 29 29 ASP CB C 29 41.000 43.130 -2.130 1
1 287 . 16 1 1 A 29 29 ASP N N 29 123.700 121.123 2.577 1
1 288 . 16 1 1 A 30 30 THR H H 30 7.780 8.701 -0.921 1
1 289 . 16 1 1 A 30 30 THR HA H 30 4.850 4.567 0.283 1
1 294 . 16 1 1 A 30 30 THR CA C 30 59.400 60.400 -1.000 1
1 295 . 16 1 1 A 30 30 THR CB C 30 71.100 70.786 0.314 1
1 297 . 16 1 1 A 30 30 THR N N 30 108.800 119.726 -10.926 1
1 298 . 16 1 1 A 31 31 ILE H H 31 8.320 8.935 -0.615 1
1 299 . 16 1 1 A 31 31 ILE HA H 31 3.580 3.730 -0.150 1
1 309 . 16 1 1 A 31 31 ILE CA C 31 62.200 64.680 -2.480 1
1 310 . 16 1 1 A 31 31 ILE CB C 31 34.300 37.469 -3.169 1
1 314 . 16 1 1 A 31 31 ILE N N 31 121.300 127.225 -5.925 1
1 315 . 16 1 1 A 32 32 GLU H H 32 9.850 8.338 1.512 1
1 316 . 16 1 1 A 32 32 GLU HA H 32 3.780 3.915 -0.135 1
1 321 . 16 1 1 A 32 32 GLU CA C 32 60.500 59.949 0.551 1
1 322 . 16 1 1 A 32 32 GLU CB C 32 28.800 29.318 -0.518 1
1 324 . 16 1 1 A 32 32 GLU N N 32 121.600 122.271 -0.671 1
1 325 . 16 1 1 A 33 33 ASN H H 33 7.810 7.677 0.133 1
1 326 . 16 1 1 A 33 33 ASN HA H 33 4.440 4.539 -0.099 1
1 329 . 16 1 1 A 33 33 ASN CA C 33 55.800 55.990 -0.190 1
1 330 . 16 1 1 A 33 33 ASN CB C 33 38.100 38.221 -0.121 1
1 331 . 16 1 1 A 33 33 ASN N N 33 121.000 118.539 2.461 1
1 332 . 16 1 1 A 34 34 VAL H H 34 8.000 8.041 -0.041 1
1 333 . 16 1 1 A 34 34 VAL HA H 34 3.300 3.584 -0.284 1
1 341 . 16 1 1 A 34 34 VAL CA C 34 67.600 66.550 1.050 1
1 342 . 16 1 1 A 34 34 VAL CB C 34 30.700 31.650 -0.950 1
1 345 . 16 1 1 A 34 34 VAL N N 34 122.200 120.517 1.683 1
1 346 . 16 1 1 A 35 35 LYS H H 35 8.490 8.456 0.034 1
1 347 . 16 1 1 A 35 35 LYS HA H 35 4.500 4.080 0.420 1
1 352 . 16 1 1 A 35 35 LYS CA C 35 59.300 58.634 0.666 1
1 353 . 16 1 1 A 35 35 LYS CB C 35 33.500 31.922 1.578 1
1 354 . 16 1 1 A 35 35 LYS N N 35 119.200 120.302 -1.102 1
1 355 . 16 1 1 A 36 36 ALA H H 36 7.880 8.548 -0.668 1
1 356 . 16 1 1 A 36 36 ALA HA H 36 4.060 4.014 0.046 1
1 360 . 16 1 1 A 36 36 ALA CA C 36 55.300 55.415 -0.115 1
1 361 . 16 1 1 A 36 36 ALA CB C 36 17.600 18.213 -0.613 1
1 362 . 16 1 1 A 36 36 ALA N N 36 123.300 122.271 1.029 1
1 363 . 16 1 1 A 37 37 LYS H H 37 7.790 7.953 -0.163 1
1 364 . 16 1 1 A 37 37 LYS HA H 37 4.110 4.070 0.040 1
1 373 . 16 1 1 A 37 37 LYS CA C 37 59.700 59.463 0.237 1
1 374 . 16 1 1 A 37 37 LYS CB C 37 33.100 32.425 0.675 1
1 378 . 16 1 1 A 37 37 LYS N N 37 120.400 117.512 2.888 1
1 379 . 16 1 1 A 38 38 ILE H H 38 8.240 7.584 0.656 1
1 380 . 16 1 1 A 38 38 ILE HA H 38 3.410 3.962 -0.552 1
1 390 . 16 1 1 A 38 38 ILE CA C 38 66.200 62.246 3.954 1
1 391 . 16 1 1 A 38 38 ILE CB C 38 36.800 37.484 -0.684 1
1 395 . 16 1 1 A 38 38 ILE N N 38 121.400 120.085 1.315 1
1 396 . 16 1 1 A 39 39 GLN H H 39 8.460 8.379 0.081 1
1 397 . 16 1 1 A 39 39 GLN HA H 39 3.730 4.006 -0.276 1
1 402 . 16 1 1 A 39 39 GLN CA C 39 60.000 58.736 1.264 1
1 403 . 16 1 1 A 39 39 GLN CB C 39 27.600 28.600 -1.000 1
1 405 . 16 1 1 A 39 39 GLN N N 39 123.500 121.352 2.148 1
1 406 . 16 1 1 A 40 40 ASP H H 40 7.970 7.969 0.001 1
1 407 . 16 1 1 A 40 40 ASP HA H 40 4.240 4.462 -0.222 1
1 410 . 16 1 1 A 40 40 ASP CA C 40 57.400 56.732 0.668 1
1 411 . 16 1 1 A 40 40 ASP CB C 40 41.000 40.494 0.506 1
1 412 . 16 1 1 A 40 40 ASP N N 40 119.900 118.945 0.955 1
1 413 . 16 1 1 A 41 41 LYS H H 41 7.420 7.614 -0.194 1
1 414 . 16 1 1 A 41 41 LYS HA H 41 4.200 4.184 0.016 1
1 423 . 16 1 1 A 41 41 LYS CA C 41 58.200 59.064 -0.864 1
1 424 . 16 1 1 A 41 41 LYS CB C 41 33.900 33.001 0.899 1
1 427 . 16 1 1 A 41 41 LYS N N 41 115.700 119.927 -4.227 1
1 428 . 16 1 1 A 42 42 GLU H H 42 8.650 7.940 0.710 1
1 429 . 16 1 1 A 42 42 GLU HA H 42 4.470 4.552 -0.082 1
1 434 . 16 1 1 A 42 42 GLU CA C 42 55.300 56.056 -0.756 1
1 435 . 16 1 1 A 42 42 GLU CB C 42 33.200 32.031 1.169 1
1 437 . 16 1 1 A 42 42 GLU N N 42 114.200 115.361 -1.161 1
1 438 . 16 1 1 A 43 43 GLY H H 43 8.400 7.919 0.481 1
1 439 . 16 1 1 A 43 43 GLY HA2 H 43 4.040 3.910 0.130 1
1 440 . 16 1 1 A 43 43 GLY HA3 H 43 3.820 3.911 -0.091 1
1 441 . 16 1 1 A 43 43 GLY CA C 43 45.900 45.708 0.192 1
1 442 . 16 1 1 A 43 43 GLY N N 43 109.000 108.779 0.221 1
1 443 . 16 1 1 A 44 44 ILE H H 44 6.080 7.657 -1.577 1
1 444 . 16 1 1 A 44 44 ILE HA H 44 4.290 4.104 0.186 1
1 446 . 16 1 1 A 44 44 ILE CA C 44 57.700 59.401 -1.701 1
1 447 . 16 1 1 A 44 44 ILE CB C 44 40.400 38.532 1.868 1
1 448 . 16 1 1 A 44 44 ILE N N 44 120.500 121.685 -1.185 1
1 449 . 16 1 1 A 46 46 PRO HA H 46 4.030 4.534 -0.504 1
1 454 . 16 1 1 A 46 46 PRO CA C 46 66.100 65.332 0.768 1
1 455 . 16 1 1 A 46 46 PRO CB C 46 32.600 31.947 0.653 1
1 458 . 16 1 1 A 47 47 ASP H H 47 8.470 8.577 -0.107 1
1 459 . 16 1 1 A 47 47 ASP HA H 47 4.310 4.434 -0.124 1
1 462 . 16 1 1 A 47 47 ASP CA C 47 55.700 56.161 -0.461 1
1 463 . 16 1 1 A 47 47 ASP CB C 47 39.700 40.138 -0.438 1
1 464 . 16 1 1 A 47 47 ASP N N 47 113.700 117.040 -3.340 1
1 465 . 16 1 1 A 48 48 GLN H H 48 7.720 7.601 0.119 1
1 466 . 16 1 1 A 48 48 GLN HA H 48 4.340 4.398 -0.058 1
1 471 . 16 1 1 A 48 48 GLN CA C 48 55.500 55.932 -0.432 1
1 472 . 16 1 1 A 48 48 GLN CB C 48 29.900 30.518 -0.618 1
1 474 . 16 1 1 A 48 48 GLN N N 48 116.900 117.530 -0.630 1
1 475 . 16 1 1 A 49 49 GLN H H 49 7.410 7.513 -0.103 1
1 476 . 16 1 1 A 49 49 GLN HA H 49 4.110 4.405 -0.295 1
1 481 . 16 1 1 A 49 49 GLN CA C 49 56.600 55.181 1.419 1
1 482 . 16 1 1 A 49 49 GLN CB C 49 31.300 30.320 0.980 1
1 484 . 16 1 1 A 49 49 GLN N N 49 118.000 118.578 -0.578 1
1 485 . 16 1 1 A 50 50 ARG H H 50 8.400 8.841 -0.441 1
1 486 . 16 1 1 A 50 50 ARG HA H 50 4.380 5.056 -0.676 1
1 491 . 16 1 1 A 50 50 ARG CA C 50 55.100 53.909 1.191 1
1 492 . 16 1 1 A 50 50 ARG CB C 50 31.600 33.010 -1.410 1
1 494 . 16 1 1 A 50 50 ARG N N 50 123.100 119.969 3.131 1
1 495 . 16 1 1 A 51 51 LEU H H 51 8.710 8.228 0.482 1
1 496 . 16 1 1 A 51 51 LEU HA H 51 5.300 5.211 0.089 1
1 506 . 16 1 1 A 51 51 LEU CA C 51 52.900 53.347 -0.447 1
1 507 . 16 1 1 A 51 51 LEU CB C 51 45.700 45.988 -0.288 1
1 511 . 16 1 1 A 51 51 LEU N N 51 124.400 121.357 3.043 1
1 512 . 16 1 1 A 52 52 ILE H H 52 9.060 9.021 0.039 1
1 513 . 16 1 1 A 52 52 ILE HA H 52 4.840 5.198 -0.358 1
1 523 . 16 1 1 A 52 52 ILE CA C 52 58.900 60.184 -1.284 1
1 524 . 16 1 1 A 52 52 ILE CB C 52 41.200 40.724 0.476 1
1 528 . 16 1 1 A 52 52 ILE N N 52 122.500 126.351 -3.851 1
1 529 . 16 1 1 A 53 53 PHE H H 53 8.730 9.577 -0.847 1
1 530 . 16 1 1 A 53 53 PHE HA H 53 5.100 4.830 0.270 1
1 535 . 16 1 1 A 53 53 PHE CA C 53 56.300 57.506 -1.206 1
1 536 . 16 1 1 A 53 53 PHE CB C 53 43.500 41.963 1.537 1
1 537 . 16 1 1 A 53 53 PHE N N 53 124.800 128.080 -3.280 1
1 538 . 16 1 1 A 54 54 ALA H H 54 8.940 9.145 -0.205 1
1 539 . 16 1 1 A 54 54 ALA HA H 54 3.610 3.926 -0.316 1
1 543 . 16 1 1 A 54 54 ALA CA C 54 52.500 53.040 -0.540 1
1 544 . 16 1 1 A 54 54 ALA CB C 54 16.300 17.315 -1.015 1
1 545 . 16 1 1 A 54 54 ALA N N 54 133.100 130.296 2.804 1
1 546 . 16 1 1 A 55 55 GLY H H 55 8.070 8.551 -0.481 1
1 547 . 16 1 1 A 55 55 GLY HA2 H 55 4.000 3.830 0.170 1
1 548 . 16 1 1 A 55 55 GLY HA3 H 55 3.340 3.872 -0.532 1
1 549 . 16 1 1 A 55 55 GLY CA C 55 45.200 45.443 -0.243 1
1 550 . 16 1 1 A 55 55 GLY N N 55 102.500 102.714 -0.214 1
1 551 . 16 1 1 A 56 56 LYS H H 56 7.860 7.843 0.017 1
1 552 . 16 1 1 A 56 56 LYS HA H 56 4.510 4.594 -0.084 1
1 558 . 16 1 1 A 56 56 LYS CA C 56 54.500 54.714 -0.214 1
1 559 . 16 1 1 A 56 56 LYS CB C 56 34.400 33.917 0.483 1
1 561 . 16 1 1 A 56 56 LYS N N 56 121.800 121.842 -0.042 1
1 562 . 16 1 1 A 57 57 GLN H H 57 8.600 8.510 0.090 1
1 563 . 16 1 1 A 57 57 GLN HA H 57 4.410 4.878 -0.468 1
1 568 . 16 1 1 A 57 57 GLN CA C 57 55.900 55.803 0.097 1
1 569 . 16 1 1 A 57 57 GLN CB C 57 28.800 29.340 -0.540 1
1 571 . 16 1 1 A 57 57 GLN N N 57 123.200 123.895 -0.695 1
1 572 . 16 1 1 A 58 58 LEU H H 58 8.480 9.127 -0.647 1
1 573 . 16 1 1 A 58 58 LEU HA H 58 4.060 5.114 -1.054 1
1 583 . 16 1 1 A 58 58 LEU CA C 58 54.100 53.190 0.910 1
1 584 . 16 1 1 A 58 58 LEU CB C 58 41.500 46.373 -4.873 1
1 588 . 16 1 1 A 58 58 LEU N N 58 125.900 123.230 2.670 1
1 589 . 16 1 1 A 59 59 GLU H H 59 8.400 8.579 -0.179 1
1 590 . 16 1 1 A 59 59 GLU HA H 59 4.400 5.031 -0.631 1
1 595 . 16 1 1 A 59 59 GLU CA C 59 55.900 54.326 1.574 1
1 596 . 16 1 1 A 59 59 GLU CB C 59 31.900 33.843 -1.943 1
1 598 . 16 1 1 A 59 59 GLU N N 59 123.100 118.509 4.591 1
1 599 . 16 1 1 A 60 60 ASP H H 60 8.110 8.434 -0.324 1
1 600 . 16 1 1 A 60 60 ASP HA H 60 4.270 5.021 -0.751 1
1 603 . 16 1 1 A 60 60 ASP CA C 60 57.100 52.410 4.690 1
1 604 . 16 1 1 A 60 60 ASP CB C 60 40.800 42.530 -1.730 1
1 605 . 16 1 1 A 60 60 ASP N N 60 120.300 119.538 0.762 1
1 606 . 16 1 1 A 61 61 GLY HA2 H 61 4.000 3.949 0.051 1
1 607 . 16 1 1 A 61 61 GLY HA3 H 61 3.830 3.949 -0.119 1
1 608 . 16 1 1 A 61 61 GLY CA C 61 45.000 45.233 -0.233 1
1 609 . 16 1 1 A 62 62 ARG H H 62 7.350 7.605 -0.255 1
1 610 . 16 1 1 A 62 62 ARG HA H 62 4.640 4.838 -0.198 1
1 615 . 16 1 1 A 62 62 ARG CA C 62 54.400 53.817 0.583 1
1 616 . 16 1 1 A 62 62 ARG CB C 62 32.600 33.516 -0.916 1
1 618 . 16 1 1 A 62 62 ARG N N 62 119.300 120.157 -0.857 1
1 619 . 16 1 1 A 63 63 THR H H 63 8.460 8.807 -0.347 1
1 620 . 16 1 1 A 63 63 THR HA H 63 5.060 4.574 0.486 1
1 625 . 16 1 1 A 63 63 THR CA C 63 59.700 60.816 -1.116 1
1 626 . 16 1 1 A 63 63 THR CB C 63 72.000 71.275 0.725 1
1 628 . 16 1 1 A 63 63 THR N N 63 109.100 112.479 -3.379 1
1 629 . 16 1 1 A 64 64 LEU H H 64 8.190 8.757 -0.567 1
1 630 . 16 1 1 A 64 64 LEU HA H 64 3.920 3.935 -0.015 1
1 640 . 16 1 1 A 64 64 LEU CA C 64 58.400 58.009 0.391 1
1 641 . 16 1 1 A 64 64 LEU CB C 64 40.200 41.165 -0.965 1
1 645 . 16 1 1 A 64 64 LEU N N 64 118.100 123.052 -4.952 1
1 646 . 16 1 1 A 65 65 SER H H 65 8.370 7.681 0.689 1
1 647 . 16 1 1 A 65 65 SER HA H 65 4.150 4.166 -0.016 1
1 650 . 16 1 1 A 65 65 SER CA C 65 60.900 60.050 0.850 1
1 651 . 16 1 1 A 65 65 SER CB C 65 62.500 63.879 -1.379 1
1 652 . 16 1 1 A 65 65 SER N N 65 112.200 114.471 -2.271 1
1 653 . 16 1 1 A 66 66 GLU H H 66 7.780 7.561 0.219 1
1 654 . 16 1 1 A 66 66 GLU HA H 66 3.890 4.188 -0.298 1
1 659 . 16 1 1 A 66 66 GLU CA C 66 59.200 58.840 0.360 1
1 660 . 16 1 1 A 66 66 GLU CB C 66 29.400 29.706 -0.306 1
1 662 . 16 1 1 A 66 66 GLU N N 66 123.600 121.904 1.696 1
1 663 . 16 1 1 A 67 67 TYR H H 67 7.290 7.570 -0.280 1
1 664 . 16 1 1 A 67 67 TYR HA H 67 4.590 4.641 -0.051 1
1 669 . 16 1 1 A 67 67 TYR CA C 67 58.400 57.437 0.963 1
1 670 . 16 1 1 A 67 67 TYR CB C 67 39.800 38.587 1.213 1
1 671 . 16 1 1 A 67 67 TYR N N 67 116.400 117.242 -0.842 1
1 672 . 16 1 1 A 68 68 ASN H H 68 8.040 7.795 0.245 1
1 673 . 16 1 1 A 68 68 ASN HA H 68 4.240 4.268 -0.028 1
1 676 . 16 1 1 A 68 68 ASN CA C 68 54.100 54.537 -0.437 1
1 677 . 16 1 1 A 68 68 ASN CB C 68 37.200 36.704 0.496 1
1 678 . 16 1 1 A 68 68 ASN N N 68 115.600 114.859 0.741 1
1 679 . 16 1 1 A 69 69 ILE H H 69 7.200 7.489 -0.289 1
1 680 . 16 1 1 A 69 69 ILE HA H 69 3.280 4.807 -1.527 1
1 690 . 16 1 1 A 69 69 ILE CA C 69 59.800 59.031 0.769 1
1 691 . 16 1 1 A 69 69 ILE CB C 69 36.600 40.408 -3.808 1
1 695 . 16 1 1 A 69 69 ILE N N 69 119.100 113.974 5.126 1
1 696 . 16 1 1 A 70 70 GLN H H 70 7.570 8.732 -1.162 1
1 697 . 16 1 1 A 70 70 GLN HA H 70 4.410 4.488 -0.078 1
1 702 . 16 1 1 A 70 70 GLN CA C 70 53.500 55.345 -1.845 1
1 703 . 16 1 1 A 70 70 GLN CB C 70 31.500 28.551 2.949 1
1 705 . 16 1 1 A 70 70 GLN N N 70 124.800 121.021 3.779 1
1 706 . 16 1 1 A 71 71 LYS H H 71 8.370 7.284 1.086 1
1 707 . 16 1 1 A 71 71 LYS HA H 71 3.870 3.492 0.378 1
1 716 . 16 1 1 A 71 71 LYS CA C 71 58.000 58.407 -0.407 1
1 717 . 16 1 1 A 71 71 LYS CB C 71 32.500 31.977 0.523 1
1 720 . 16 1 1 A 71 71 LYS N N 71 120.200 120.764 -0.564 1
1 721 . 16 1 1 A 72 72 GLU H H 72 9.230 7.648 1.582 1
1 722 . 16 1 1 A 72 72 GLU HA H 72 3.240 4.344 -1.104 1
1 727 . 16 1 1 A 72 72 GLU CA C 72 58.300 55.319 2.981 1
1 728 . 16 1 1 A 72 72 GLU CB C 72 26.000 28.007 -2.007 1
1 730 . 16 1 1 A 72 72 GLU N N 72 115.100 119.085 -3.985 1
1 731 . 16 1 1 A 73 73 SER H H 73 7.690 8.372 -0.682 1
1 732 . 16 1 1 A 73 73 SER HA H 73 4.520 4.702 -0.182 1
1 735 . 16 1 1 A 73 73 SER CA C 73 61.100 59.242 1.858 1
1 736 . 16 1 1 A 73 73 SER CB C 73 64.800 64.229 0.571 1
1 737 . 16 1 1 A 73 73 SER N N 73 115.300 119.622 -4.322 1
1 738 . 16 1 1 A 74 74 THR H H 74 8.620 7.958 0.662 1
1 739 . 16 1 1 A 74 74 THR HA H 74 5.200 5.060 0.140 1
1 744 . 16 1 1 A 74 74 THR CA C 74 62.400 61.748 0.652 1
1 745 . 16 1 1 A 74 74 THR CB C 74 70.200 70.830 -0.630 1
1 747 . 16 1 1 A 74 74 THR N N 74 117.500 112.423 5.077 1
1 748 . 16 1 1 A 75 75 LEU H H 75 9.350 9.027 0.323 1
1 749 . 16 1 1 A 75 75 LEU HA H 75 4.990 4.806 0.184 1
1 759 . 16 1 1 A 75 75 LEU CA C 75 53.800 53.693 0.107 1
1 760 . 16 1 1 A 75 75 LEU CB C 75 44.400 45.843 -1.443 1
1 764 . 16 1 1 A 75 75 LEU N N 75 128.000 126.338 1.662 1
1 765 . 16 1 1 A 76 76 HIS H H 76 9.140 8.445 0.695 1
1 766 . 16 1 1 A 76 76 HIS HA H 76 5.040 5.131 -0.091 1
1 769 . 16 1 1 A 76 76 HIS CA C 76 56.200 54.516 1.684 1
1 770 . 16 1 1 A 76 76 HIS CB C 76 32.500 31.833 0.667 1
1 771 . 16 1 1 A 76 76 HIS N N 76 119.600 120.697 -1.097 1
1 772 . 16 1 1 A 77 77 LEU H H 77 8.240 8.942 -0.702 1
1 773 . 16 1 1 A 77 77 LEU HA H 77 5.080 5.174 -0.094 1
1 783 . 16 1 1 A 77 77 LEU CA C 77 53.600 53.815 -0.215 1
1 784 . 16 1 1 A 77 77 LEU CB C 77 44.100 43.653 0.447 1
1 788 . 16 1 1 A 77 77 LEU N N 77 123.800 121.142 2.658 1
1 789 . 16 1 1 A 78 78 VAL H H 78 9.110 8.848 0.262 1
1 790 . 16 1 1 A 78 78 VAL HA H 78 4.260 4.651 -0.391 1
1 798 . 16 1 1 A 78 78 VAL CA C 78 60.400 60.924 -0.524 1
1 799 . 16 1 1 A 78 78 VAL CB C 78 34.700 35.827 -1.127 1
1 802 . 16 1 1 A 78 78 VAL N N 78 127.100 124.472 2.628 1
1 803 . 16 1 1 A 79 79 LEU H H 79 8.050 8.920 -0.870 1
1 804 . 16 1 1 A 79 79 LEU HA H 79 4.950 4.926 0.024 1
1 813 . 16 1 1 A 79 79 LEU CA C 79 53.800 53.170 0.630 1
1 814 . 16 1 1 A 79 79 LEU CB C 79 42.700 44.308 -1.608 1
1 818 . 16 1 1 A 79 79 LEU N N 79 123.400 128.855 -5.455 1
1 819 . 16 1 1 A 80 80 ARG H H 80 8.540 9.082 -0.542 1
1 820 . 16 1 1 A 80 80 ARG HA H 80 4.170 3.955 0.215 1
1 827 . 16 1 1 A 80 80 ARG CA C 80 55.800 56.953 -1.153 1
1 828 . 16 1 1 A 80 80 ARG CB C 80 31.100 28.796 2.304 1
1 830 . 16 1 1 A 80 80 ARG N N 80 123.500 126.261 -2.761 1
1 831 . 16 1 1 A 81 81 LEU H H 81 8.250 7.723 0.527 1
1 832 . 16 1 1 A 81 81 LEU HA H 81 4.270 4.308 -0.038 1
1 842 . 16 1 1 A 81 81 LEU CA C 81 55.000 54.554 0.446 1
1 843 . 16 1 1 A 81 81 LEU CB C 81 42.200 43.253 -1.053 1
1 847 . 16 1 1 A 81 81 LEU N N 81 124.100 119.712 4.388 1
1 848 . 16 1 1 A 82 82 ARG H H 82 8.310 8.939 -0.629 1
1 849 . 16 1 1 A 82 82 ARG HA H 82 4.200 4.497 -0.297 1
1 852 . 16 1 1 A 82 82 ARG CA C 82 56.300 57.425 -1.125 1
1 853 . 16 1 1 A 82 82 ARG CB C 82 30.700 33.039 -2.339 1
1 855 . 16 1 1 A 82 82 ARG N N 82 121.500 121.663 -0.163 1
1 856 . 16 1 1 A 83 83 GLY H H 83 8.410 7.704 0.706 1
1 857 . 16 1 1 A 83 83 GLY HA2 H 83 3.750 4.076 -0.326 1
1 858 . 16 1 1 A 83 83 GLY HA3 H 83 3.754 4.077 -0.323 1
1 859 . 16 1 1 A 83 83 GLY CA C 83 45.100 44.939 0.161 1
1 860 . 16 1 1 A 83 83 GLY N N 83 110.200 106.132 4.068 1
1 861 . 16 1 1 A 84 84 TYR H H 84 7.950 8.609 -0.659 1
1 862 . 16 1 1 A 84 84 TYR HA H 84 4.400 5.075 -0.675 1
1 865 . 16 1 1 A 84 84 TYR CA C 84 58.100 58.163 -0.063 1
1 866 . 16 1 1 A 84 84 TYR CB C 84 38.800 41.465 -2.665 1
1 867 . 16 1 1 A 84 84 TYR N N 84 119.900 124.441 -4.541 1
1 868 . 16 1 1 A 85 85 ALA H H 85 8.150 7.854 0.296 1
1 869 . 16 1 1 A 85 85 ALA HA H 85 4.150 4.926 -0.776 1
1 873 . 16 1 1 A 85 85 ALA CA C 85 52.600 51.295 1.305 1
1 874 . 16 1 1 A 85 85 ALA CB C 85 19.200 23.503 -4.303 1
1 875 . 16 1 1 A 85 85 ALA N N 85 124.800 126.769 -1.969 1
1 876 . 16 1 1 A 86 86 ASP H H 86 8.020 8.421 -0.401 1
1 877 . 16 1 1 A 86 86 ASP HA H 86 4.450 5.102 -0.652 1
1 880 . 16 1 1 A 86 86 ASP CA C 86 54.100 53.143 0.957 1
1 881 . 16 1 1 A 86 86 ASP CB C 86 41.100 44.647 -3.547 1
1 882 . 16 1 1 A 86 86 ASP N N 86 118.900 116.091 2.809 1
1 883 . 16 1 1 A 87 87 LEU H H 87 8.010 8.500 -0.490 1
1 884 . 16 1 1 A 87 87 LEU HA H 87 4.210 4.448 -0.238 1
1 893 . 16 1 1 A 87 87 LEU CA C 87 55.300 55.020 0.280 1
1 894 . 16 1 1 A 87 87 LEU CB C 87 42.000 40.882 1.118 1
1 898 . 16 1 1 A 87 87 LEU N N 87 122.400 124.799 -2.399 1
1 899 . 16 1 1 A 88 88 ARG H H 88 8.170 8.413 -0.243 1
1 900 . 16 1 1 A 88 88 ARG HA H 88 4.210 4.616 -0.406 1
1 903 . 16 1 1 A 88 88 ARG CA C 88 56.300 55.708 0.592 1
1 904 . 16 1 1 A 88 88 ARG CB C 88 30.600 33.892 -3.292 1
1 905 . 16 1 1 A 88 88 ARG N N 88 121.200 124.614 -3.414 1
1 906 . 16 1 1 A 91 91 PRO HA H 91 4.290 4.474 -0.184 1
1 911 . 16 1 1 A 91 91 PRO CA C 91 63.800 64.428 -0.628 1
1 912 . 16 1 1 A 91 91 PRO CB C 91 32.100 32.263 -0.163 1
1 915 . 16 1 1 A 92 92 ASP H H 92 8.280 7.486 0.794 1
1 916 . 16 1 1 A 92 92 ASP HA H 92 4.540 5.046 -0.506 1
1 919 . 16 1 1 A 92 92 ASP CA C 92 54.600 53.768 0.832 1
1 920 . 16 1 1 A 92 92 ASP CB C 92 41.000 43.413 -2.413 1
1 921 . 16 1 1 A 92 92 ASP N N 92 118.700 112.853 5.847 1
1 922 . 16 1 1 A 93 93 ARG H H 93 7.780 9.001 -1.221 1
1 923 . 16 1 1 A 93 93 ARG HA H 93 4.190 5.221 -1.031 1
1 930 . 16 1 1 A 93 93 ARG CA C 93 56.300 53.942 2.358 1
1 931 . 16 1 1 A 93 93 ARG CB C 93 30.700 33.354 -2.654 1
1 934 . 16 1 1 A 93 93 ARG N N 93 120.700 121.652 -0.952 1
1 935 . 16 1 1 A 94 94 GLN H H 94 8.280 8.684 -0.404 1
1 936 . 16 1 1 A 94 94 GLN HA H 94 4.210 5.018 -0.808 1
1 941 . 16 1 1 A 94 94 GLN CA C 94 55.800 53.426 2.374 1
1 942 . 16 1 1 A 94 94 GLN CB C 94 29.300 30.717 -1.417 1
1 944 . 16 1 1 A 94 94 GLN N N 94 121.000 116.285 4.715 1
1 945 . 16 1 1 A 95 95 ASP H H 95 8.270 8.539 -0.269 1
1 946 . 16 1 1 A 95 95 ASP HA H 95 4.450 4.802 -0.352 1
1 949 . 16 1 1 A 95 95 ASP CA C 95 54.300 53.862 0.438 1
1 950 . 16 1 1 A 95 95 ASP CB C 95 41.000 42.061 -1.061 1
1 951 . 16 1 1 A 95 95 ASP N N 95 121.000 121.335 -0.335 1
1 952 . 16 1 1 A 96 96 HIS H H 96 8.090 9.087 -0.997 1
1 953 . 16 1 1 A 96 96 HIS HA H 96 4.470 5.470 -1.000 1
1 956 . 16 1 1 A 96 96 HIS CA C 96 55.900 54.042 1.858 1
1 957 . 16 1 1 A 96 96 HIS CB C 96 30.500 34.119 -3.619 1
1 958 . 16 1 1 A 96 96 HIS N N 96 119.300 121.647 -2.347 1
1 959 . 16 1 1 A 97 97 HIS H H 97 8.240 8.727 -0.487 1
1 960 . 16 1 1 A 97 97 HIS HA H 97 4.470 5.087 -0.617 1
1 963 . 16 1 1 A 97 97 HIS CA C 97 56.200 52.881 3.319 1
1 964 . 16 1 1 A 97 97 HIS CB C 97 30.400 29.512 0.888 1
1 965 . 16 1 1 A 97 97 HIS N N 97 121.300 117.047 4.253 1
1 966 . 16 1 1 A 98 98 PRO HA H 98 4.340 4.427 -0.087 1
1 973 . 16 1 1 A 98 98 PRO CA C 98 63.700 62.392 1.308 1
1 974 . 16 1 1 A 98 98 PRO CB C 98 31.900 33.423 -1.523 1
1 977 . 16 1 1 A 99 99 GLY H H 99 8.660 8.386 0.274 1
1 978 . 16 1 1 A 99 99 GLY HA2 H 99 3.920 4.298 -0.378 1
1 979 . 16 1 1 A 99 99 GLY HA3 H 99 3.920 4.305 -0.385 1
1 980 . 16 1 1 A 99 99 GLY CA C 99 45.200 45.331 -0.131 1
1 981 . 16 1 1 A 99 99 GLY N N 99 110.000 107.159 2.841 1
1 982 . 16 1 1 A 100 100 SER H H 100 8.170 8.625 -0.455 1
1 983 . 16 1 1 A 100 100 SER HA H 100 4.360 5.046 -0.686 1
1 986 . 16 1 1 A 100 100 SER CA C 100 58.500 57.478 1.022 1
1 987 . 16 1 1 A 100 100 SER CB C 100 64.000 65.690 -1.690 1
1 988 . 16 1 1 A 100 100 SER N N 100 115.600 115.703 -0.103 1
1 989 . 16 1 1 A 101 101 GLY H H 101 8.420 8.666 -0.246 1
1 990 . 16 1 1 A 101 101 GLY HA2 H 101 3.890 4.187 -0.297 1
1 991 . 16 1 1 A 101 101 GLY HA3 H 101 3.920 4.188 -0.268 1
1 992 . 16 1 1 A 101 101 GLY CA C 101 45.200 44.294 0.906 1
1 993 . 16 1 1 A 101 101 GLY N N 101 111.000 108.104 2.896 1
1 994 . 16 1 1 A 102 102 ALA H H 102 8.030 8.406 -0.376 1
1 995 . 16 1 1 A 102 102 ALA HA H 102 4.250 4.876 -0.626 1
1 999 . 16 1 1 A 102 102 ALA CA C 102 52.500 51.369 1.131 1
1 1000 . 16 1 1 A 102 102 ALA CB C 102 19.200 22.843 -3.643 1
1 4 . 17 1 1 A 2 2 SER H H 2 8.160 8.687 -0.527 1
1 5 . 17 1 1 A 2 2 SER HA H 2 4.370 4.311 0.059 1
1 9 . 17 1 1 A 2 2 SER CA C 2 58.300 60.480 -2.180 1
1 10 . 17 1 1 A 2 2 SER CB C 2 63.900 63.299 0.601 1
1 11 . 17 1 1 A 2 2 SER N N 2 115.600 118.209 -2.609 1
1 12 . 17 1 1 A 3 3 LEU H H 3 8.250 7.686 0.564 1
1 13 . 17 1 1 A 3 3 LEU HA H 3 4.280 5.059 -0.779 1
1 17 . 17 1 1 A 3 3 LEU CA C 3 55.200 52.829 2.371 1
1 18 . 17 1 1 A 3 3 LEU CB C 3 42.100 45.820 -3.720 1
1 19 . 17 1 1 A 3 3 LEU N N 3 124.100 118.245 5.855 1
1 20 . 17 1 1 A 4 4 VAL H H 4 7.950 8.649 -0.699 1
1 21 . 17 1 1 A 4 4 VAL HA H 4 4.680 4.614 0.066 1
1 26 . 17 1 1 A 4 4 VAL CA C 4 59.800 59.152 0.648 1
1 27 . 17 1 1 A 4 4 VAL CB C 4 32.500 33.084 -0.584 1
1 28 . 17 1 1 A 4 4 VAL N N 4 122.600 115.604 6.996 1
1 29 . 17 1 1 A 5 5 PRO CA C 5 63.100 62.766 0.334 1
1 30 . 17 1 1 A 5 5 PRO CB C 5 32.000 31.930 0.070 1
1 32 . 17 1 1 A 6 6 ARG H H 6 8.360 8.564 -0.204 1
1 33 . 17 1 1 A 6 6 ARG HA H 6 4.250 4.596 -0.346 1
1 36 . 17 1 1 A 6 6 ARG CA C 6 56.000 55.469 0.531 1
1 37 . 17 1 1 A 6 6 ARG CB C 6 30.900 30.142 0.758 1
1 38 . 17 1 1 A 6 6 ARG N N 6 121.800 122.141 -0.341 1
1 39 . 17 1 1 A 7 7 GLY H H 7 8.460 7.350 1.110 1
1 40 . 17 1 1 A 7 7 GLY HA2 H 7 3.940 4.131 -0.191 1
1 41 . 17 1 1 A 7 7 GLY HA3 H 7 3.760 4.137 -0.377 1
1 42 . 17 1 1 A 7 7 GLY CA C 7 45.000 45.584 -0.584 1
1 43 . 17 1 1 A 7 7 GLY N N 7 110.700 110.160 0.540 1
1 44 . 17 1 1 A 8 8 SER H H 8 7.990 8.434 -0.444 1
1 45 . 17 1 1 A 8 8 SER HA H 8 4.450 4.744 -0.294 1
1 48 . 17 1 1 A 8 8 SER CA C 8 58.900 58.032 0.868 1
1 49 . 17 1 1 A 8 8 SER CB C 8 64.200 63.492 0.708 1
1 50 . 17 1 1 A 8 8 SER N N 8 115.500 115.912 -0.412 1
1 51 . 17 1 1 A 9 9 MET H H 9 9.040 7.582 1.458 1
1 52 . 17 1 1 A 9 9 MET HA H 9 4.610 5.078 -0.468 1
1 60 . 17 1 1 A 9 9 MET CA C 9 54.400 53.498 0.902 1
1 61 . 17 1 1 A 9 9 MET CB C 9 35.400 34.430 0.970 1
1 64 . 17 1 1 A 9 9 MET N N 9 120.500 121.305 -0.805 1
1 65 . 17 1 1 A 10 10 GLN H H 10 8.270 8.970 -0.700 1
1 66 . 17 1 1 A 10 10 GLN HA H 10 5.270 5.347 -0.077 1
1 71 . 17 1 1 A 10 10 GLN CA C 10 54.200 54.417 -0.217 1
1 72 . 17 1 1 A 10 10 GLN CB C 10 30.500 32.490 -1.990 1
1 74 . 17 1 1 A 10 10 GLN N N 10 121.000 122.396 -1.396 1
1 75 . 17 1 1 A 11 11 ILE H H 11 8.270 8.831 -0.561 1
1 76 . 17 1 1 A 11 11 ILE HA H 11 4.100 4.908 -0.808 1
1 86 . 17 1 1 A 11 11 ILE CA C 11 59.400 59.124 0.276 1
1 87 . 17 1 1 A 11 11 ILE CB C 11 41.800 41.250 0.550 1
1 91 . 17 1 1 A 11 11 ILE N N 11 114.600 121.570 -6.970 1
1 92 . 17 1 1 A 12 12 PHE H H 12 8.520 8.890 -0.370 1
1 93 . 17 1 1 A 12 12 PHE HA H 12 5.540 5.433 0.107 1
1 96 . 17 1 1 A 12 12 PHE CA C 12 55.000 56.313 -1.313 1
1 97 . 17 1 1 A 12 12 PHE CB C 12 41.200 41.183 0.017 1
1 98 . 17 1 1 A 12 12 PHE N N 12 118.600 125.193 -6.593 1
1 99 . 17 1 1 A 13 13 VAL H H 13 9.230 8.754 0.476 1
1 100 . 17 1 1 A 13 13 VAL HA H 13 4.740 5.287 -0.547 1
1 108 . 17 1 1 A 13 13 VAL CA C 13 60.300 60.020 0.280 1
1 109 . 17 1 1 A 13 13 VAL CB C 13 34.100 35.004 -0.904 1
1 112 . 17 1 1 A 13 13 VAL N N 13 121.400 124.374 -2.974 1
1 113 . 17 1 1 A 14 14 LYS H H 14 8.910 8.250 0.660 1
1 114 . 17 1 1 A 14 14 LYS HA H 14 5.190 4.570 0.620 1
1 122 . 17 1 1 A 14 14 LYS CA C 14 54.600 55.231 -0.631 1
1 123 . 17 1 1 A 14 14 LYS CB C 14 34.300 33.651 0.649 1
1 126 . 17 1 1 A 14 14 LYS N N 14 128.000 127.801 0.199 1
1 127 . 17 1 1 A 15 15 THR H H 15 8.650 8.595 0.055 1
1 128 . 17 1 1 A 15 15 THR HA H 15 4.870 4.645 0.225 1
1 133 . 17 1 1 A 15 15 THR CA C 15 60.300 60.804 -0.504 1
1 134 . 17 1 1 A 15 15 THR CB C 15 70.600 71.375 -0.775 1
1 136 . 17 1 1 A 15 15 THR N N 15 115.300 116.246 -0.946 1
1 137 . 17 1 1 A 16 16 LEU H H 16 9.070 8.810 0.260 1
1 138 . 17 1 1 A 16 16 LEU HA H 16 4.210 4.054 0.156 1
1 148 . 17 1 1 A 16 16 LEU CA C 16 57.400 57.493 -0.093 1
1 149 . 17 1 1 A 16 16 LEU CB C 16 41.800 41.710 0.090 1
1 153 . 17 1 1 A 16 16 LEU N N 16 121.400 122.276 -0.876 1
1 154 . 17 1 1 A 17 17 THR H H 17 7.560 7.836 -0.276 1
1 155 . 17 1 1 A 17 17 THR HA H 17 4.330 4.317 0.013 1
1 160 . 17 1 1 A 17 17 THR CA C 17 61.400 63.605 -2.205 1
1 161 . 17 1 1 A 17 17 THR CB C 17 68.900 70.041 -1.141 1
1 163 . 17 1 1 A 17 17 THR N N 17 105.900 112.534 -6.634 1
1 164 . 17 1 1 A 18 18 GLY H H 18 7.750 7.919 -0.169 1
1 165 . 17 1 1 A 18 18 GLY HA2 H 18 4.250 3.998 0.252 1
1 166 . 17 1 1 A 18 18 GLY HA3 H 18 3.520 4.013 -0.493 1
1 167 . 17 1 1 A 18 18 GLY CA C 18 45.300 45.122 0.178 1
1 168 . 17 1 1 A 18 18 GLY N N 18 109.300 109.188 0.112 1
1 169 . 17 1 1 A 19 19 LYS H H 19 7.210 7.682 -0.472 1
1 170 . 17 1 1 A 19 19 LYS HA H 19 4.260 4.246 0.014 1
1 175 . 17 1 1 A 19 19 LYS CA C 19 56.300 56.796 -0.496 1
1 176 . 17 1 1 A 19 19 LYS CB C 19 33.200 33.779 -0.579 1
1 179 . 17 1 1 A 19 19 LYS N N 19 122.000 120.602 1.398 1
1 180 . 17 1 1 A 20 20 THR H H 20 8.570 8.746 -0.176 1
1 181 . 17 1 1 A 20 20 THR HA H 20 4.950 5.323 -0.373 1
1 186 . 17 1 1 A 20 20 THR CA C 20 62.200 60.202 1.998 1
1 187 . 17 1 1 A 20 20 THR CB C 20 69.700 70.815 -1.115 1
1 189 . 17 1 1 A 20 20 THR N N 20 120.700 112.587 8.113 1
1 190 . 17 1 1 A 21 21 ILE H H 21 9.510 8.836 0.674 1
1 191 . 17 1 1 A 21 21 ILE HA H 21 4.390 4.849 -0.459 1
1 201 . 17 1 1 A 21 21 ILE CA C 21 60.000 59.073 0.927 1
1 202 . 17 1 1 A 21 21 ILE CB C 21 40.700 41.706 -1.006 1
1 206 . 17 1 1 A 21 21 ILE N N 21 128.200 122.772 5.428 1
1 207 . 17 1 1 A 22 22 THR H H 22 8.700 8.823 -0.123 1
1 208 . 17 1 1 A 22 22 THR HA H 22 4.860 4.439 0.421 1
1 213 . 17 1 1 A 22 22 THR CA C 22 62.100 63.050 -0.950 1
1 214 . 17 1 1 A 22 22 THR CB C 22 69.500 68.980 0.520 1
1 216 . 17 1 1 A 22 22 THR N N 22 122.300 121.327 0.973 1
1 217 . 17 1 1 A 23 23 LEU H H 23 8.720 8.942 -0.222 1
1 218 . 17 1 1 A 23 23 LEU HA H 23 4.690 4.977 -0.287 1
1 228 . 17 1 1 A 23 23 LEU CA C 23 52.700 53.575 -0.875 1
1 229 . 17 1 1 A 23 23 LEU CB C 23 46.600 45.523 1.077 1
1 233 . 17 1 1 A 23 23 LEU N N 23 125.400 127.441 -2.041 1
1 234 . 17 1 1 A 24 24 GLU H H 24 8.080 8.814 -0.734 1
1 235 . 17 1 1 A 24 24 GLU HA H 24 4.800 4.965 -0.165 1
1 238 . 17 1 1 A 24 24 GLU CA C 24 55.400 55.278 0.122 1
1 239 . 17 1 1 A 24 24 GLU CB C 24 30.100 31.754 -1.654 1
1 241 . 17 1 1 A 24 24 GLU N N 24 121.800 121.320 0.480 1
1 242 . 17 1 1 A 25 25 VAL H H 25 8.800 8.584 0.216 1
1 243 . 17 1 1 A 25 25 VAL HA H 25 4.640 4.946 -0.306 1
1 251 . 17 1 1 A 25 25 VAL CA C 25 58.600 60.379 -1.779 1
1 252 . 17 1 1 A 25 25 VAL CB C 25 36.300 35.242 1.058 1
1 255 . 17 1 1 A 25 25 VAL N N 25 116.700 125.518 -8.818 1
1 256 . 17 1 1 A 26 26 GLU H H 26 8.500 8.357 0.143 1
1 257 . 17 1 1 A 26 26 GLU HA H 26 4.900 4.593 0.307 1
1 260 . 17 1 1 A 26 26 GLU CA C 26 53.000 54.557 -1.557 1
1 261 . 17 1 1 A 26 26 GLU CB C 26 31.200 33.456 -2.256 1
1 262 . 17 1 1 A 26 26 GLU N N 26 117.900 124.463 -6.563 1
1 263 . 17 1 1 A 27 27 PRO HA H 27 4.040 4.385 -0.345 1
1 270 . 17 1 1 A 27 27 PRO CA C 27 65.400 64.598 0.802 1
1 271 . 17 1 1 A 27 27 PRO CB C 27 31.700 31.921 -0.221 1
1 274 . 17 1 1 A 28 28 SER H H 28 7.010 8.072 -1.062 1
1 275 . 17 1 1 A 28 28 SER HA H 28 4.280 4.450 -0.170 1
1 278 . 17 1 1 A 28 28 SER CA C 28 57.400 58.316 -0.916 1
1 279 . 17 1 1 A 28 28 SER CB C 28 63.400 64.019 -0.619 1
1 280 . 17 1 1 A 28 28 SER N N 28 103.800 110.288 -6.488 1
1 281 . 17 1 1 A 29 29 ASP H H 29 7.960 7.747 0.213 1
1 282 . 17 1 1 A 29 29 ASP HA H 29 4.600 4.899 -0.299 1
1 285 . 17 1 1 A 29 29 ASP CA C 29 55.900 53.428 2.472 1
1 286 . 17 1 1 A 29 29 ASP CB C 29 41.000 41.701 -0.701 1
1 287 . 17 1 1 A 29 29 ASP N N 29 123.700 121.632 2.068 1
1 288 . 17 1 1 A 30 30 THR H H 30 7.780 8.890 -1.110 1
1 289 . 17 1 1 A 30 30 THR HA H 30 4.850 4.578 0.272 1
1 294 . 17 1 1 A 30 30 THR CA C 30 59.400 61.053 -1.653 1
1 295 . 17 1 1 A 30 30 THR CB C 30 71.100 70.227 0.873 1
1 297 . 17 1 1 A 30 30 THR N N 30 108.800 118.686 -9.886 1
1 298 . 17 1 1 A 31 31 ILE H H 31 8.320 8.952 -0.632 1
1 299 . 17 1 1 A 31 31 ILE HA H 31 3.580 3.778 -0.198 1
1 309 . 17 1 1 A 31 31 ILE CA C 31 62.200 65.067 -2.867 1
1 310 . 17 1 1 A 31 31 ILE CB C 31 34.300 37.553 -3.253 1
1 314 . 17 1 1 A 31 31 ILE N N 31 121.300 127.109 -5.809 1
1 315 . 17 1 1 A 32 32 GLU H H 32 9.850 8.498 1.352 1
1 316 . 17 1 1 A 32 32 GLU HA H 32 3.780 3.865 -0.085 1
1 321 . 17 1 1 A 32 32 GLU CA C 32 60.500 59.962 0.538 1
1 322 . 17 1 1 A 32 32 GLU CB C 32 28.800 29.284 -0.484 1
1 324 . 17 1 1 A 32 32 GLU N N 32 121.600 122.160 -0.560 1
1 325 . 17 1 1 A 33 33 ASN H H 33 7.810 7.700 0.110 1
1 326 . 17 1 1 A 33 33 ASN HA H 33 4.440 4.533 -0.093 1
1 329 . 17 1 1 A 33 33 ASN CA C 33 55.800 56.397 -0.597 1
1 330 . 17 1 1 A 33 33 ASN CB C 33 38.100 39.260 -1.160 1
1 331 . 17 1 1 A 33 33 ASN N N 33 121.000 119.209 1.791 1
1 332 . 17 1 1 A 34 34 VAL H H 34 8.000 8.025 -0.025 1
1 333 . 17 1 1 A 34 34 VAL HA H 34 3.300 3.608 -0.308 1
1 341 . 17 1 1 A 34 34 VAL CA C 34 67.600 66.682 0.918 1
1 342 . 17 1 1 A 34 34 VAL CB C 34 30.700 31.645 -0.945 1
1 345 . 17 1 1 A 34 34 VAL N N 34 122.200 119.261 2.939 1
1 346 . 17 1 1 A 35 35 LYS H H 35 8.490 8.343 0.147 1
1 347 . 17 1 1 A 35 35 LYS HA H 35 4.500 3.978 0.522 1
1 352 . 17 1 1 A 35 35 LYS CA C 35 59.300 58.952 0.348 1
1 353 . 17 1 1 A 35 35 LYS CB C 35 33.500 32.282 1.218 1
1 354 . 17 1 1 A 35 35 LYS N N 35 119.200 120.210 -1.010 1
1 355 . 17 1 1 A 36 36 ALA H H 36 7.880 8.417 -0.537 1
1 356 . 17 1 1 A 36 36 ALA HA H 36 4.060 4.025 0.035 1
1 360 . 17 1 1 A 36 36 ALA CA C 36 55.300 54.916 0.384 1
1 361 . 17 1 1 A 36 36 ALA CB C 36 17.600 18.214 -0.614 1
1 362 . 17 1 1 A 36 36 ALA N N 36 123.300 121.711 1.589 1
1 363 . 17 1 1 A 37 37 LYS H H 37 7.790 8.041 -0.251 1
1 364 . 17 1 1 A 37 37 LYS HA H 37 4.110 4.100 0.010 1
1 373 . 17 1 1 A 37 37 LYS CA C 37 59.700 59.354 0.346 1
1 374 . 17 1 1 A 37 37 LYS CB C 37 33.100 32.487 0.613 1
1 378 . 17 1 1 A 37 37 LYS N N 37 120.400 117.312 3.088 1
1 379 . 17 1 1 A 38 38 ILE H H 38 8.240 7.669 0.571 1
1 380 . 17 1 1 A 38 38 ILE HA H 38 3.410 4.032 -0.622 1
1 390 . 17 1 1 A 38 38 ILE CA C 38 66.200 62.057 4.143 1
1 391 . 17 1 1 A 38 38 ILE CB C 38 36.800 37.707 -0.907 1
1 395 . 17 1 1 A 38 38 ILE N N 38 121.400 120.057 1.343 1
1 396 . 17 1 1 A 39 39 GLN H H 39 8.460 8.607 -0.147 1
1 397 . 17 1 1 A 39 39 GLN HA H 39 3.730 3.930 -0.200 1
1 402 . 17 1 1 A 39 39 GLN CA C 39 60.000 59.491 0.509 1
1 403 . 17 1 1 A 39 39 GLN CB C 39 27.600 27.983 -0.383 1
1 405 . 17 1 1 A 39 39 GLN N N 39 123.500 121.097 2.403 1
1 406 . 17 1 1 A 40 40 ASP H H 40 7.970 7.849 0.121 1
1 407 . 17 1 1 A 40 40 ASP HA H 40 4.240 4.486 -0.246 1
1 410 . 17 1 1 A 40 40 ASP CA C 40 57.400 56.608 0.792 1
1 411 . 17 1 1 A 40 40 ASP CB C 40 41.000 40.472 0.528 1
1 412 . 17 1 1 A 40 40 ASP N N 40 119.900 118.902 0.998 1
1 413 . 17 1 1 A 41 41 LYS H H 41 7.420 7.780 -0.360 1
1 414 . 17 1 1 A 41 41 LYS HA H 41 4.200 4.182 0.018 1
1 423 . 17 1 1 A 41 41 LYS CA C 41 58.200 59.208 -1.008 1
1 424 . 17 1 1 A 41 41 LYS CB C 41 33.900 32.752 1.148 1
1 427 . 17 1 1 A 41 41 LYS N N 41 115.700 120.789 -5.089 1
1 428 . 17 1 1 A 42 42 GLU H H 42 8.650 8.327 0.323 1
1 429 . 17 1 1 A 42 42 GLU HA H 42 4.470 4.488 -0.018 1
1 434 . 17 1 1 A 42 42 GLU CA C 42 55.300 56.005 -0.705 1
1 435 . 17 1 1 A 42 42 GLU CB C 42 33.200 32.016 1.184 1
1 437 . 17 1 1 A 42 42 GLU N N 42 114.200 115.325 -1.125 1
1 438 . 17 1 1 A 43 43 GLY H H 43 8.400 8.038 0.362 1
1 439 . 17 1 1 A 43 43 GLY HA2 H 43 4.040 3.875 0.165 1
1 440 . 17 1 1 A 43 43 GLY HA3 H 43 3.820 3.882 -0.062 1
1 441 . 17 1 1 A 43 43 GLY CA C 43 45.900 45.733 0.167 1
1 442 . 17 1 1 A 43 43 GLY N N 43 109.000 108.745 0.255 1
1 443 . 17 1 1 A 44 44 ILE H H 44 6.080 7.704 -1.624 1
1 444 . 17 1 1 A 44 44 ILE HA H 44 4.290 4.176 0.114 1
1 446 . 17 1 1 A 44 44 ILE CA C 44 57.700 59.087 -1.387 1
1 447 . 17 1 1 A 44 44 ILE CB C 44 40.400 38.541 1.859 1
1 448 . 17 1 1 A 44 44 ILE N N 44 120.500 121.823 -1.323 1
1 449 . 17 1 1 A 46 46 PRO HA H 46 4.030 4.282 -0.252 1
1 454 . 17 1 1 A 46 46 PRO CA C 46 66.100 65.113 0.987 1
1 455 . 17 1 1 A 46 46 PRO CB C 46 32.600 32.028 0.572 1
1 458 . 17 1 1 A 47 47 ASP H H 47 8.470 8.540 -0.070 1
1 459 . 17 1 1 A 47 47 ASP HA H 47 4.310 4.361 -0.051 1
1 462 . 17 1 1 A 47 47 ASP CA C 47 55.700 57.021 -1.321 1
1 463 . 17 1 1 A 47 47 ASP CB C 47 39.700 40.391 -0.691 1
1 464 . 17 1 1 A 47 47 ASP N N 47 113.700 117.400 -3.700 1
1 465 . 17 1 1 A 48 48 GLN H H 48 7.720 7.443 0.277 1
1 466 . 17 1 1 A 48 48 GLN HA H 48 4.340 4.431 -0.091 1
1 471 . 17 1 1 A 48 48 GLN CA C 48 55.500 54.989 0.511 1
1 472 . 17 1 1 A 48 48 GLN CB C 48 29.900 29.925 -0.025 1
1 474 . 17 1 1 A 48 48 GLN N N 48 116.900 115.234 1.666 1
1 475 . 17 1 1 A 49 49 GLN H H 49 7.410 7.483 -0.073 1
1 476 . 17 1 1 A 49 49 GLN HA H 49 4.110 4.123 -0.013 1
1 481 . 17 1 1 A 49 49 GLN CA C 49 56.600 56.341 0.259 1
1 482 . 17 1 1 A 49 49 GLN CB C 49 31.300 29.695 1.605 1
1 484 . 17 1 1 A 49 49 GLN N N 49 118.000 121.847 -3.847 1
1 485 . 17 1 1 A 50 50 ARG H H 50 8.400 9.003 -0.603 1
1 486 . 17 1 1 A 50 50 ARG HA H 50 4.380 5.097 -0.717 1
1 491 . 17 1 1 A 50 50 ARG CA C 50 55.100 54.754 0.346 1
1 492 . 17 1 1 A 50 50 ARG CB C 50 31.600 32.382 -0.782 1
1 494 . 17 1 1 A 50 50 ARG N N 50 123.100 122.920 0.180 1
1 495 . 17 1 1 A 51 51 LEU H H 51 8.710 8.633 0.077 1
1 496 . 17 1 1 A 51 51 LEU HA H 51 5.300 4.962 0.338 1
1 506 . 17 1 1 A 51 51 LEU CA C 51 52.900 53.970 -1.070 1
1 507 . 17 1 1 A 51 51 LEU CB C 51 45.700 44.225 1.475 1
1 511 . 17 1 1 A 51 51 LEU N N 51 124.400 126.598 -2.198 1
1 512 . 17 1 1 A 52 52 ILE H H 52 9.060 8.969 0.091 1
1 513 . 17 1 1 A 52 52 ILE HA H 52 4.840 5.174 -0.334 1
1 523 . 17 1 1 A 52 52 ILE CA C 52 58.900 60.439 -1.539 1
1 524 . 17 1 1 A 52 52 ILE CB C 52 41.200 39.884 1.316 1
1 528 . 17 1 1 A 52 52 ILE N N 52 122.500 128.564 -6.064 1
1 529 . 17 1 1 A 53 53 PHE H H 53 8.730 9.457 -0.727 1
1 530 . 17 1 1 A 53 53 PHE HA H 53 5.100 4.748 0.352 1
1 535 . 17 1 1 A 53 53 PHE CA C 53 56.300 57.447 -1.147 1
1 536 . 17 1 1 A 53 53 PHE CB C 53 43.500 41.837 1.663 1
1 537 . 17 1 1 A 53 53 PHE N N 53 124.800 127.791 -2.991 1
1 538 . 17 1 1 A 54 54 ALA H H 54 8.940 9.119 -0.179 1
1 539 . 17 1 1 A 54 54 ALA HA H 54 3.610 3.885 -0.275 1
1 543 . 17 1 1 A 54 54 ALA CA C 54 52.500 53.000 -0.500 1
1 544 . 17 1 1 A 54 54 ALA CB C 54 16.300 17.293 -0.993 1
1 545 . 17 1 1 A 54 54 ALA N N 54 133.100 130.280 2.820 1
1 546 . 17 1 1 A 55 55 GLY H H 55 8.070 8.634 -0.564 1
1 547 . 17 1 1 A 55 55 GLY HA2 H 55 4.000 3.859 0.141 1
1 548 . 17 1 1 A 55 55 GLY HA3 H 55 3.340 3.892 -0.552 1
1 549 . 17 1 1 A 55 55 GLY CA C 55 45.200 45.788 -0.588 1
1 550 . 17 1 1 A 55 55 GLY N N 55 102.500 102.748 -0.248 1
1 551 . 17 1 1 A 56 56 LYS H H 56 7.860 7.574 0.286 1
1 552 . 17 1 1 A 56 56 LYS HA H 56 4.510 4.857 -0.347 1
1 558 . 17 1 1 A 56 56 LYS CA C 56 54.500 54.919 -0.419 1
1 559 . 17 1 1 A 56 56 LYS CB C 56 34.400 35.441 -1.041 1
1 561 . 17 1 1 A 56 56 LYS N N 56 121.800 120.023 1.777 1
1 562 . 17 1 1 A 57 57 GLN H H 57 8.600 8.722 -0.122 1
1 563 . 17 1 1 A 57 57 GLN HA H 57 4.410 4.904 -0.494 1
1 568 . 17 1 1 A 57 57 GLN CA C 57 55.900 55.789 0.111 1
1 569 . 17 1 1 A 57 57 GLN CB C 57 28.800 29.233 -0.433 1
1 571 . 17 1 1 A 57 57 GLN N N 57 123.200 123.812 -0.612 1
1 572 . 17 1 1 A 58 58 LEU H H 58 8.480 8.936 -0.456 1
1 573 . 17 1 1 A 58 58 LEU HA H 58 4.060 5.008 -0.948 1
1 583 . 17 1 1 A 58 58 LEU CA C 58 54.100 53.253 0.847 1
1 584 . 17 1 1 A 58 58 LEU CB C 58 41.500 46.061 -4.561 1
1 588 . 17 1 1 A 58 58 LEU N N 58 125.900 123.237 2.663 1
1 589 . 17 1 1 A 59 59 GLU H H 59 8.400 8.896 -0.496 1
1 590 . 17 1 1 A 59 59 GLU HA H 59 4.400 5.168 -0.768 1
1 595 . 17 1 1 A 59 59 GLU CA C 59 55.900 54.136 1.764 1
1 596 . 17 1 1 A 59 59 GLU CB C 59 31.900 33.108 -1.208 1
1 598 . 17 1 1 A 59 59 GLU N N 59 123.100 117.547 5.553 1
1 599 . 17 1 1 A 60 60 ASP H H 60 8.110 8.802 -0.692 1
1 600 . 17 1 1 A 60 60 ASP HA H 60 4.270 5.479 -1.209 1
1 603 . 17 1 1 A 60 60 ASP CA C 60 57.100 52.409 4.691 1
1 604 . 17 1 1 A 60 60 ASP CB C 60 40.800 44.483 -3.683 1
1 605 . 17 1 1 A 60 60 ASP N N 60 120.300 120.558 -0.258 1
1 606 . 17 1 1 A 61 61 GLY HA2 H 61 4.000 4.024 -0.024 1
1 607 . 17 1 1 A 61 61 GLY HA3 H 61 3.830 4.037 -0.207 1
1 608 . 17 1 1 A 61 61 GLY CA C 61 45.000 45.543 -0.543 1
1 609 . 17 1 1 A 62 62 ARG H H 62 7.350 7.978 -0.628 1
1 610 . 17 1 1 A 62 62 ARG HA H 62 4.640 4.909 -0.269 1
1 615 . 17 1 1 A 62 62 ARG CA C 62 54.400 53.906 0.494 1
1 616 . 17 1 1 A 62 62 ARG CB C 62 32.600 34.082 -1.482 1
1 618 . 17 1 1 A 62 62 ARG N N 62 119.300 119.660 -0.360 1
1 619 . 17 1 1 A 63 63 THR H H 63 8.460 8.787 -0.327 1
1 620 . 17 1 1 A 63 63 THR HA H 63 5.060 4.649 0.411 1
1 625 . 17 1 1 A 63 63 THR CA C 63 59.700 60.919 -1.219 1
1 626 . 17 1 1 A 63 63 THR CB C 63 72.000 71.240 0.760 1
1 628 . 17 1 1 A 63 63 THR N N 63 109.100 112.820 -3.720 1
1 629 . 17 1 1 A 64 64 LEU H H 64 8.190 8.834 -0.644 1
1 630 . 17 1 1 A 64 64 LEU HA H 64 3.920 3.969 -0.049 1
1 640 . 17 1 1 A 64 64 LEU CA C 64 58.400 57.852 0.548 1
1 641 . 17 1 1 A 64 64 LEU CB C 64 40.200 41.646 -1.446 1
1 645 . 17 1 1 A 64 64 LEU N N 64 118.100 122.967 -4.867 1
1 646 . 17 1 1 A 65 65 SER H H 65 8.370 7.745 0.625 1
1 647 . 17 1 1 A 65 65 SER HA H 65 4.150 4.176 -0.026 1
1 650 . 17 1 1 A 65 65 SER CA C 65 60.900 60.641 0.259 1
1 651 . 17 1 1 A 65 65 SER CB C 65 62.500 63.417 -0.917 1
1 652 . 17 1 1 A 65 65 SER N N 65 112.200 113.897 -1.697 1
1 653 . 17 1 1 A 66 66 GLU H H 66 7.780 7.678 0.102 1
1 654 . 17 1 1 A 66 66 GLU HA H 66 3.890 4.139 -0.249 1
1 659 . 17 1 1 A 66 66 GLU CA C 66 59.200 58.886 0.314 1
1 660 . 17 1 1 A 66 66 GLU CB C 66 29.400 29.430 -0.030 1
1 662 . 17 1 1 A 66 66 GLU N N 66 123.600 121.962 1.638 1
1 663 . 17 1 1 A 67 67 TYR H H 67 7.290 7.536 -0.246 1
1 664 . 17 1 1 A 67 67 TYR HA H 67 4.590 4.540 0.050 1
1 669 . 17 1 1 A 67 67 TYR CA C 67 58.400 59.226 -0.826 1
1 670 . 17 1 1 A 67 67 TYR CB C 67 39.800 38.976 0.824 1
1 671 . 17 1 1 A 67 67 TYR N N 67 116.400 119.620 -3.220 1
1 672 . 17 1 1 A 68 68 ASN H H 68 8.040 8.015 0.025 1
1 673 . 17 1 1 A 68 68 ASN HA H 68 4.240 4.430 -0.190 1
1 676 . 17 1 1 A 68 68 ASN CA C 68 54.100 53.933 0.167 1
1 677 . 17 1 1 A 68 68 ASN CB C 68 37.200 36.730 0.470 1
1 678 . 17 1 1 A 68 68 ASN N N 68 115.600 118.808 -3.208 1
1 679 . 17 1 1 A 69 69 ILE H H 69 7.200 7.479 -0.279 1
1 680 . 17 1 1 A 69 69 ILE HA H 69 3.280 4.755 -1.475 1
1 690 . 17 1 1 A 69 69 ILE CA C 69 59.800 58.889 0.911 1
1 691 . 17 1 1 A 69 69 ILE CB C 69 36.600 40.517 -3.917 1
1 695 . 17 1 1 A 69 69 ILE N N 69 119.100 114.143 4.957 1
1 696 . 17 1 1 A 70 70 GLN H H 70 7.570 8.296 -0.726 1
1 697 . 17 1 1 A 70 70 GLN HA H 70 4.410 4.429 -0.019 1
1 702 . 17 1 1 A 70 70 GLN CA C 70 53.500 55.386 -1.886 1
1 703 . 17 1 1 A 70 70 GLN CB C 70 31.500 28.190 3.310 1
1 705 . 17 1 1 A 70 70 GLN N N 70 124.800 119.285 5.515 1
1 706 . 17 1 1 A 71 71 LYS H H 71 8.370 7.515 0.855 1
1 707 . 17 1 1 A 71 71 LYS HA H 71 3.870 4.078 -0.208 1
1 716 . 17 1 1 A 71 71 LYS CA C 71 58.000 55.101 2.899 1
1 717 . 17 1 1 A 71 71 LYS CB C 71 32.500 30.658 1.842 1
1 720 . 17 1 1 A 71 71 LYS N N 71 120.200 120.544 -0.344 1
1 721 . 17 1 1 A 72 72 GLU H H 72 9.230 7.960 1.270 1
1 722 . 17 1 1 A 72 72 GLU HA H 72 3.240 4.587 -1.347 1
1 727 . 17 1 1 A 72 72 GLU CA C 72 58.300 55.612 2.688 1
1 728 . 17 1 1 A 72 72 GLU CB C 72 26.000 30.209 -4.209 1
1 730 . 17 1 1 A 72 72 GLU N N 72 115.100 120.356 -5.256 1
1 731 . 17 1 1 A 73 73 SER H H 73 7.690 8.015 -0.325 1
1 732 . 17 1 1 A 73 73 SER HA H 73 4.520 4.808 -0.288 1
1 735 . 17 1 1 A 73 73 SER CA C 73 61.100 59.389 1.711 1
1 736 . 17 1 1 A 73 73 SER CB C 73 64.800 64.528 0.272 1
1 737 . 17 1 1 A 73 73 SER N N 73 115.300 113.136 2.164 1
1 738 . 17 1 1 A 74 74 THR H H 74 8.620 7.857 0.763 1
1 739 . 17 1 1 A 74 74 THR HA H 74 5.200 5.115 0.085 1
1 744 . 17 1 1 A 74 74 THR CA C 74 62.400 61.810 0.590 1
1 745 . 17 1 1 A 74 74 THR CB C 74 70.200 70.842 -0.642 1
1 747 . 17 1 1 A 74 74 THR N N 74 117.500 112.342 5.158 1
1 748 . 17 1 1 A 75 75 LEU H H 75 9.350 9.185 0.165 1
1 749 . 17 1 1 A 75 75 LEU HA H 75 4.990 4.891 0.099 1
1 759 . 17 1 1 A 75 75 LEU CA C 75 53.800 53.644 0.156 1
1 760 . 17 1 1 A 75 75 LEU CB C 75 44.400 46.408 -2.008 1
1 764 . 17 1 1 A 75 75 LEU N N 75 128.000 128.466 -0.466 1
1 765 . 17 1 1 A 76 76 HIS H H 76 9.140 8.139 1.001 1
1 766 . 17 1 1 A 76 76 HIS HA H 76 5.040 5.093 -0.053 1
1 769 . 17 1 1 A 76 76 HIS CA C 76 56.200 54.472 1.728 1
1 770 . 17 1 1 A 76 76 HIS CB C 76 32.500 31.653 0.847 1
1 771 . 17 1 1 A 76 76 HIS N N 76 119.600 122.093 -2.493 1
1 772 . 17 1 1 A 77 77 LEU H H 77 8.240 8.914 -0.674 1
1 773 . 17 1 1 A 77 77 LEU HA H 77 5.080 5.449 -0.369 1
1 783 . 17 1 1 A 77 77 LEU CA C 77 53.600 53.752 -0.152 1
1 784 . 17 1 1 A 77 77 LEU CB C 77 44.100 43.389 0.711 1
1 788 . 17 1 1 A 77 77 LEU N N 77 123.800 121.232 2.568 1
1 789 . 17 1 1 A 78 78 VAL H H 78 9.110 8.833 0.277 1
1 790 . 17 1 1 A 78 78 VAL HA H 78 4.260 4.639 -0.379 1
1 798 . 17 1 1 A 78 78 VAL CA C 78 60.400 60.738 -0.338 1
1 799 . 17 1 1 A 78 78 VAL CB C 78 34.700 36.023 -1.323 1
1 802 . 17 1 1 A 78 78 VAL N N 78 127.100 124.166 2.934 1
1 803 . 17 1 1 A 79 79 LEU H H 79 8.050 8.927 -0.877 1
1 804 . 17 1 1 A 79 79 LEU HA H 79 4.950 4.942 0.008 1
1 813 . 17 1 1 A 79 79 LEU CA C 79 53.800 53.169 0.631 1
1 814 . 17 1 1 A 79 79 LEU CB C 79 42.700 44.498 -1.798 1
1 818 . 17 1 1 A 79 79 LEU N N 79 123.400 128.876 -5.476 1
1 819 . 17 1 1 A 80 80 ARG H H 80 8.540 9.074 -0.534 1
1 820 . 17 1 1 A 80 80 ARG HA H 80 4.170 3.950 0.220 1
1 827 . 17 1 1 A 80 80 ARG CA C 80 55.800 56.851 -1.051 1
1 828 . 17 1 1 A 80 80 ARG CB C 80 31.100 28.843 2.257 1
1 830 . 17 1 1 A 80 80 ARG N N 80 123.500 126.287 -2.787 1
1 831 . 17 1 1 A 81 81 LEU H H 81 8.250 7.807 0.443 1
1 832 . 17 1 1 A 81 81 LEU HA H 81 4.270 4.277 -0.007 1
1 842 . 17 1 1 A 81 81 LEU CA C 81 55.000 54.891 0.109 1
1 843 . 17 1 1 A 81 81 LEU CB C 81 42.200 43.212 -1.012 1
1 847 . 17 1 1 A 81 81 LEU N N 81 124.100 120.499 3.601 1
1 848 . 17 1 1 A 82 82 ARG H H 82 8.310 8.786 -0.476 1
1 849 . 17 1 1 A 82 82 ARG HA H 82 4.200 4.625 -0.425 1
1 852 . 17 1 1 A 82 82 ARG CA C 82 56.300 55.804 0.496 1
1 853 . 17 1 1 A 82 82 ARG CB C 82 30.700 33.035 -2.335 1
1 855 . 17 1 1 A 82 82 ARG N N 82 121.500 119.768 1.732 1
1 856 . 17 1 1 A 83 83 GLY H H 83 8.410 8.479 -0.069 1
1 857 . 17 1 1 A 83 83 GLY HA2 H 83 3.750 3.853 -0.103 1
1 858 . 17 1 1 A 83 83 GLY HA3 H 83 3.754 3.903 -0.149 1
1 859 . 17 1 1 A 83 83 GLY CA C 83 45.100 44.487 0.613 1
1 860 . 17 1 1 A 83 83 GLY N N 83 110.200 111.644 -1.444 1
1 861 . 17 1 1 A 84 84 TYR H H 84 7.950 7.484 0.466 1
1 862 . 17 1 1 A 84 84 TYR HA H 84 4.400 5.377 -0.977 1
1 865 . 17 1 1 A 84 84 TYR CA C 84 58.100 55.467 2.633 1
1 866 . 17 1 1 A 84 84 TYR CB C 84 38.800 41.636 -2.836 1
1 867 . 17 1 1 A 84 84 TYR N N 84 119.900 115.643 4.257 1
1 868 . 17 1 1 A 85 85 ALA H H 85 8.150 8.511 -0.361 1
1 869 . 17 1 1 A 85 85 ALA HA H 85 4.150 4.617 -0.467 1
1 873 . 17 1 1 A 85 85 ALA CA C 85 52.600 53.036 -0.436 1
1 874 . 17 1 1 A 85 85 ALA CB C 85 19.200 18.965 0.235 1
1 875 . 17 1 1 A 85 85 ALA N N 85 124.800 122.030 2.770 1
1 876 . 17 1 1 A 86 86 ASP H H 86 8.020 8.446 -0.426 1
1 877 . 17 1 1 A 86 86 ASP HA H 86 4.450 5.065 -0.615 1
1 880 . 17 1 1 A 86 86 ASP CA C 86 54.100 53.637 0.463 1
1 881 . 17 1 1 A 86 86 ASP CB C 86 41.100 45.194 -4.094 1
1 882 . 17 1 1 A 86 86 ASP N N 86 118.900 122.856 -3.956 1
1 883 . 17 1 1 A 87 87 LEU H H 87 8.010 8.871 -0.861 1
1 884 . 17 1 1 A 87 87 LEU HA H 87 4.210 4.394 -0.184 1
1 893 . 17 1 1 A 87 87 LEU CA C 87 55.300 55.102 0.198 1
1 894 . 17 1 1 A 87 87 LEU CB C 87 42.000 40.836 1.164 1
1 898 . 17 1 1 A 87 87 LEU N N 87 122.400 125.387 -2.987 1
1 899 . 17 1 1 A 88 88 ARG H H 88 8.170 9.043 -0.873 1
1 900 . 17 1 1 A 88 88 ARG HA H 88 4.210 4.507 -0.297 1
1 903 . 17 1 1 A 88 88 ARG CA C 88 56.300 57.454 -1.154 1
1 904 . 17 1 1 A 88 88 ARG CB C 88 30.600 32.663 -2.063 1
1 905 . 17 1 1 A 88 88 ARG N N 88 121.200 127.744 -6.544 1
1 906 . 17 1 1 A 91 91 PRO HA H 91 4.290 4.700 -0.410 1
1 911 . 17 1 1 A 91 91 PRO CA C 91 63.800 62.463 1.337 1
1 912 . 17 1 1 A 91 91 PRO CB C 91 32.100 29.570 2.530 1
1 915 . 17 1 1 A 92 92 ASP H H 92 8.280 8.209 0.071 1
1 916 . 17 1 1 A 92 92 ASP HA H 92 4.540 5.226 -0.686 1
1 919 . 17 1 1 A 92 92 ASP CA C 92 54.600 53.163 1.437 1
1 920 . 17 1 1 A 92 92 ASP CB C 92 41.000 44.292 -3.292 1
1 921 . 17 1 1 A 92 92 ASP N N 92 118.700 118.217 0.483 1
1 922 . 17 1 1 A 93 93 ARG H H 93 7.780 8.767 -0.987 1
1 923 . 17 1 1 A 93 93 ARG HA H 93 4.190 4.937 -0.747 1
1 930 . 17 1 1 A 93 93 ARG CA C 93 56.300 53.877 2.423 1
1 931 . 17 1 1 A 93 93 ARG CB C 93 30.700 32.627 -1.927 1
1 934 . 17 1 1 A 93 93 ARG N N 93 120.700 119.980 0.720 1
1 935 . 17 1 1 A 94 94 GLN H H 94 8.280 8.408 -0.128 1
1 936 . 17 1 1 A 94 94 GLN HA H 94 4.210 4.254 -0.044 1
1 941 . 17 1 1 A 94 94 GLN CA C 94 55.800 56.138 -0.338 1
1 942 . 17 1 1 A 94 94 GLN CB C 94 29.300 28.772 0.528 1
1 944 . 17 1 1 A 94 94 GLN N N 94 121.000 119.064 1.936 1
1 945 . 17 1 1 A 95 95 ASP H H 95 8.270 8.876 -0.606 1
1 946 . 17 1 1 A 95 95 ASP HA H 95 4.450 5.404 -0.954 1
1 949 . 17 1 1 A 95 95 ASP CA C 95 54.300 53.071 1.229 1
1 950 . 17 1 1 A 95 95 ASP CB C 95 41.000 44.116 -3.116 1
1 951 . 17 1 1 A 95 95 ASP N N 95 121.000 122.834 -1.834 1
1 952 . 17 1 1 A 96 96 HIS H H 96 8.090 8.643 -0.553 1
1 953 . 17 1 1 A 96 96 HIS HA H 96 4.470 5.225 -0.755 1
1 956 . 17 1 1 A 96 96 HIS CA C 96 55.900 54.821 1.079 1
1 957 . 17 1 1 A 96 96 HIS CB C 96 30.500 31.839 -1.339 1
1 958 . 17 1 1 A 96 96 HIS N N 96 119.300 115.184 4.116 1
1 959 . 17 1 1 A 97 97 HIS H H 97 8.240 8.792 -0.552 1
1 960 . 17 1 1 A 97 97 HIS HA H 97 4.470 5.008 -0.538 1
1 963 . 17 1 1 A 97 97 HIS CA C 97 56.200 54.226 1.974 1
1 964 . 17 1 1 A 97 97 HIS CB C 97 30.400 34.603 -4.203 1
1 965 . 17 1 1 A 97 97 HIS N N 97 121.300 119.443 1.857 1
1 966 . 17 1 1 A 98 98 PRO HA H 98 4.340 4.418 -0.078 1
1 973 . 17 1 1 A 98 98 PRO CA C 98 63.700 62.784 0.916 1
1 974 . 17 1 1 A 98 98 PRO CB C 98 31.900 33.036 -1.136 1
1 977 . 17 1 1 A 99 99 GLY H H 99 8.660 8.209 0.451 1
1 978 . 17 1 1 A 99 99 GLY HA2 H 99 3.920 4.147 -0.227 1
1 979 . 17 1 1 A 99 99 GLY HA3 H 99 3.920 4.171 -0.251 1
1 980 . 17 1 1 A 99 99 GLY CA C 99 45.200 45.656 -0.456 1
1 981 . 17 1 1 A 99 99 GLY N N 99 110.000 107.303 2.697 1
1 982 . 17 1 1 A 100 100 SER H H 100 8.170 8.823 -0.653 1
1 983 . 17 1 1 A 100 100 SER HA H 100 4.360 4.983 -0.623 1
1 986 . 17 1 1 A 100 100 SER CA C 100 58.500 57.662 0.838 1
1 987 . 17 1 1 A 100 100 SER CB C 100 64.000 66.110 -2.110 1
1 988 . 17 1 1 A 100 100 SER N N 100 115.600 118.249 -2.649 1
1 989 . 17 1 1 A 101 101 GLY H H 101 8.420 8.322 0.098 1
1 990 . 17 1 1 A 101 101 GLY HA2 H 101 3.890 4.217 -0.327 1
1 991 . 17 1 1 A 101 101 GLY HA3 H 101 3.920 4.219 -0.299 1
1 992 . 17 1 1 A 101 101 GLY CA C 101 45.200 45.994 -0.794 1
1 993 . 17 1 1 A 101 101 GLY N N 101 111.000 110.060 0.940 1
1 994 . 17 1 1 A 102 102 ALA H H 102 8.030 8.512 -0.482 1
1 995 . 17 1 1 A 102 102 ALA HA H 102 4.250 4.701 -0.451 1
1 999 . 17 1 1 A 102 102 ALA CA C 102 52.500 51.292 1.208 1
1 1000 . 17 1 1 A 102 102 ALA CB C 102 19.200 22.488 -3.288 1
1 4 . 18 1 1 A 2 2 SER H H 2 8.160 7.673 0.487 1
1 5 . 18 1 1 A 2 2 SER HA H 2 4.370 4.830 -0.460 1
1 9 . 18 1 1 A 2 2 SER CA C 2 58.300 57.621 0.679 1
1 10 . 18 1 1 A 2 2 SER CB C 2 63.900 65.340 -1.440 1
1 11 . 18 1 1 A 2 2 SER N N 2 115.600 112.745 2.855 1
1 12 . 18 1 1 A 3 3 LEU H H 3 8.250 8.510 -0.260 1
1 13 . 18 1 1 A 3 3 LEU HA H 3 4.280 4.406 -0.126 1
1 17 . 18 1 1 A 3 3 LEU CA C 3 55.200 55.133 0.067 1
1 18 . 18 1 1 A 3 3 LEU CB C 3 42.100 42.596 -0.496 1
1 19 . 18 1 1 A 3 3 LEU N N 3 124.100 124.021 0.079 1
1 20 . 18 1 1 A 4 4 VAL H H 4 7.950 8.673 -0.723 1
1 21 . 18 1 1 A 4 4 VAL HA H 4 4.680 4.890 -0.210 1
1 26 . 18 1 1 A 4 4 VAL CA C 4 59.800 58.116 1.684 1
1 27 . 18 1 1 A 4 4 VAL CB C 4 32.500 33.615 -1.115 1
1 28 . 18 1 1 A 4 4 VAL N N 4 122.600 119.159 3.441 1
1 29 . 18 1 1 A 5 5 PRO CA C 5 63.100 62.366 0.734 1
1 30 . 18 1 1 A 5 5 PRO CB C 5 32.000 33.386 -1.386 1
1 32 . 18 1 1 A 6 6 ARG H H 6 8.360 8.177 0.183 1
1 33 . 18 1 1 A 6 6 ARG HA H 6 4.250 4.696 -0.446 1
1 36 . 18 1 1 A 6 6 ARG CA C 6 56.000 55.005 0.995 1
1 37 . 18 1 1 A 6 6 ARG CB C 6 30.900 30.094 0.806 1
1 38 . 18 1 1 A 6 6 ARG N N 6 121.800 116.894 4.906 1
1 39 . 18 1 1 A 7 7 GLY H H 7 8.460 8.002 0.458 1
1 40 . 18 1 1 A 7 7 GLY HA2 H 7 3.940 3.960 -0.020 1
1 41 . 18 1 1 A 7 7 GLY HA3 H 7 3.760 3.960 -0.200 1
1 42 . 18 1 1 A 7 7 GLY CA C 7 45.000 45.402 -0.402 1
1 43 . 18 1 1 A 7 7 GLY N N 7 110.700 109.376 1.324 1
1 44 . 18 1 1 A 8 8 SER H H 8 7.990 8.329 -0.339 1
1 45 . 18 1 1 A 8 8 SER HA H 8 4.450 4.118 0.332 1
1 48 . 18 1 1 A 8 8 SER CA C 8 58.900 59.544 -0.644 1
1 49 . 18 1 1 A 8 8 SER CB C 8 64.200 62.576 1.624 1
1 50 . 18 1 1 A 8 8 SER N N 8 115.500 114.661 0.839 1
1 51 . 18 1 1 A 9 9 MET H H 9 9.040 7.543 1.497 1
1 52 . 18 1 1 A 9 9 MET HA H 9 4.610 5.103 -0.493 1
1 60 . 18 1 1 A 9 9 MET CA C 9 54.400 54.004 0.396 1
1 61 . 18 1 1 A 9 9 MET CB C 9 35.400 36.060 -0.660 1
1 64 . 18 1 1 A 9 9 MET N N 9 120.500 119.843 0.657 1
1 65 . 18 1 1 A 10 10 GLN H H 10 8.270 8.993 -0.723 1
1 66 . 18 1 1 A 10 10 GLN HA H 10 5.270 5.363 -0.093 1
1 71 . 18 1 1 A 10 10 GLN CA C 10 54.200 54.224 -0.024 1
1 72 . 18 1 1 A 10 10 GLN CB C 10 30.500 32.598 -2.098 1
1 74 . 18 1 1 A 10 10 GLN N N 10 121.000 122.429 -1.429 1
1 75 . 18 1 1 A 11 11 ILE H H 11 8.270 8.835 -0.565 1
1 76 . 18 1 1 A 11 11 ILE HA H 11 4.100 4.811 -0.711 1
1 86 . 18 1 1 A 11 11 ILE CA C 11 59.400 59.378 0.022 1
1 87 . 18 1 1 A 11 11 ILE CB C 11 41.800 40.260 1.540 1
1 91 . 18 1 1 A 11 11 ILE N N 11 114.600 121.442 -6.842 1
1 92 . 18 1 1 A 12 12 PHE H H 12 8.520 8.846 -0.326 1
1 93 . 18 1 1 A 12 12 PHE HA H 12 5.540 5.321 0.219 1
1 96 . 18 1 1 A 12 12 PHE CA C 12 55.000 56.940 -1.940 1
1 97 . 18 1 1 A 12 12 PHE CB C 12 41.200 40.987 0.213 1
1 98 . 18 1 1 A 12 12 PHE N N 12 118.600 123.339 -4.739 1
1 99 . 18 1 1 A 13 13 VAL H H 13 9.230 8.811 0.419 1
1 100 . 18 1 1 A 13 13 VAL HA H 13 4.740 4.867 -0.127 1
1 108 . 18 1 1 A 13 13 VAL CA C 13 60.300 60.581 -0.281 1
1 109 . 18 1 1 A 13 13 VAL CB C 13 34.100 34.954 -0.854 1
1 112 . 18 1 1 A 13 13 VAL N N 13 121.400 123.262 -1.862 1
1 113 . 18 1 1 A 14 14 LYS H H 14 8.910 8.213 0.697 1
1 114 . 18 1 1 A 14 14 LYS HA H 14 5.190 4.727 0.463 1
1 122 . 18 1 1 A 14 14 LYS CA C 14 54.600 54.724 -0.124 1
1 123 . 18 1 1 A 14 14 LYS CB C 14 34.300 34.802 -0.502 1
1 126 . 18 1 1 A 14 14 LYS N N 14 128.000 126.281 1.719 1
1 127 . 18 1 1 A 15 15 THR H H 15 8.650 9.012 -0.362 1
1 128 . 18 1 1 A 15 15 THR HA H 15 4.870 4.683 0.187 1
1 133 . 18 1 1 A 15 15 THR CA C 15 60.300 60.784 -0.484 1
1 134 . 18 1 1 A 15 15 THR CB C 15 70.600 71.295 -0.695 1
1 136 . 18 1 1 A 15 15 THR N N 15 115.300 117.075 -1.775 1
1 137 . 18 1 1 A 16 16 LEU H H 16 9.070 8.741 0.329 1
1 138 . 18 1 1 A 16 16 LEU HA H 16 4.210 4.042 0.168 1
1 148 . 18 1 1 A 16 16 LEU CA C 16 57.400 57.588 -0.188 1
1 149 . 18 1 1 A 16 16 LEU CB C 16 41.800 41.412 0.388 1
1 153 . 18 1 1 A 16 16 LEU N N 16 121.400 119.297 2.103 1
1 154 . 18 1 1 A 17 17 THR H H 17 7.560 7.778 -0.218 1
1 155 . 18 1 1 A 17 17 THR HA H 17 4.330 4.262 0.068 1
1 160 . 18 1 1 A 17 17 THR CA C 17 61.400 63.502 -2.102 1
1 161 . 18 1 1 A 17 17 THR CB C 17 68.900 69.511 -0.611 1
1 163 . 18 1 1 A 17 17 THR N N 17 105.900 113.789 -7.889 1
1 164 . 18 1 1 A 18 18 GLY H H 18 7.750 7.768 -0.018 1
1 165 . 18 1 1 A 18 18 GLY HA2 H 18 4.250 4.046 0.204 1
1 166 . 18 1 1 A 18 18 GLY HA3 H 18 3.520 4.057 -0.537 1
1 167 . 18 1 1 A 18 18 GLY CA C 18 45.300 44.862 0.438 1
1 168 . 18 1 1 A 18 18 GLY N N 18 109.300 108.782 0.518 1
1 169 . 18 1 1 A 19 19 LYS H H 19 7.210 7.789 -0.579 1
1 170 . 18 1 1 A 19 19 LYS HA H 19 4.260 4.316 -0.056 1
1 175 . 18 1 1 A 19 19 LYS CA C 19 56.300 56.183 0.117 1
1 176 . 18 1 1 A 19 19 LYS CB C 19 33.200 33.698 -0.498 1
1 179 . 18 1 1 A 19 19 LYS N N 19 122.000 120.096 1.904 1
1 180 . 18 1 1 A 20 20 THR H H 20 8.570 8.536 0.034 1
1 181 . 18 1 1 A 20 20 THR HA H 20 4.950 5.305 -0.355 1
1 186 . 18 1 1 A 20 20 THR CA C 20 62.200 61.947 0.253 1
1 187 . 18 1 1 A 20 20 THR CB C 20 69.700 70.248 -0.548 1
1 189 . 18 1 1 A 20 20 THR N N 20 120.700 117.412 3.288 1
1 190 . 18 1 1 A 21 21 ILE H H 21 9.510 8.370 1.140 1
1 191 . 18 1 1 A 21 21 ILE HA H 21 4.390 4.854 -0.464 1
1 201 . 18 1 1 A 21 21 ILE CA C 21 60.000 59.066 0.934 1
1 202 . 18 1 1 A 21 21 ILE CB C 21 40.700 41.727 -1.027 1
1 206 . 18 1 1 A 21 21 ILE N N 21 128.200 122.484 5.716 1
1 207 . 18 1 1 A 22 22 THR H H 22 8.700 8.757 -0.057 1
1 208 . 18 1 1 A 22 22 THR HA H 22 4.860 4.482 0.378 1
1 213 . 18 1 1 A 22 22 THR CA C 22 62.100 63.285 -1.185 1
1 214 . 18 1 1 A 22 22 THR CB C 22 69.500 69.068 0.432 1
1 216 . 18 1 1 A 22 22 THR N N 22 122.300 121.184 1.116 1
1 217 . 18 1 1 A 23 23 LEU H H 23 8.720 8.994 -0.274 1
1 218 . 18 1 1 A 23 23 LEU HA H 23 4.690 5.088 -0.398 1
1 228 . 18 1 1 A 23 23 LEU CA C 23 52.700 53.164 -0.464 1
1 229 . 18 1 1 A 23 23 LEU CB C 23 46.600 45.076 1.524 1
1 233 . 18 1 1 A 23 23 LEU N N 23 125.400 127.893 -2.493 1
1 234 . 18 1 1 A 24 24 GLU H H 24 8.080 8.635 -0.555 1
1 235 . 18 1 1 A 24 24 GLU HA H 24 4.800 4.716 0.084 1
1 238 . 18 1 1 A 24 24 GLU CA C 24 55.400 55.785 -0.385 1
1 239 . 18 1 1 A 24 24 GLU CB C 24 30.100 30.863 -0.763 1
1 241 . 18 1 1 A 24 24 GLU N N 24 121.800 122.971 -1.171 1
1 242 . 18 1 1 A 25 25 VAL H H 25 8.800 8.916 -0.116 1
1 243 . 18 1 1 A 25 25 VAL HA H 25 4.640 4.952 -0.312 1
1 251 . 18 1 1 A 25 25 VAL CA C 25 58.600 59.553 -0.953 1
1 252 . 18 1 1 A 25 25 VAL CB C 25 36.300 35.954 0.346 1
1 255 . 18 1 1 A 25 25 VAL N N 25 116.700 116.438 0.262 1
1 256 . 18 1 1 A 26 26 GLU H H 26 8.500 8.438 0.062 1
1 257 . 18 1 1 A 26 26 GLU HA H 26 4.900 4.639 0.261 1
1 260 . 18 1 1 A 26 26 GLU CA C 26 53.000 53.636 -0.636 1
1 261 . 18 1 1 A 26 26 GLU CB C 26 31.200 33.985 -2.785 1
1 262 . 18 1 1 A 26 26 GLU N N 26 117.900 121.480 -3.580 1
1 263 . 18 1 1 A 27 27 PRO HA H 27 4.040 4.449 -0.409 1
1 270 . 18 1 1 A 27 27 PRO CA C 27 65.400 64.850 0.550 1
1 271 . 18 1 1 A 27 27 PRO CB C 27 31.700 32.011 -0.311 1
1 274 . 18 1 1 A 28 28 SER H H 28 7.010 8.265 -1.255 1
1 275 . 18 1 1 A 28 28 SER HA H 28 4.280 4.668 -0.388 1
1 278 . 18 1 1 A 28 28 SER CA C 28 57.400 58.045 -0.645 1
1 279 . 18 1 1 A 28 28 SER CB C 28 63.400 63.774 -0.374 1
1 280 . 18 1 1 A 28 28 SER N N 28 103.800 111.221 -7.421 1
1 281 . 18 1 1 A 29 29 ASP H H 29 7.960 7.841 0.119 1
1 282 . 18 1 1 A 29 29 ASP HA H 29 4.600 5.177 -0.577 1
1 285 . 18 1 1 A 29 29 ASP CA C 29 55.900 52.875 3.025 1
1 286 . 18 1 1 A 29 29 ASP CB C 29 41.000 43.712 -2.712 1
1 287 . 18 1 1 A 29 29 ASP N N 29 123.700 120.251 3.449 1
1 288 . 18 1 1 A 30 30 THR H H 30 7.780 8.694 -0.914 1
1 289 . 18 1 1 A 30 30 THR HA H 30 4.850 4.712 0.138 1
1 294 . 18 1 1 A 30 30 THR CA C 30 59.400 60.046 -0.646 1
1 295 . 18 1 1 A 30 30 THR CB C 30 71.100 71.309 -0.209 1
1 297 . 18 1 1 A 30 30 THR N N 30 108.800 117.813 -9.013 1
1 298 . 18 1 1 A 31 31 ILE H H 31 8.320 9.068 -0.748 1
1 299 . 18 1 1 A 31 31 ILE HA H 31 3.580 3.770 -0.190 1
1 309 . 18 1 1 A 31 31 ILE CA C 31 62.200 64.801 -2.601 1
1 310 . 18 1 1 A 31 31 ILE CB C 31 34.300 37.556 -3.256 1
1 314 . 18 1 1 A 31 31 ILE N N 31 121.300 127.292 -5.992 1
1 315 . 18 1 1 A 32 32 GLU H H 32 9.850 8.440 1.410 1
1 316 . 18 1 1 A 32 32 GLU HA H 32 3.780 3.942 -0.162 1
1 321 . 18 1 1 A 32 32 GLU CA C 32 60.500 59.755 0.745 1
1 322 . 18 1 1 A 32 32 GLU CB C 32 28.800 29.105 -0.305 1
1 324 . 18 1 1 A 32 32 GLU N N 32 121.600 121.593 0.007 1
1 325 . 18 1 1 A 33 33 ASN H H 33 7.810 7.569 0.241 1
1 326 . 18 1 1 A 33 33 ASN HA H 33 4.440 4.642 -0.202 1
1 329 . 18 1 1 A 33 33 ASN CA C 33 55.800 56.049 -0.249 1
1 330 . 18 1 1 A 33 33 ASN CB C 33 38.100 38.761 -0.661 1
1 331 . 18 1 1 A 33 33 ASN N N 33 121.000 118.262 2.738 1
1 332 . 18 1 1 A 34 34 VAL H H 34 8.000 8.072 -0.072 1
1 333 . 18 1 1 A 34 34 VAL HA H 34 3.300 3.837 -0.537 1
1 341 . 18 1 1 A 34 34 VAL CA C 34 67.600 66.570 1.030 1
1 342 . 18 1 1 A 34 34 VAL CB C 34 30.700 31.658 -0.958 1
1 345 . 18 1 1 A 34 34 VAL N N 34 122.200 120.306 1.894 1
1 346 . 18 1 1 A 35 35 LYS H H 35 8.490 8.288 0.202 1
1 347 . 18 1 1 A 35 35 LYS HA H 35 4.500 4.000 0.500 1
1 352 . 18 1 1 A 35 35 LYS CA C 35 59.300 59.171 0.129 1
1 353 . 18 1 1 A 35 35 LYS CB C 35 33.500 32.173 1.327 1
1 354 . 18 1 1 A 35 35 LYS N N 35 119.200 120.154 -0.954 1
1 355 . 18 1 1 A 36 36 ALA H H 36 7.880 8.519 -0.639 1
1 356 . 18 1 1 A 36 36 ALA HA H 36 4.060 4.031 0.029 1
1 360 . 18 1 1 A 36 36 ALA CA C 36 55.300 55.276 0.024 1
1 361 . 18 1 1 A 36 36 ALA CB C 36 17.600 18.158 -0.558 1
1 362 . 18 1 1 A 36 36 ALA N N 36 123.300 122.198 1.102 1
1 363 . 18 1 1 A 37 37 LYS H H 37 7.790 7.829 -0.039 1
1 364 . 18 1 1 A 37 37 LYS HA H 37 4.110 3.941 0.169 1
1 373 . 18 1 1 A 37 37 LYS CA C 37 59.700 59.811 -0.111 1
1 374 . 18 1 1 A 37 37 LYS CB C 37 33.100 32.031 1.069 1
1 378 . 18 1 1 A 37 37 LYS N N 37 120.400 118.068 2.332 1
1 379 . 18 1 1 A 38 38 ILE H H 38 8.240 7.480 0.760 1
1 380 . 18 1 1 A 38 38 ILE HA H 38 3.410 3.976 -0.566 1
1 390 . 18 1 1 A 38 38 ILE CA C 38 66.200 62.370 3.830 1
1 391 . 18 1 1 A 38 38 ILE CB C 38 36.800 37.864 -1.064 1
1 395 . 18 1 1 A 38 38 ILE N N 38 121.400 119.957 1.443 1
1 396 . 18 1 1 A 39 39 GLN H H 39 8.460 8.206 0.254 1
1 397 . 18 1 1 A 39 39 GLN HA H 39 3.730 4.044 -0.314 1
1 402 . 18 1 1 A 39 39 GLN CA C 39 60.000 58.232 1.768 1
1 403 . 18 1 1 A 39 39 GLN CB C 39 27.600 28.436 -0.836 1
1 405 . 18 1 1 A 39 39 GLN N N 39 123.500 119.412 4.088 1
1 406 . 18 1 1 A 40 40 ASP H H 40 7.970 7.604 0.366 1
1 407 . 18 1 1 A 40 40 ASP HA H 40 4.240 4.387 -0.147 1
1 410 . 18 1 1 A 40 40 ASP CA C 40 57.400 56.586 0.814 1
1 411 . 18 1 1 A 40 40 ASP CB C 40 41.000 40.678 0.322 1
1 412 . 18 1 1 A 40 40 ASP N N 40 119.900 120.467 -0.567 1
1 413 . 18 1 1 A 41 41 LYS H H 41 7.420 7.870 -0.450 1
1 414 . 18 1 1 A 41 41 LYS HA H 41 4.200 4.163 0.037 1
1 423 . 18 1 1 A 41 41 LYS CA C 41 58.200 59.086 -0.886 1
1 424 . 18 1 1 A 41 41 LYS CB C 41 33.900 32.768 1.132 1
1 427 . 18 1 1 A 41 41 LYS N N 41 115.700 119.114 -3.414 1
1 428 . 18 1 1 A 42 42 GLU H H 42 8.650 8.071 0.579 1
1 429 . 18 1 1 A 42 42 GLU HA H 42 4.470 4.576 -0.106 1
1 434 . 18 1 1 A 42 42 GLU CA C 42 55.300 56.161 -0.861 1
1 435 . 18 1 1 A 42 42 GLU CB C 42 33.200 31.819 1.381 1
1 437 . 18 1 1 A 42 42 GLU N N 42 114.200 115.450 -1.250 1
1 438 . 18 1 1 A 43 43 GLY H H 43 8.400 7.786 0.614 1
1 439 . 18 1 1 A 43 43 GLY HA2 H 43 4.040 3.962 0.078 1
1 440 . 18 1 1 A 43 43 GLY HA3 H 43 3.820 3.971 -0.151 1
1 441 . 18 1 1 A 43 43 GLY CA C 43 45.900 46.673 -0.773 1
1 442 . 18 1 1 A 43 43 GLY N N 43 109.000 108.684 0.316 1
1 443 . 18 1 1 A 44 44 ILE H H 44 6.080 7.953 -1.873 1
1 444 . 18 1 1 A 44 44 ILE HA H 44 4.290 4.168 0.122 1
1 446 . 18 1 1 A 44 44 ILE CA C 44 57.700 59.645 -1.945 1
1 447 . 18 1 1 A 44 44 ILE CB C 44 40.400 38.273 2.127 1
1 448 . 18 1 1 A 44 44 ILE N N 44 120.500 120.633 -0.133 1
1 449 . 18 1 1 A 46 46 PRO HA H 46 4.030 4.321 -0.291 1
1 454 . 18 1 1 A 46 46 PRO CA C 46 66.100 65.100 1.000 1
1 455 . 18 1 1 A 46 46 PRO CB C 46 32.600 31.930 0.670 1
1 458 . 18 1 1 A 47 47 ASP H H 47 8.470 8.530 -0.060 1
1 459 . 18 1 1 A 47 47 ASP HA H 47 4.310 4.370 -0.060 1
1 462 . 18 1 1 A 47 47 ASP CA C 47 55.700 57.067 -1.367 1
1 463 . 18 1 1 A 47 47 ASP CB C 47 39.700 40.414 -0.714 1
1 464 . 18 1 1 A 47 47 ASP N N 47 113.700 117.812 -4.112 1
1 465 . 18 1 1 A 48 48 GLN H H 48 7.720 7.492 0.228 1
1 466 . 18 1 1 A 48 48 GLN HA H 48 4.340 4.388 -0.048 1
1 471 . 18 1 1 A 48 48 GLN CA C 48 55.500 55.113 0.387 1
1 472 . 18 1 1 A 48 48 GLN CB C 48 29.900 30.333 -0.433 1
1 474 . 18 1 1 A 48 48 GLN N N 48 116.900 115.247 1.653 1
1 475 . 18 1 1 A 49 49 GLN H H 49 7.410 7.684 -0.274 1
1 476 . 18 1 1 A 49 49 GLN HA H 49 4.110 4.096 0.014 1
1 481 . 18 1 1 A 49 49 GLN CA C 49 56.600 56.627 -0.027 1
1 482 . 18 1 1 A 49 49 GLN CB C 49 31.300 29.652 1.648 1
1 484 . 18 1 1 A 49 49 GLN N N 49 118.000 121.934 -3.934 1
1 485 . 18 1 1 A 50 50 ARG H H 50 8.400 8.716 -0.316 1
1 486 . 18 1 1 A 50 50 ARG HA H 50 4.380 4.949 -0.569 1
1 491 . 18 1 1 A 50 50 ARG CA C 50 55.100 54.287 0.813 1
1 492 . 18 1 1 A 50 50 ARG CB C 50 31.600 33.206 -1.606 1
1 494 . 18 1 1 A 50 50 ARG N N 50 123.100 125.300 -2.200 1
1 495 . 18 1 1 A 51 51 LEU H H 51 8.710 8.736 -0.026 1
1 496 . 18 1 1 A 51 51 LEU HA H 51 5.300 5.208 0.092 1
1 506 . 18 1 1 A 51 51 LEU CA C 51 52.900 53.538 -0.638 1
1 507 . 18 1 1 A 51 51 LEU CB C 51 45.700 45.525 0.175 1
1 511 . 18 1 1 A 51 51 LEU N N 51 124.400 120.751 3.649 1
1 512 . 18 1 1 A 52 52 ILE H H 52 9.060 9.091 -0.031 1
1 513 . 18 1 1 A 52 52 ILE HA H 52 4.840 5.021 -0.181 1
1 523 . 18 1 1 A 52 52 ILE CA C 52 58.900 60.008 -1.108 1
1 524 . 18 1 1 A 52 52 ILE CB C 52 41.200 40.958 0.242 1
1 528 . 18 1 1 A 52 52 ILE N N 52 122.500 123.389 -0.889 1
1 529 . 18 1 1 A 53 53 PHE H H 53 8.730 9.471 -0.741 1
1 530 . 18 1 1 A 53 53 PHE HA H 53 5.100 4.796 0.304 1
1 535 . 18 1 1 A 53 53 PHE CA C 53 56.300 57.489 -1.189 1
1 536 . 18 1 1 A 53 53 PHE CB C 53 43.500 41.964 1.536 1
1 537 . 18 1 1 A 53 53 PHE N N 53 124.800 127.462 -2.662 1
1 538 . 18 1 1 A 54 54 ALA H H 54 8.940 9.117 -0.177 1
1 539 . 18 1 1 A 54 54 ALA HA H 54 3.610 3.868 -0.258 1
1 543 . 18 1 1 A 54 54 ALA CA C 54 52.500 52.996 -0.496 1
1 544 . 18 1 1 A 54 54 ALA CB C 54 16.300 17.352 -1.052 1
1 545 . 18 1 1 A 54 54 ALA N N 54 133.100 130.276 2.824 1
1 546 . 18 1 1 A 55 55 GLY H H 55 8.070 8.366 -0.296 1
1 547 . 18 1 1 A 55 55 GLY HA2 H 55 4.000 3.774 0.226 1
1 548 . 18 1 1 A 55 55 GLY HA3 H 55 3.340 3.800 -0.460 1
1 549 . 18 1 1 A 55 55 GLY CA C 55 45.200 45.204 -0.004 1
1 550 . 18 1 1 A 55 55 GLY N N 55 102.500 102.582 -0.082 1
1 551 . 18 1 1 A 56 56 LYS H H 56 7.860 7.902 -0.042 1
1 552 . 18 1 1 A 56 56 LYS HA H 56 4.510 4.548 -0.038 1
1 558 . 18 1 1 A 56 56 LYS CA C 56 54.500 54.695 -0.195 1
1 559 . 18 1 1 A 56 56 LYS CB C 56 34.400 33.920 0.480 1
1 561 . 18 1 1 A 56 56 LYS N N 56 121.800 121.830 -0.030 1
1 562 . 18 1 1 A 57 57 GLN H H 57 8.600 8.604 -0.004 1
1 563 . 18 1 1 A 57 57 GLN HA H 57 4.410 4.905 -0.495 1
1 568 . 18 1 1 A 57 57 GLN CA C 57 55.900 55.766 0.134 1
1 569 . 18 1 1 A 57 57 GLN CB C 57 28.800 29.689 -0.889 1
1 571 . 18 1 1 A 57 57 GLN N N 57 123.200 127.369 -4.169 1
1 572 . 18 1 1 A 58 58 LEU H H 58 8.480 8.206 0.274 1
1 573 . 18 1 1 A 58 58 LEU HA H 58 4.060 4.496 -0.436 1
1 583 . 18 1 1 A 58 58 LEU CA C 58 54.100 54.475 -0.375 1
1 584 . 18 1 1 A 58 58 LEU CB C 58 41.500 42.442 -0.942 1
1 588 . 18 1 1 A 58 58 LEU N N 58 125.900 126.235 -0.335 1
1 589 . 18 1 1 A 59 59 GLU H H 59 8.400 8.469 -0.069 1
1 590 . 18 1 1 A 59 59 GLU HA H 59 4.400 4.452 -0.052 1
1 595 . 18 1 1 A 59 59 GLU CA C 59 55.900 57.235 -1.335 1
1 596 . 18 1 1 A 59 59 GLU CB C 59 31.900 30.397 1.503 1
1 598 . 18 1 1 A 59 59 GLU N N 59 123.100 119.419 3.681 1
1 599 . 18 1 1 A 60 60 ASP H H 60 8.110 8.114 -0.004 1
1 600 . 18 1 1 A 60 60 ASP HA H 60 4.270 4.719 -0.449 1
1 603 . 18 1 1 A 60 60 ASP CA C 60 57.100 55.837 1.263 1
1 604 . 18 1 1 A 60 60 ASP CB C 60 40.800 42.339 -1.539 1
1 605 . 18 1 1 A 60 60 ASP N N 60 120.300 119.168 1.132 1
1 606 . 18 1 1 A 61 61 GLY HA2 H 61 4.000 4.128 -0.128 1
1 607 . 18 1 1 A 61 61 GLY HA3 H 61 3.830 4.153 -0.323 1
1 608 . 18 1 1 A 61 61 GLY CA C 61 45.000 45.827 -0.827 1
1 609 . 18 1 1 A 62 62 ARG H H 62 7.350 9.056 -1.706 1
1 610 . 18 1 1 A 62 62 ARG HA H 62 4.640 4.962 -0.322 1
1 615 . 18 1 1 A 62 62 ARG CA C 62 54.400 54.081 0.319 1
1 616 . 18 1 1 A 62 62 ARG CB C 62 32.600 34.420 -1.820 1
1 618 . 18 1 1 A 62 62 ARG N N 62 119.300 125.226 -5.926 1
1 619 . 18 1 1 A 63 63 THR H H 63 8.460 8.813 -0.353 1
1 620 . 18 1 1 A 63 63 THR HA H 63 5.060 4.607 0.453 1
1 625 . 18 1 1 A 63 63 THR CA C 63 59.700 60.837 -1.137 1
1 626 . 18 1 1 A 63 63 THR CB C 63 72.000 70.899 1.101 1
1 628 . 18 1 1 A 63 63 THR N N 63 109.100 113.797 -4.697 1
1 629 . 18 1 1 A 64 64 LEU H H 64 8.190 8.742 -0.552 1
1 630 . 18 1 1 A 64 64 LEU HA H 64 3.920 4.079 -0.159 1
1 640 . 18 1 1 A 64 64 LEU CA C 64 58.400 58.507 -0.107 1
1 641 . 18 1 1 A 64 64 LEU CB C 64 40.200 41.130 -0.930 1
1 645 . 18 1 1 A 64 64 LEU N N 64 118.100 124.063 -5.963 1
1 646 . 18 1 1 A 65 65 SER H H 65 8.370 8.000 0.370 1
1 647 . 18 1 1 A 65 65 SER HA H 65 4.150 4.194 -0.044 1
1 650 . 18 1 1 A 65 65 SER CA C 65 60.900 61.443 -0.543 1
1 651 . 18 1 1 A 65 65 SER CB C 65 62.500 62.882 -0.382 1
1 652 . 18 1 1 A 65 65 SER N N 65 112.200 114.645 -2.445 1
1 653 . 18 1 1 A 66 66 GLU H H 66 7.780 8.415 -0.635 1
1 654 . 18 1 1 A 66 66 GLU HA H 66 3.890 4.060 -0.170 1
1 659 . 18 1 1 A 66 66 GLU CA C 66 59.200 59.179 0.021 1
1 660 . 18 1 1 A 66 66 GLU CB C 66 29.400 29.349 0.051 1
1 662 . 18 1 1 A 66 66 GLU N N 66 123.600 121.217 2.383 1
1 663 . 18 1 1 A 67 67 TYR H H 67 7.290 7.701 -0.411 1
1 664 . 18 1 1 A 67 67 TYR HA H 67 4.590 4.550 0.040 1
1 669 . 18 1 1 A 67 67 TYR CA C 67 58.400 59.143 -0.743 1
1 670 . 18 1 1 A 67 67 TYR CB C 67 39.800 39.185 0.615 1
1 671 . 18 1 1 A 67 67 TYR N N 67 116.400 119.963 -3.563 1
1 672 . 18 1 1 A 68 68 ASN H H 68 8.040 7.996 0.044 1
1 673 . 18 1 1 A 68 68 ASN HA H 68 4.240 4.294 -0.054 1
1 676 . 18 1 1 A 68 68 ASN CA C 68 54.100 54.670 -0.570 1
1 677 . 18 1 1 A 68 68 ASN CB C 68 37.200 37.122 0.078 1
1 678 . 18 1 1 A 68 68 ASN N N 68 115.600 115.488 0.112 1
1 679 . 18 1 1 A 69 69 ILE H H 69 7.200 7.430 -0.230 1
1 680 . 18 1 1 A 69 69 ILE HA H 69 3.280 4.480 -1.200 1
1 690 . 18 1 1 A 69 69 ILE CA C 69 59.800 59.508 0.292 1
1 691 . 18 1 1 A 69 69 ILE CB C 69 36.600 38.903 -2.303 1
1 695 . 18 1 1 A 69 69 ILE N N 69 119.100 114.822 4.278 1
1 696 . 18 1 1 A 70 70 GLN H H 70 7.570 8.968 -1.398 1
1 697 . 18 1 1 A 70 70 GLN HA H 70 4.410 4.582 -0.172 1
1 702 . 18 1 1 A 70 70 GLN CA C 70 53.500 55.300 -1.800 1
1 703 . 18 1 1 A 70 70 GLN CB C 70 31.500 28.328 3.172 1
1 705 . 18 1 1 A 70 70 GLN N N 70 124.800 120.363 4.437 1
1 706 . 18 1 1 A 71 71 LYS H H 71 8.370 7.648 0.722 1
1 707 . 18 1 1 A 71 71 LYS HA H 71 3.870 3.419 0.451 1
1 716 . 18 1 1 A 71 71 LYS CA C 71 58.000 57.735 0.265 1
1 717 . 18 1 1 A 71 71 LYS CB C 71 32.500 31.450 1.050 1
1 720 . 18 1 1 A 71 71 LYS N N 71 120.200 118.267 1.933 1
1 721 . 18 1 1 A 72 72 GLU H H 72 9.230 8.285 0.945 1
1 722 . 18 1 1 A 72 72 GLU HA H 72 3.240 4.222 -0.982 1
1 727 . 18 1 1 A 72 72 GLU CA C 72 58.300 56.655 1.645 1
1 728 . 18 1 1 A 72 72 GLU CB C 72 26.000 29.159 -3.159 1
1 730 . 18 1 1 A 72 72 GLU N N 72 115.100 120.003 -4.903 1
1 731 . 18 1 1 A 73 73 SER H H 73 7.690 8.147 -0.457 1
1 732 . 18 1 1 A 73 73 SER HA H 73 4.520 4.779 -0.259 1
1 735 . 18 1 1 A 73 73 SER CA C 73 61.100 59.059 2.041 1
1 736 . 18 1 1 A 73 73 SER CB C 73 64.800 65.369 -0.569 1
1 737 . 18 1 1 A 73 73 SER N N 73 115.300 114.420 0.880 1
1 738 . 18 1 1 A 74 74 THR H H 74 8.620 7.937 0.683 1
1 739 . 18 1 1 A 74 74 THR HA H 74 5.200 5.087 0.113 1
1 744 . 18 1 1 A 74 74 THR CA C 74 62.400 61.794 0.606 1
1 745 . 18 1 1 A 74 74 THR CB C 74 70.200 70.798 -0.598 1
1 747 . 18 1 1 A 74 74 THR N N 74 117.500 111.078 6.422 1
1 748 . 18 1 1 A 75 75 LEU H H 75 9.350 9.196 0.154 1
1 749 . 18 1 1 A 75 75 LEU HA H 75 4.990 5.068 -0.078 1
1 759 . 18 1 1 A 75 75 LEU CA C 75 53.800 53.366 0.434 1
1 760 . 18 1 1 A 75 75 LEU CB C 75 44.400 45.136 -0.736 1
1 764 . 18 1 1 A 75 75 LEU N N 75 128.000 127.570 0.430 1
1 765 . 18 1 1 A 76 76 HIS H H 76 9.140 8.456 0.684 1
1 766 . 18 1 1 A 76 76 HIS HA H 76 5.040 5.153 -0.113 1
1 769 . 18 1 1 A 76 76 HIS CA C 76 56.200 54.291 1.909 1
1 770 . 18 1 1 A 76 76 HIS CB C 76 32.500 31.388 1.112 1
1 771 . 18 1 1 A 76 76 HIS N N 76 119.600 122.935 -3.335 1
1 772 . 18 1 1 A 77 77 LEU H H 77 8.240 8.952 -0.712 1
1 773 . 18 1 1 A 77 77 LEU HA H 77 5.080 5.159 -0.079 1
1 783 . 18 1 1 A 77 77 LEU CA C 77 53.600 53.772 -0.172 1
1 784 . 18 1 1 A 77 77 LEU CB C 77 44.100 43.431 0.669 1
1 788 . 18 1 1 A 77 77 LEU N N 77 123.800 121.471 2.329 1
1 789 . 18 1 1 A 78 78 VAL H H 78 9.110 8.831 0.279 1
1 790 . 18 1 1 A 78 78 VAL HA H 78 4.260 4.659 -0.399 1
1 798 . 18 1 1 A 78 78 VAL CA C 78 60.400 60.967 -0.567 1
1 799 . 18 1 1 A 78 78 VAL CB C 78 34.700 35.729 -1.029 1
1 802 . 18 1 1 A 78 78 VAL N N 78 127.100 124.189 2.911 1
1 803 . 18 1 1 A 79 79 LEU H H 79 8.050 8.881 -0.831 1
1 804 . 18 1 1 A 79 79 LEU HA H 79 4.950 4.921 0.029 1
1 813 . 18 1 1 A 79 79 LEU CA C 79 53.800 53.213 0.587 1
1 814 . 18 1 1 A 79 79 LEU CB C 79 42.700 44.373 -1.673 1
1 818 . 18 1 1 A 79 79 LEU N N 79 123.400 128.803 -5.403 1
1 819 . 18 1 1 A 80 80 ARG H H 80 8.540 8.796 -0.256 1
1 820 . 18 1 1 A 80 80 ARG HA H 80 4.170 3.787 0.383 1
1 827 . 18 1 1 A 80 80 ARG CA C 80 55.800 56.941 -1.141 1
1 828 . 18 1 1 A 80 80 ARG CB C 80 31.100 28.669 2.431 1
1 830 . 18 1 1 A 80 80 ARG N N 80 123.500 124.326 -0.826 1
1 831 . 18 1 1 A 81 81 LEU H H 81 8.250 7.713 0.537 1
1 832 . 18 1 1 A 81 81 LEU HA H 81 4.270 4.296 -0.026 1
1 842 . 18 1 1 A 81 81 LEU CA C 81 55.000 54.362 0.638 1
1 843 . 18 1 1 A 81 81 LEU CB C 81 42.200 43.715 -1.515 1
1 847 . 18 1 1 A 81 81 LEU N N 81 124.100 119.431 4.669 1
1 848 . 18 1 1 A 82 82 ARG H H 82 8.310 9.093 -0.783 1
1 849 . 18 1 1 A 82 82 ARG HA H 82 4.200 4.432 -0.232 1
1 852 . 18 1 1 A 82 82 ARG CA C 82 56.300 57.371 -1.071 1
1 853 . 18 1 1 A 82 82 ARG CB C 82 30.700 32.528 -1.828 1
1 855 . 18 1 1 A 82 82 ARG N N 82 121.500 121.037 0.463 1
1 856 . 18 1 1 A 83 83 GLY H H 83 8.410 7.517 0.893 1
1 857 . 18 1 1 A 83 83 GLY HA2 H 83 3.750 3.898 -0.148 1
1 858 . 18 1 1 A 83 83 GLY HA3 H 83 3.754 4.002 -0.248 1
1 859 . 18 1 1 A 83 83 GLY CA C 83 45.100 45.508 -0.408 1
1 860 . 18 1 1 A 83 83 GLY N N 83 110.200 106.331 3.869 1
1 861 . 18 1 1 A 84 84 TYR H H 84 7.950 8.445 -0.495 1
1 862 . 18 1 1 A 84 84 TYR HA H 84 4.400 5.239 -0.839 1
1 865 . 18 1 1 A 84 84 TYR CA C 84 58.100 56.422 1.678 1
1 866 . 18 1 1 A 84 84 TYR CB C 84 38.800 43.359 -4.559 1
1 867 . 18 1 1 A 84 84 TYR N N 84 119.900 120.136 -0.236 1
1 868 . 18 1 1 A 85 85 ALA H H 85 8.150 8.677 -0.527 1
1 869 . 18 1 1 A 85 85 ALA HA H 85 4.150 5.138 -0.988 1
1 873 . 18 1 1 A 85 85 ALA CA C 85 52.600 52.018 0.582 1
1 874 . 18 1 1 A 85 85 ALA CB C 85 19.200 20.825 -1.625 1
1 875 . 18 1 1 A 85 85 ALA N N 85 124.800 122.800 2.000 1
1 876 . 18 1 1 A 86 86 ASP H H 86 8.020 8.654 -0.634 1
1 877 . 18 1 1 A 86 86 ASP HA H 86 4.450 5.071 -0.621 1
1 880 . 18 1 1 A 86 86 ASP CA C 86 54.100 53.353 0.747 1
1 881 . 18 1 1 A 86 86 ASP CB C 86 41.100 44.576 -3.476 1
1 882 . 18 1 1 A 86 86 ASP N N 86 118.900 121.295 -2.395 1
1 883 . 18 1 1 A 87 87 LEU H H 87 8.010 8.354 -0.344 1
1 884 . 18 1 1 A 87 87 LEU HA H 87 4.210 4.734 -0.524 1
1 893 . 18 1 1 A 87 87 LEU CA C 87 55.300 54.061 1.239 1
1 894 . 18 1 1 A 87 87 LEU CB C 87 42.000 43.103 -1.103 1
1 898 . 18 1 1 A 87 87 LEU N N 87 122.400 122.454 -0.054 1
1 899 . 18 1 1 A 88 88 ARG H H 88 8.170 8.421 -0.251 1
1 900 . 18 1 1 A 88 88 ARG HA H 88 4.210 4.605 -0.395 1
1 903 . 18 1 1 A 88 88 ARG CA C 88 56.300 55.362 0.938 1
1 904 . 18 1 1 A 88 88 ARG CB C 88 30.600 33.327 -2.727 1
1 905 . 18 1 1 A 88 88 ARG N N 88 121.200 121.000 0.200 1
1 906 . 18 1 1 A 91 91 PRO HA H 91 4.290 4.700 -0.410 1
1 911 . 18 1 1 A 91 91 PRO CA C 91 63.800 62.404 1.396 1
1 912 . 18 1 1 A 91 91 PRO CB C 91 32.100 29.504 2.596 1
1 915 . 18 1 1 A 92 92 ASP H H 92 8.280 8.401 -0.121 1
1 916 . 18 1 1 A 92 92 ASP HA H 92 4.540 4.976 -0.436 1
1 919 . 18 1 1 A 92 92 ASP CA C 92 54.600 53.566 1.034 1
1 920 . 18 1 1 A 92 92 ASP CB C 92 41.000 44.643 -3.643 1
1 921 . 18 1 1 A 92 92 ASP N N 92 118.700 123.383 -4.683 1
1 922 . 18 1 1 A 93 93 ARG H H 93 7.780 8.477 -0.697 1
1 923 . 18 1 1 A 93 93 ARG HA H 93 4.190 4.412 -0.222 1
1 930 . 18 1 1 A 93 93 ARG CA C 93 56.300 55.988 0.312 1
1 931 . 18 1 1 A 93 93 ARG CB C 93 30.700 31.623 -0.923 1
1 934 . 18 1 1 A 93 93 ARG N N 93 120.700 124.449 -3.749 1
1 935 . 18 1 1 A 94 94 GLN H H 94 8.280 8.229 0.051 1
1 936 . 18 1 1 A 94 94 GLN HA H 94 4.210 4.541 -0.331 1
1 941 . 18 1 1 A 94 94 GLN CA C 94 55.800 55.701 0.099 1
1 942 . 18 1 1 A 94 94 GLN CB C 94 29.300 29.616 -0.316 1
1 944 . 18 1 1 A 94 94 GLN N N 94 121.000 119.584 1.416 1
1 945 . 18 1 1 A 95 95 ASP H H 95 8.270 8.783 -0.513 1
1 946 . 18 1 1 A 95 95 ASP HA H 95 4.450 5.249 -0.799 1
1 949 . 18 1 1 A 95 95 ASP CA C 95 54.300 53.957 0.343 1
1 950 . 18 1 1 A 95 95 ASP CB C 95 41.000 44.472 -3.472 1
1 951 . 18 1 1 A 95 95 ASP N N 95 121.000 121.277 -0.277 1
1 952 . 18 1 1 A 96 96 HIS H H 96 8.090 8.672 -0.582 1
1 953 . 18 1 1 A 96 96 HIS HA H 96 4.470 4.743 -0.273 1
1 956 . 18 1 1 A 96 96 HIS CA C 96 55.900 55.900 0.000 1
1 957 . 18 1 1 A 96 96 HIS CB C 96 30.500 31.824 -1.324 1
1 958 . 18 1 1 A 96 96 HIS N N 96 119.300 121.952 -2.652 1
1 959 . 18 1 1 A 97 97 HIS H H 97 8.240 7.939 0.301 1
1 960 . 18 1 1 A 97 97 HIS HA H 97 4.470 4.981 -0.511 1
1 963 . 18 1 1 A 97 97 HIS CA C 97 56.200 53.697 2.503 1
1 964 . 18 1 1 A 97 97 HIS CB C 97 30.400 30.607 -0.207 1
1 965 . 18 1 1 A 97 97 HIS N N 97 121.300 116.878 4.422 1
1 966 . 18 1 1 A 98 98 PRO HA H 98 4.340 4.467 -0.127 1
1 973 . 18 1 1 A 98 98 PRO CA C 98 63.700 62.952 0.748 1
1 974 . 18 1 1 A 98 98 PRO CB C 98 31.900 33.325 -1.425 1
1 977 . 18 1 1 A 99 99 GLY H H 99 8.660 8.244 0.416 1
1 978 . 18 1 1 A 99 99 GLY HA2 H 99 3.920 4.165 -0.245 1
1 979 . 18 1 1 A 99 99 GLY HA3 H 99 3.920 4.182 -0.262 1
1 980 . 18 1 1 A 99 99 GLY CA C 99 45.200 45.724 -0.524 1
1 981 . 18 1 1 A 99 99 GLY N N 99 110.000 108.310 1.690 1
1 982 . 18 1 1 A 100 100 SER H H 100 8.170 8.853 -0.683 1
1 983 . 18 1 1 A 100 100 SER HA H 100 4.360 4.899 -0.539 1
1 986 . 18 1 1 A 100 100 SER CA C 100 58.500 57.569 0.931 1
1 987 . 18 1 1 A 100 100 SER CB C 100 64.000 66.252 -2.252 1
1 988 . 18 1 1 A 100 100 SER N N 100 115.600 117.435 -1.835 1
1 989 . 18 1 1 A 101 101 GLY H H 101 8.420 8.342 0.078 1
1 990 . 18 1 1 A 101 101 GLY HA2 H 101 3.890 4.167 -0.277 1
1 991 . 18 1 1 A 101 101 GLY HA3 H 101 3.920 4.168 -0.248 1
1 992 . 18 1 1 A 101 101 GLY CA C 101 45.200 45.885 -0.685 1
1 993 . 18 1 1 A 101 101 GLY N N 101 111.000 106.899 4.101 1
1 994 . 18 1 1 A 102 102 ALA H H 102 8.030 8.536 -0.506 1
1 995 . 18 1 1 A 102 102 ALA HA H 102 4.250 4.691 -0.441 1
1 999 . 18 1 1 A 102 102 ALA CA C 102 52.500 51.325 1.175 1
1 1000 . 18 1 1 A 102 102 ALA CB C 102 19.200 22.651 -3.451 1
1 4 . 19 1 1 A 2 2 SER H H 2 8.160 8.636 -0.476 1
1 5 . 19 1 1 A 2 2 SER HA H 2 4.370 3.985 0.385 1
1 9 . 19 1 1 A 2 2 SER CA C 2 58.300 59.152 -0.852 1
1 10 . 19 1 1 A 2 2 SER CB C 2 63.900 61.425 2.475 1
1 11 . 19 1 1 A 2 2 SER N N 2 115.600 113.645 1.955 1
1 12 . 19 1 1 A 3 3 LEU H H 3 8.250 7.467 0.783 1
1 13 . 19 1 1 A 3 3 LEU HA H 3 4.280 4.853 -0.573 1
1 17 . 19 1 1 A 3 3 LEU CA C 3 55.200 53.572 1.628 1
1 18 . 19 1 1 A 3 3 LEU CB C 3 42.100 44.924 -2.824 1
1 19 . 19 1 1 A 3 3 LEU N N 3 124.100 120.847 3.253 1
1 20 . 19 1 1 A 4 4 VAL H H 4 7.950 9.048 -1.098 1
1 21 . 19 1 1 A 4 4 VAL HA H 4 4.680 4.431 0.249 1
1 26 . 19 1 1 A 4 4 VAL CA C 4 59.800 58.542 1.258 1
1 27 . 19 1 1 A 4 4 VAL CB C 4 32.500 34.764 -2.264 1
1 28 . 19 1 1 A 4 4 VAL N N 4 122.600 121.644 0.956 1
1 29 . 19 1 1 A 5 5 PRO CA C 5 63.100 62.301 0.799 1
1 30 . 19 1 1 A 5 5 PRO CB C 5 32.000 33.059 -1.059 1
1 32 . 19 1 1 A 6 6 ARG H H 6 8.360 8.460 -0.100 1
1 33 . 19 1 1 A 6 6 ARG HA H 6 4.250 4.824 -0.574 1
1 36 . 19 1 1 A 6 6 ARG CA C 6 56.000 54.627 1.373 1
1 37 . 19 1 1 A 6 6 ARG CB C 6 30.900 33.564 -2.664 1
1 38 . 19 1 1 A 6 6 ARG N N 6 121.800 119.972 1.828 1
1 39 . 19 1 1 A 7 7 GLY H H 7 8.460 8.230 0.230 1
1 40 . 19 1 1 A 7 7 GLY HA2 H 7 3.940 4.197 -0.257 1
1 41 . 19 1 1 A 7 7 GLY HA3 H 7 3.760 4.215 -0.455 1
1 42 . 19 1 1 A 7 7 GLY CA C 7 45.000 45.442 -0.442 1
1 43 . 19 1 1 A 7 7 GLY N N 7 110.700 108.841 1.859 1
1 44 . 19 1 1 A 8 8 SER H H 8 7.990 8.554 -0.564 1
1 45 . 19 1 1 A 8 8 SER HA H 8 4.450 4.663 -0.213 1
1 48 . 19 1 1 A 8 8 SER CA C 8 58.900 59.078 -0.178 1
1 49 . 19 1 1 A 8 8 SER CB C 8 64.200 64.648 -0.448 1
1 50 . 19 1 1 A 8 8 SER N N 8 115.500 115.042 0.458 1
1 51 . 19 1 1 A 9 9 MET H H 9 9.040 7.524 1.516 1
1 52 . 19 1 1 A 9 9 MET HA H 9 4.610 5.119 -0.509 1
1 60 . 19 1 1 A 9 9 MET CA C 9 54.400 53.657 0.743 1
1 61 . 19 1 1 A 9 9 MET CB C 9 35.400 34.191 1.209 1
1 64 . 19 1 1 A 9 9 MET N N 9 120.500 118.894 1.606 1
1 65 . 19 1 1 A 10 10 GLN H H 10 8.270 9.043 -0.773 1
1 66 . 19 1 1 A 10 10 GLN HA H 10 5.270 5.315 -0.045 1
1 71 . 19 1 1 A 10 10 GLN CA C 10 54.200 54.424 -0.224 1
1 72 . 19 1 1 A 10 10 GLN CB C 10 30.500 32.366 -1.866 1
1 74 . 19 1 1 A 10 10 GLN N N 10 121.000 122.251 -1.251 1
1 75 . 19 1 1 A 11 11 ILE H H 11 8.270 8.805 -0.535 1
1 76 . 19 1 1 A 11 11 ILE HA H 11 4.100 4.883 -0.783 1
1 86 . 19 1 1 A 11 11 ILE CA C 11 59.400 59.108 0.292 1
1 87 . 19 1 1 A 11 11 ILE CB C 11 41.800 41.414 0.386 1
1 91 . 19 1 1 A 11 11 ILE N N 11 114.600 121.560 -6.960 1
1 92 . 19 1 1 A 12 12 PHE H H 12 8.520 8.806 -0.286 1
1 93 . 19 1 1 A 12 12 PHE HA H 12 5.540 5.347 0.193 1
1 96 . 19 1 1 A 12 12 PHE CA C 12 55.000 56.606 -1.606 1
1 97 . 19 1 1 A 12 12 PHE CB C 12 41.200 41.218 -0.018 1
1 98 . 19 1 1 A 12 12 PHE N N 12 118.600 124.992 -6.392 1
1 99 . 19 1 1 A 13 13 VAL H H 13 9.230 8.780 0.450 1
1 100 . 19 1 1 A 13 13 VAL HA H 13 4.740 5.260 -0.520 1
1 108 . 19 1 1 A 13 13 VAL CA C 13 60.300 59.976 0.324 1
1 109 . 19 1 1 A 13 13 VAL CB C 13 34.100 34.901 -0.801 1
1 112 . 19 1 1 A 13 13 VAL N N 13 121.400 124.050 -2.650 1
1 113 . 19 1 1 A 14 14 LYS H H 14 8.910 8.513 0.397 1
1 114 . 19 1 1 A 14 14 LYS HA H 14 5.190 4.532 0.658 1
1 122 . 19 1 1 A 14 14 LYS CA C 14 54.600 55.024 -0.424 1
1 123 . 19 1 1 A 14 14 LYS CB C 14 34.300 33.468 0.832 1
1 126 . 19 1 1 A 14 14 LYS N N 14 128.000 127.899 0.101 1
1 127 . 19 1 1 A 15 15 THR H H 15 8.650 8.734 -0.084 1
1 128 . 19 1 1 A 15 15 THR HA H 15 4.870 4.686 0.184 1
1 133 . 19 1 1 A 15 15 THR CA C 15 60.300 60.810 -0.510 1
1 134 . 19 1 1 A 15 15 THR CB C 15 70.600 71.351 -0.751 1
1 136 . 19 1 1 A 15 15 THR N N 15 115.300 116.194 -0.894 1
1 137 . 19 1 1 A 16 16 LEU H H 16 9.070 8.812 0.258 1
1 138 . 19 1 1 A 16 16 LEU HA H 16 4.210 3.990 0.220 1
1 148 . 19 1 1 A 16 16 LEU CA C 16 57.400 57.888 -0.488 1
1 149 . 19 1 1 A 16 16 LEU CB C 16 41.800 41.349 0.451 1
1 153 . 19 1 1 A 16 16 LEU N N 16 121.400 122.602 -1.202 1
1 154 . 19 1 1 A 17 17 THR H H 17 7.560 7.798 -0.238 1
1 155 . 19 1 1 A 17 17 THR HA H 17 4.330 4.305 0.025 1
1 160 . 19 1 1 A 17 17 THR CA C 17 61.400 63.454 -2.054 1
1 161 . 19 1 1 A 17 17 THR CB C 17 68.900 69.518 -0.618 1
1 163 . 19 1 1 A 17 17 THR N N 17 105.900 111.983 -6.083 1
1 164 . 19 1 1 A 18 18 GLY H H 18 7.750 7.803 -0.053 1
1 165 . 19 1 1 A 18 18 GLY HA2 H 18 4.250 4.035 0.215 1
1 166 . 19 1 1 A 18 18 GLY HA3 H 18 3.520 4.050 -0.530 1
1 167 . 19 1 1 A 18 18 GLY CA C 18 45.300 44.896 0.404 1
1 168 . 19 1 1 A 18 18 GLY N N 18 109.300 109.071 0.229 1
1 169 . 19 1 1 A 19 19 LYS H H 19 7.210 7.761 -0.551 1
1 170 . 19 1 1 A 19 19 LYS HA H 19 4.260 4.248 0.012 1
1 175 . 19 1 1 A 19 19 LYS CA C 19 56.300 56.620 -0.320 1
1 176 . 19 1 1 A 19 19 LYS CB C 19 33.200 33.864 -0.664 1
1 179 . 19 1 1 A 19 19 LYS N N 19 122.000 120.667 1.333 1
1 180 . 19 1 1 A 20 20 THR H H 20 8.570 8.675 -0.105 1
1 181 . 19 1 1 A 20 20 THR HA H 20 4.950 5.293 -0.343 1
1 186 . 19 1 1 A 20 20 THR CA C 20 62.200 60.302 1.898 1
1 187 . 19 1 1 A 20 20 THR CB C 20 69.700 70.699 -0.999 1
1 189 . 19 1 1 A 20 20 THR N N 20 120.700 112.464 8.236 1
1 190 . 19 1 1 A 21 21 ILE H H 21 9.510 8.297 1.213 1
1 191 . 19 1 1 A 21 21 ILE HA H 21 4.390 4.829 -0.439 1
1 201 . 19 1 1 A 21 21 ILE CA C 21 60.000 59.053 0.947 1
1 202 . 19 1 1 A 21 21 ILE CB C 21 40.700 41.686 -0.986 1
1 206 . 19 1 1 A 21 21 ILE N N 21 128.200 122.857 5.343 1
1 207 . 19 1 1 A 22 22 THR H H 22 8.700 8.757 -0.057 1
1 208 . 19 1 1 A 22 22 THR HA H 22 4.860 4.498 0.362 1
1 213 . 19 1 1 A 22 22 THR CA C 22 62.100 62.913 -0.813 1
1 214 . 19 1 1 A 22 22 THR CB C 22 69.500 68.900 0.600 1
1 216 . 19 1 1 A 22 22 THR N N 22 122.300 121.089 1.211 1
1 217 . 19 1 1 A 23 23 LEU H H 23 8.720 8.836 -0.116 1
1 218 . 19 1 1 A 23 23 LEU HA H 23 4.690 4.996 -0.306 1
1 228 . 19 1 1 A 23 23 LEU CA C 23 52.700 53.741 -1.041 1
1 229 . 19 1 1 A 23 23 LEU CB C 23 46.600 45.923 0.677 1
1 233 . 19 1 1 A 23 23 LEU N N 23 125.400 127.220 -1.820 1
1 234 . 19 1 1 A 24 24 GLU H H 24 8.080 8.584 -0.504 1
1 235 . 19 1 1 A 24 24 GLU HA H 24 4.800 4.994 -0.194 1
1 238 . 19 1 1 A 24 24 GLU CA C 24 55.400 55.360 0.040 1
1 239 . 19 1 1 A 24 24 GLU CB C 24 30.100 31.711 -1.611 1
1 241 . 19 1 1 A 24 24 GLU N N 24 121.800 118.761 3.039 1
1 242 . 19 1 1 A 25 25 VAL H H 25 8.800 8.813 -0.013 1
1 243 . 19 1 1 A 25 25 VAL HA H 25 4.640 4.973 -0.333 1
1 251 . 19 1 1 A 25 25 VAL CA C 25 58.600 59.395 -0.795 1
1 252 . 19 1 1 A 25 25 VAL CB C 25 36.300 36.218 0.082 1
1 255 . 19 1 1 A 25 25 VAL N N 25 116.700 117.271 -0.571 1
1 256 . 19 1 1 A 26 26 GLU H H 26 8.500 8.438 0.062 1
1 257 . 19 1 1 A 26 26 GLU HA H 26 4.900 4.585 0.315 1
1 260 . 19 1 1 A 26 26 GLU CA C 26 53.000 53.966 -0.966 1
1 261 . 19 1 1 A 26 26 GLU CB C 26 31.200 34.122 -2.922 1
1 262 . 19 1 1 A 26 26 GLU N N 26 117.900 121.157 -3.257 1
1 263 . 19 1 1 A 27 27 PRO HA H 27 4.040 4.379 -0.339 1
1 270 . 19 1 1 A 27 27 PRO CA C 27 65.400 64.844 0.556 1
1 271 . 19 1 1 A 27 27 PRO CB C 27 31.700 32.071 -0.371 1
1 274 . 19 1 1 A 28 28 SER H H 28 7.010 8.084 -1.074 1
1 275 . 19 1 1 A 28 28 SER HA H 28 4.280 4.460 -0.180 1
1 278 . 19 1 1 A 28 28 SER CA C 28 57.400 58.321 -0.921 1
1 279 . 19 1 1 A 28 28 SER CB C 28 63.400 64.165 -0.765 1
1 280 . 19 1 1 A 28 28 SER N N 28 103.800 110.295 -6.495 1
1 281 . 19 1 1 A 29 29 ASP H H 29 7.960 7.807 0.153 1
1 282 . 19 1 1 A 29 29 ASP HA H 29 4.600 4.927 -0.327 1
1 285 . 19 1 1 A 29 29 ASP CA C 29 55.900 53.522 2.378 1
1 286 . 19 1 1 A 29 29 ASP CB C 29 41.000 41.452 -0.452 1
1 287 . 19 1 1 A 29 29 ASP N N 29 123.700 121.857 1.843 1
1 288 . 19 1 1 A 30 30 THR H H 30 7.780 8.883 -1.103 1
1 289 . 19 1 1 A 30 30 THR HA H 30 4.850 4.762 0.088 1
1 294 . 19 1 1 A 30 30 THR CA C 30 59.400 60.642 -1.242 1
1 295 . 19 1 1 A 30 30 THR CB C 30 71.100 71.352 -0.252 1
1 297 . 19 1 1 A 30 30 THR N N 30 108.800 117.335 -8.535 1
1 298 . 19 1 1 A 31 31 ILE H H 31 8.320 8.939 -0.619 1
1 299 . 19 1 1 A 31 31 ILE HA H 31 3.580 3.737 -0.157 1
1 309 . 19 1 1 A 31 31 ILE CA C 31 62.200 64.606 -2.406 1
1 310 . 19 1 1 A 31 31 ILE CB C 31 34.300 37.487 -3.187 1
1 314 . 19 1 1 A 31 31 ILE N N 31 121.300 122.440 -1.140 1
1 315 . 19 1 1 A 32 32 GLU H H 32 9.850 8.048 1.802 1
1 316 . 19 1 1 A 32 32 GLU HA H 32 3.780 3.923 -0.143 1
1 321 . 19 1 1 A 32 32 GLU CA C 32 60.500 59.982 0.518 1
1 322 . 19 1 1 A 32 32 GLU CB C 32 28.800 29.332 -0.532 1
1 324 . 19 1 1 A 32 32 GLU N N 32 121.600 122.314 -0.714 1
1 325 . 19 1 1 A 33 33 ASN H H 33 7.810 7.605 0.205 1
1 326 . 19 1 1 A 33 33 ASN HA H 33 4.440 4.621 -0.181 1
1 329 . 19 1 1 A 33 33 ASN CA C 33 55.800 55.770 0.030 1
1 330 . 19 1 1 A 33 33 ASN CB C 33 38.100 38.711 -0.611 1
1 331 . 19 1 1 A 33 33 ASN N N 33 121.000 117.815 3.185 1
1 332 . 19 1 1 A 34 34 VAL H H 34 8.000 7.776 0.224 1
1 333 . 19 1 1 A 34 34 VAL HA H 34 3.300 3.552 -0.252 1
1 341 . 19 1 1 A 34 34 VAL CA C 34 67.600 67.109 0.491 1
1 342 . 19 1 1 A 34 34 VAL CB C 34 30.700 31.354 -0.654 1
1 345 . 19 1 1 A 34 34 VAL N N 34 122.200 120.970 1.230 1
1 346 . 19 1 1 A 35 35 LYS H H 35 8.490 8.525 -0.035 1
1 347 . 19 1 1 A 35 35 LYS HA H 35 4.500 4.072 0.428 1
1 352 . 19 1 1 A 35 35 LYS CA C 35 59.300 58.686 0.614 1
1 353 . 19 1 1 A 35 35 LYS CB C 35 33.500 32.041 1.459 1
1 354 . 19 1 1 A 35 35 LYS N N 35 119.200 120.283 -1.083 1
1 355 . 19 1 1 A 36 36 ALA H H 36 7.880 7.919 -0.039 1
1 356 . 19 1 1 A 36 36 ALA HA H 36 4.060 4.047 0.013 1
1 360 . 19 1 1 A 36 36 ALA CA C 36 55.300 54.853 0.447 1
1 361 . 19 1 1 A 36 36 ALA CB C 36 17.600 18.086 -0.486 1
1 362 . 19 1 1 A 36 36 ALA N N 36 123.300 121.765 1.535 1
1 363 . 19 1 1 A 37 37 LYS H H 37 7.790 7.885 -0.095 1
1 364 . 19 1 1 A 37 37 LYS HA H 37 4.110 4.091 0.019 1
1 373 . 19 1 1 A 37 37 LYS CA C 37 59.700 59.669 0.031 1
1 374 . 19 1 1 A 37 37 LYS CB C 37 33.100 32.456 0.644 1
1 378 . 19 1 1 A 37 37 LYS N N 37 120.400 117.163 3.237 1
1 379 . 19 1 1 A 38 38 ILE H H 38 8.240 7.991 0.249 1
1 380 . 19 1 1 A 38 38 ILE HA H 38 3.410 3.973 -0.563 1
1 390 . 19 1 1 A 38 38 ILE CA C 38 66.200 62.085 4.115 1
1 391 . 19 1 1 A 38 38 ILE CB C 38 36.800 37.797 -0.997 1
1 395 . 19 1 1 A 38 38 ILE N N 38 121.400 119.781 1.619 1
1 396 . 19 1 1 A 39 39 GLN H H 39 8.460 8.513 -0.053 1
1 397 . 19 1 1 A 39 39 GLN HA H 39 3.730 4.027 -0.297 1
1 402 . 19 1 1 A 39 39 GLN CA C 39 60.000 58.672 1.328 1
1 403 . 19 1 1 A 39 39 GLN CB C 39 27.600 28.676 -1.076 1
1 405 . 19 1 1 A 39 39 GLN N N 39 123.500 121.415 2.085 1
1 406 . 19 1 1 A 40 40 ASP H H 40 7.970 8.016 -0.046 1
1 407 . 19 1 1 A 40 40 ASP HA H 40 4.240 4.494 -0.254 1
1 410 . 19 1 1 A 40 40 ASP CA C 40 57.400 56.702 0.698 1
1 411 . 19 1 1 A 40 40 ASP CB C 40 41.000 40.507 0.493 1
1 412 . 19 1 1 A 40 40 ASP N N 40 119.900 118.530 1.370 1
1 413 . 19 1 1 A 41 41 LYS H H 41 7.420 7.648 -0.228 1
1 414 . 19 1 1 A 41 41 LYS HA H 41 4.200 4.147 0.053 1
1 423 . 19 1 1 A 41 41 LYS CA C 41 58.200 59.083 -0.883 1
1 424 . 19 1 1 A 41 41 LYS CB C 41 33.900 32.775 1.125 1
1 427 . 19 1 1 A 41 41 LYS N N 41 115.700 120.875 -5.175 1
1 428 . 19 1 1 A 42 42 GLU H H 42 8.650 7.766 0.884 1
1 429 . 19 1 1 A 42 42 GLU HA H 42 4.470 4.864 -0.394 1
1 434 . 19 1 1 A 42 42 GLU CA C 42 55.300 55.842 -0.542 1
1 435 . 19 1 1 A 42 42 GLU CB C 42 33.200 32.065 1.135 1
1 437 . 19 1 1 A 42 42 GLU N N 42 114.200 113.578 0.622 1
1 438 . 19 1 1 A 43 43 GLY H H 43 8.400 7.936 0.464 1
1 439 . 19 1 1 A 43 43 GLY HA2 H 43 4.040 3.989 0.051 1
1 440 . 19 1 1 A 43 43 GLY HA3 H 43 3.820 3.993 -0.173 1
1 441 . 19 1 1 A 43 43 GLY CA C 43 45.900 45.300 0.600 1
1 442 . 19 1 1 A 43 43 GLY N N 43 109.000 109.608 -0.608 1
1 443 . 19 1 1 A 44 44 ILE H H 44 6.080 7.538 -1.458 1
1 444 . 19 1 1 A 44 44 ILE HA H 44 4.290 4.141 0.149 1
1 446 . 19 1 1 A 44 44 ILE CA C 44 57.700 59.428 -1.728 1
1 447 . 19 1 1 A 44 44 ILE CB C 44 40.400 38.529 1.871 1
1 448 . 19 1 1 A 44 44 ILE N N 44 120.500 122.473 -1.973 1
1 449 . 19 1 1 A 46 46 PRO HA H 46 4.030 4.209 -0.179 1
1 454 . 19 1 1 A 46 46 PRO CA C 46 66.100 65.281 0.819 1
1 455 . 19 1 1 A 46 46 PRO CB C 46 32.600 32.061 0.539 1
1 458 . 19 1 1 A 47 47 ASP H H 47 8.470 8.598 -0.128 1
1 459 . 19 1 1 A 47 47 ASP HA H 47 4.310 4.347 -0.037 1
1 462 . 19 1 1 A 47 47 ASP CA C 47 55.700 57.149 -1.449 1
1 463 . 19 1 1 A 47 47 ASP CB C 47 39.700 40.201 -0.501 1
1 464 . 19 1 1 A 47 47 ASP N N 47 113.700 117.491 -3.791 1
1 465 . 19 1 1 A 48 48 GLN H H 48 7.720 7.422 0.298 1
1 466 . 19 1 1 A 48 48 GLN HA H 48 4.340 4.433 -0.093 1
1 471 . 19 1 1 A 48 48 GLN CA C 48 55.500 55.131 0.369 1
1 472 . 19 1 1 A 48 48 GLN CB C 48 29.900 29.435 0.465 1
1 474 . 19 1 1 A 48 48 GLN N N 48 116.900 115.466 1.434 1
1 475 . 19 1 1 A 49 49 GLN H H 49 7.410 7.671 -0.261 1
1 476 . 19 1 1 A 49 49 GLN HA H 49 4.110 4.636 -0.526 1
1 481 . 19 1 1 A 49 49 GLN CA C 49 56.600 55.328 1.272 1
1 482 . 19 1 1 A 49 49 GLN CB C 49 31.300 30.333 0.967 1
1 484 . 19 1 1 A 49 49 GLN N N 49 118.000 121.423 -3.423 1
1 485 . 19 1 1 A 50 50 ARG H H 50 8.400 8.531 -0.131 1
1 486 . 19 1 1 A 50 50 ARG HA H 50 4.380 4.613 -0.233 1
1 491 . 19 1 1 A 50 50 ARG CA C 50 55.100 55.566 -0.466 1
1 492 . 19 1 1 A 50 50 ARG CB C 50 31.600 31.149 0.451 1
1 494 . 19 1 1 A 50 50 ARG N N 50 123.100 123.053 0.047 1
1 495 . 19 1 1 A 51 51 LEU H H 51 8.710 9.028 -0.318 1
1 496 . 19 1 1 A 51 51 LEU HA H 51 5.300 4.850 0.450 1
1 506 . 19 1 1 A 51 51 LEU CA C 51 52.900 53.424 -0.524 1
1 507 . 19 1 1 A 51 51 LEU CB C 51 45.700 42.247 3.453 1
1 511 . 19 1 1 A 51 51 LEU N N 51 124.400 125.437 -1.037 1
1 512 . 19 1 1 A 52 52 ILE H H 52 9.060 9.020 0.040 1
1 513 . 19 1 1 A 52 52 ILE HA H 52 4.840 4.814 0.026 1
1 523 . 19 1 1 A 52 52 ILE CA C 52 58.900 60.487 -1.587 1
1 524 . 19 1 1 A 52 52 ILE CB C 52 41.200 39.818 1.382 1
1 528 . 19 1 1 A 52 52 ILE N N 52 122.500 125.317 -2.817 1
1 529 . 19 1 1 A 53 53 PHE H H 53 8.730 9.447 -0.717 1
1 530 . 19 1 1 A 53 53 PHE HA H 53 5.100 4.761 0.339 1
1 535 . 19 1 1 A 53 53 PHE CA C 53 56.300 57.444 -1.144 1
1 536 . 19 1 1 A 53 53 PHE CB C 53 43.500 41.925 1.575 1
1 537 . 19 1 1 A 53 53 PHE N N 53 124.800 127.627 -2.827 1
1 538 . 19 1 1 A 54 54 ALA H H 54 8.940 9.159 -0.219 1
1 539 . 19 1 1 A 54 54 ALA HA H 54 3.610 3.876 -0.266 1
1 543 . 19 1 1 A 54 54 ALA CA C 54 52.500 52.988 -0.488 1
1 544 . 19 1 1 A 54 54 ALA CB C 54 16.300 17.315 -1.015 1
1 545 . 19 1 1 A 54 54 ALA N N 54 133.100 130.379 2.721 1
1 546 . 19 1 1 A 55 55 GLY H H 55 8.070 8.590 -0.520 1
1 547 . 19 1 1 A 55 55 GLY HA2 H 55 4.000 3.844 0.156 1
1 548 . 19 1 1 A 55 55 GLY HA3 H 55 3.340 3.865 -0.525 1
1 549 . 19 1 1 A 55 55 GLY CA C 55 45.200 45.657 -0.457 1
1 550 . 19 1 1 A 55 55 GLY N N 55 102.500 102.663 -0.163 1
1 551 . 19 1 1 A 56 56 LYS H H 56 7.860 7.705 0.155 1
1 552 . 19 1 1 A 56 56 LYS HA H 56 4.510 4.832 -0.322 1
1 558 . 19 1 1 A 56 56 LYS CA C 56 54.500 54.881 -0.381 1
1 559 . 19 1 1 A 56 56 LYS CB C 56 34.400 35.401 -1.001 1
1 561 . 19 1 1 A 56 56 LYS N N 56 121.800 120.221 1.579 1
1 562 . 19 1 1 A 57 57 GLN H H 57 8.600 8.894 -0.294 1
1 563 . 19 1 1 A 57 57 GLN HA H 57 4.410 5.112 -0.702 1
1 568 . 19 1 1 A 57 57 GLN CA C 57 55.900 55.561 0.339 1
1 569 . 19 1 1 A 57 57 GLN CB C 57 28.800 29.837 -1.037 1
1 571 . 19 1 1 A 57 57 GLN N N 57 123.200 127.775 -4.575 1
1 572 . 19 1 1 A 58 58 LEU H H 58 8.480 8.443 0.037 1
1 573 . 19 1 1 A 58 58 LEU HA H 58 4.060 5.126 -1.066 1
1 583 . 19 1 1 A 58 58 LEU CA C 58 54.100 53.025 1.075 1
1 584 . 19 1 1 A 58 58 LEU CB C 58 41.500 45.634 -4.134 1
1 588 . 19 1 1 A 58 58 LEU N N 58 125.900 120.728 5.172 1
1 589 . 19 1 1 A 59 59 GLU H H 59 8.400 8.281 0.119 1
1 590 . 19 1 1 A 59 59 GLU HA H 59 4.400 4.803 -0.403 1
1 595 . 19 1 1 A 59 59 GLU CA C 59 55.900 55.244 0.656 1
1 596 . 19 1 1 A 59 59 GLU CB C 59 31.900 31.600 0.300 1
1 598 . 19 1 1 A 59 59 GLU N N 59 123.100 118.990 4.110 1
1 599 . 19 1 1 A 60 60 ASP H H 60 8.110 8.554 -0.444 1
1 600 . 19 1 1 A 60 60 ASP HA H 60 4.270 5.053 -0.783 1
1 603 . 19 1 1 A 60 60 ASP CA C 60 57.100 53.155 3.945 1
1 604 . 19 1 1 A 60 60 ASP CB C 60 40.800 45.094 -4.294 1
1 605 . 19 1 1 A 60 60 ASP N N 60 120.300 118.839 1.461 1
1 606 . 19 1 1 A 61 61 GLY HA2 H 61 4.000 4.004 -0.004 1
1 607 . 19 1 1 A 61 61 GLY HA3 H 61 3.830 4.019 -0.189 1
1 608 . 19 1 1 A 61 61 GLY CA C 61 45.000 45.263 -0.263 1
1 609 . 19 1 1 A 62 62 ARG H H 62 7.350 7.895 -0.545 1
1 610 . 19 1 1 A 62 62 ARG HA H 62 4.640 4.645 -0.005 1
1 615 . 19 1 1 A 62 62 ARG CA C 62 54.400 55.393 -0.993 1
1 616 . 19 1 1 A 62 62 ARG CB C 62 32.600 32.024 0.576 1
1 618 . 19 1 1 A 62 62 ARG N N 62 119.300 121.002 -1.702 1
1 619 . 19 1 1 A 63 63 THR H H 63 8.460 8.850 -0.390 1
1 620 . 19 1 1 A 63 63 THR HA H 63 5.060 4.696 0.364 1
1 625 . 19 1 1 A 63 63 THR CA C 63 59.700 60.783 -1.083 1
1 626 . 19 1 1 A 63 63 THR CB C 63 72.000 71.154 0.846 1
1 628 . 19 1 1 A 63 63 THR N N 63 109.100 112.754 -3.654 1
1 629 . 19 1 1 A 64 64 LEU H H 64 8.190 8.757 -0.567 1
1 630 . 19 1 1 A 64 64 LEU HA H 64 3.920 3.989 -0.069 1
1 640 . 19 1 1 A 64 64 LEU CA C 64 58.400 57.992 0.408 1
1 641 . 19 1 1 A 64 64 LEU CB C 64 40.200 41.543 -1.343 1
1 645 . 19 1 1 A 64 64 LEU N N 64 118.100 123.274 -5.174 1
1 646 . 19 1 1 A 65 65 SER H H 65 8.370 7.762 0.608 1
1 647 . 19 1 1 A 65 65 SER HA H 65 4.150 4.159 -0.009 1
1 650 . 19 1 1 A 65 65 SER CA C 65 60.900 61.274 -0.374 1
1 651 . 19 1 1 A 65 65 SER CB C 65 62.500 63.016 -0.516 1
1 652 . 19 1 1 A 65 65 SER N N 65 112.200 113.793 -1.593 1
1 653 . 19 1 1 A 66 66 GLU H H 66 7.780 8.167 -0.387 1
1 654 . 19 1 1 A 66 66 GLU HA H 66 3.890 4.203 -0.313 1
1 659 . 19 1 1 A 66 66 GLU CA C 66 59.200 58.656 0.544 1
1 660 . 19 1 1 A 66 66 GLU CB C 66 29.400 29.698 -0.298 1
1 662 . 19 1 1 A 66 66 GLU N N 66 123.600 122.015 1.585 1
1 663 . 19 1 1 A 67 67 TYR H H 67 7.290 7.848 -0.558 1
1 664 . 19 1 1 A 67 67 TYR HA H 67 4.590 4.508 0.082 1
1 669 . 19 1 1 A 67 67 TYR CA C 67 58.400 60.274 -1.874 1
1 670 . 19 1 1 A 67 67 TYR CB C 67 39.800 39.300 0.500 1
1 671 . 19 1 1 A 67 67 TYR N N 67 116.400 121.462 -5.062 1
1 672 . 19 1 1 A 68 68 ASN H H 68 8.040 7.881 0.159 1
1 673 . 19 1 1 A 68 68 ASN HA H 68 4.240 4.435 -0.195 1
1 676 . 19 1 1 A 68 68 ASN CA C 68 54.100 54.477 -0.377 1
1 677 . 19 1 1 A 68 68 ASN CB C 68 37.200 37.392 -0.192 1
1 678 . 19 1 1 A 68 68 ASN N N 68 115.600 116.010 -0.410 1
1 679 . 19 1 1 A 69 69 ILE H H 69 7.200 7.486 -0.286 1
1 680 . 19 1 1 A 69 69 ILE HA H 69 3.280 4.511 -1.231 1
1 690 . 19 1 1 A 69 69 ILE CA C 69 59.800 59.784 0.016 1
1 691 . 19 1 1 A 69 69 ILE CB C 69 36.600 39.677 -3.077 1
1 695 . 19 1 1 A 69 69 ILE N N 69 119.100 115.463 3.637 1
1 696 . 19 1 1 A 70 70 GLN H H 70 7.570 8.629 -1.059 1
1 697 . 19 1 1 A 70 70 GLN HA H 70 4.410 3.996 0.414 1
1 702 . 19 1 1 A 70 70 GLN CA C 70 53.500 57.889 -4.389 1
1 703 . 19 1 1 A 70 70 GLN CB C 70 31.500 28.592 2.908 1
1 705 . 19 1 1 A 70 70 GLN N N 70 124.800 122.688 2.112 1
1 706 . 19 1 1 A 71 71 LYS H H 71 8.370 7.276 1.094 1
1 707 . 19 1 1 A 71 71 LYS HA H 71 3.870 3.607 0.263 1
1 716 . 19 1 1 A 71 71 LYS CA C 71 58.000 57.099 0.901 1
1 717 . 19 1 1 A 71 71 LYS CB C 71 32.500 31.263 1.237 1
1 720 . 19 1 1 A 71 71 LYS N N 71 120.200 118.445 1.755 1
1 721 . 19 1 1 A 72 72 GLU H H 72 9.230 7.967 1.263 1
1 722 . 19 1 1 A 72 72 GLU HA H 72 3.240 4.639 -1.399 1
1 727 . 19 1 1 A 72 72 GLU CA C 72 58.300 55.431 2.869 1
1 728 . 19 1 1 A 72 72 GLU CB C 72 26.000 30.254 -4.254 1
1 730 . 19 1 1 A 72 72 GLU N N 72 115.100 117.865 -2.765 1
1 731 . 19 1 1 A 73 73 SER H H 73 7.690 7.908 -0.218 1
1 732 . 19 1 1 A 73 73 SER HA H 73 4.520 4.750 -0.230 1
1 735 . 19 1 1 A 73 73 SER CA C 73 61.100 59.076 2.024 1
1 736 . 19 1 1 A 73 73 SER CB C 73 64.800 65.102 -0.302 1
1 737 . 19 1 1 A 73 73 SER N N 73 115.300 114.279 1.021 1
1 738 . 19 1 1 A 74 74 THR H H 74 8.620 7.826 0.794 1
1 739 . 19 1 1 A 74 74 THR HA H 74 5.200 5.127 0.073 1
1 744 . 19 1 1 A 74 74 THR CA C 74 62.400 61.832 0.568 1
1 745 . 19 1 1 A 74 74 THR CB C 74 70.200 70.852 -0.652 1
1 747 . 19 1 1 A 74 74 THR N N 74 117.500 111.020 6.480 1
1 748 . 19 1 1 A 75 75 LEU H H 75 9.350 8.649 0.701 1
1 749 . 19 1 1 A 75 75 LEU HA H 75 4.990 4.953 0.037 1
1 759 . 19 1 1 A 75 75 LEU CA C 75 53.800 53.700 0.100 1
1 760 . 19 1 1 A 75 75 LEU CB C 75 44.400 45.556 -1.156 1
1 764 . 19 1 1 A 75 75 LEU N N 75 128.000 126.936 1.064 1
1 765 . 19 1 1 A 76 76 HIS H H 76 9.140 8.237 0.903 1
1 766 . 19 1 1 A 76 76 HIS HA H 76 5.040 5.105 -0.065 1
1 769 . 19 1 1 A 76 76 HIS CA C 76 56.200 54.120 2.080 1
1 770 . 19 1 1 A 76 76 HIS CB C 76 32.500 31.454 1.046 1
1 771 . 19 1 1 A 76 76 HIS N N 76 119.600 122.349 -2.749 1
1 772 . 19 1 1 A 77 77 LEU H H 77 8.240 8.912 -0.672 1
1 773 . 19 1 1 A 77 77 LEU HA H 77 5.080 5.444 -0.364 1
1 783 . 19 1 1 A 77 77 LEU CA C 77 53.600 53.810 -0.210 1
1 784 . 19 1 1 A 77 77 LEU CB C 77 44.100 43.736 0.364 1
1 788 . 19 1 1 A 77 77 LEU N N 77 123.800 121.078 2.722 1
1 789 . 19 1 1 A 78 78 VAL H H 78 9.110 8.836 0.274 1
1 790 . 19 1 1 A 78 78 VAL HA H 78 4.260 4.759 -0.499 1
1 798 . 19 1 1 A 78 78 VAL CA C 78 60.400 60.473 -0.073 1
1 799 . 19 1 1 A 78 78 VAL CB C 78 34.700 35.968 -1.268 1
1 802 . 19 1 1 A 78 78 VAL N N 78 127.100 124.547 2.553 1
1 803 . 19 1 1 A 79 79 LEU H H 79 8.050 8.930 -0.880 1
1 804 . 19 1 1 A 79 79 LEU HA H 79 4.950 4.946 0.004 1
1 813 . 19 1 1 A 79 79 LEU CA C 79 53.800 53.166 0.634 1
1 814 . 19 1 1 A 79 79 LEU CB C 79 42.700 44.544 -1.844 1
1 818 . 19 1 1 A 79 79 LEU N N 79 123.400 127.942 -4.542 1
1 819 . 19 1 1 A 80 80 ARG H H 80 8.540 8.303 0.237 1
1 820 . 19 1 1 A 80 80 ARG HA H 80 4.170 4.012 0.158 1
1 827 . 19 1 1 A 80 80 ARG CA C 80 55.800 56.862 -1.062 1
1 828 . 19 1 1 A 80 80 ARG CB C 80 31.100 28.014 3.086 1
1 830 . 19 1 1 A 80 80 ARG N N 80 123.500 125.052 -1.552 1
1 831 . 19 1 1 A 81 81 LEU H H 81 8.250 7.693 0.557 1
1 832 . 19 1 1 A 81 81 LEU HA H 81 4.270 4.323 -0.053 1
1 842 . 19 1 1 A 81 81 LEU CA C 81 55.000 54.541 0.459 1
1 843 . 19 1 1 A 81 81 LEU CB C 81 42.200 43.084 -0.884 1
1 847 . 19 1 1 A 81 81 LEU N N 81 124.100 118.684 5.416 1
1 848 . 19 1 1 A 82 82 ARG H H 82 8.310 8.955 -0.645 1
1 849 . 19 1 1 A 82 82 ARG HA H 82 4.200 4.557 -0.357 1
1 852 . 19 1 1 A 82 82 ARG CA C 82 56.300 56.775 -0.475 1
1 853 . 19 1 1 A 82 82 ARG CB C 82 30.700 32.879 -2.179 1
1 855 . 19 1 1 A 82 82 ARG N N 82 121.500 118.302 3.198 1
1 856 . 19 1 1 A 83 83 GLY H H 83 8.410 7.421 0.989 1
1 857 . 19 1 1 A 83 83 GLY HA2 H 83 3.750 4.078 -0.328 1
1 858 . 19 1 1 A 83 83 GLY HA3 H 83 3.754 4.165 -0.411 1
1 859 . 19 1 1 A 83 83 GLY CA C 83 45.100 46.133 -1.033 1
1 860 . 19 1 1 A 83 83 GLY N N 83 110.200 103.677 6.523 1
1 861 . 19 1 1 A 84 84 TYR H H 84 7.950 8.635 -0.685 1
1 862 . 19 1 1 A 84 84 TYR HA H 84 4.400 5.657 -1.257 1
1 865 . 19 1 1 A 84 84 TYR CA C 84 58.100 55.243 2.857 1
1 866 . 19 1 1 A 84 84 TYR CB C 84 38.800 41.733 -2.933 1
1 867 . 19 1 1 A 84 84 TYR N N 84 119.900 118.944 0.956 1
1 868 . 19 1 1 A 85 85 ALA H H 85 8.150 8.934 -0.784 1
1 869 . 19 1 1 A 85 85 ALA HA H 85 4.150 4.891 -0.741 1
1 873 . 19 1 1 A 85 85 ALA CA C 85 52.600 50.696 1.904 1
1 874 . 19 1 1 A 85 85 ALA CB C 85 19.200 23.170 -3.970 1
1 875 . 19 1 1 A 85 85 ALA N N 85 124.800 122.294 2.506 1
1 876 . 19 1 1 A 86 86 ASP H H 86 8.020 8.669 -0.649 1
1 877 . 19 1 1 A 86 86 ASP HA H 86 4.450 4.814 -0.364 1
1 880 . 19 1 1 A 86 86 ASP CA C 86 54.100 53.368 0.732 1
1 881 . 19 1 1 A 86 86 ASP CB C 86 41.100 41.586 -0.486 1
1 882 . 19 1 1 A 86 86 ASP N N 86 118.900 118.813 0.087 1
1 883 . 19 1 1 A 87 87 LEU H H 87 8.010 8.513 -0.503 1
1 884 . 19 1 1 A 87 87 LEU HA H 87 4.210 4.727 -0.517 1
1 893 . 19 1 1 A 87 87 LEU CA C 87 55.300 54.377 0.923 1
1 894 . 19 1 1 A 87 87 LEU CB C 87 42.000 42.231 -0.231 1
1 898 . 19 1 1 A 87 87 LEU N N 87 122.400 118.855 3.545 1
1 899 . 19 1 1 A 88 88 ARG H H 88 8.170 7.529 0.641 1
1 900 . 19 1 1 A 88 88 ARG HA H 88 4.210 4.163 0.047 1
1 903 . 19 1 1 A 88 88 ARG CA C 88 56.300 58.347 -2.047 1
1 904 . 19 1 1 A 88 88 ARG CB C 88 30.600 31.363 -0.763 1
1 905 . 19 1 1 A 88 88 ARG N N 88 121.200 121.093 0.107 1
1 906 . 19 1 1 A 91 91 PRO HA H 91 4.290 4.421 -0.131 1
1 911 . 19 1 1 A 91 91 PRO CA C 91 63.800 63.998 -0.198 1
1 912 . 19 1 1 A 91 91 PRO CB C 91 32.100 32.022 0.078 1
1 915 . 19 1 1 A 92 92 ASP H H 92 8.280 7.397 0.883 1
1 916 . 19 1 1 A 92 92 ASP HA H 92 4.540 5.042 -0.502 1
1 919 . 19 1 1 A 92 92 ASP CA C 92 54.600 52.691 1.909 1
1 920 . 19 1 1 A 92 92 ASP CB C 92 41.000 44.113 -3.113 1
1 921 . 19 1 1 A 92 92 ASP N N 92 118.700 112.838 5.862 1
1 922 . 19 1 1 A 93 93 ARG H H 93 7.780 8.474 -0.694 1
1 923 . 19 1 1 A 93 93 ARG HA H 93 4.190 4.192 -0.002 1
1 930 . 19 1 1 A 93 93 ARG CA C 93 56.300 56.305 -0.005 1
1 931 . 19 1 1 A 93 93 ARG CB C 93 30.700 30.343 0.357 1
1 934 . 19 1 1 A 93 93 ARG N N 93 120.700 121.656 -0.956 1
1 935 . 19 1 1 A 94 94 GLN H H 94 8.280 8.368 -0.088 1
1 936 . 19 1 1 A 94 94 GLN HA H 94 4.210 4.289 -0.079 1
1 941 . 19 1 1 A 94 94 GLN CA C 94 55.800 56.220 -0.420 1
1 942 . 19 1 1 A 94 94 GLN CB C 94 29.300 29.093 0.207 1
1 944 . 19 1 1 A 94 94 GLN N N 94 121.000 120.857 0.143 1
1 945 . 19 1 1 A 95 95 ASP H H 95 8.270 8.921 -0.651 1
1 946 . 19 1 1 A 95 95 ASP HA H 95 4.450 5.241 -0.791 1
1 949 . 19 1 1 A 95 95 ASP CA C 95 54.300 53.269 1.031 1
1 950 . 19 1 1 A 95 95 ASP CB C 95 41.000 42.034 -1.034 1
1 951 . 19 1 1 A 95 95 ASP N N 95 121.000 124.340 -3.340 1
1 952 . 19 1 1 A 96 96 HIS H H 96 8.090 9.271 -1.181 1
1 953 . 19 1 1 A 96 96 HIS HA H 96 4.470 5.005 -0.535 1
1 956 . 19 1 1 A 96 96 HIS CA C 96 55.900 56.419 -0.519 1
1 957 . 19 1 1 A 96 96 HIS CB C 96 30.500 31.473 -0.973 1
1 958 . 19 1 1 A 96 96 HIS N N 96 119.300 124.395 -5.095 1
1 959 . 19 1 1 A 97 97 HIS H H 97 8.240 7.943 0.297 1
1 960 . 19 1 1 A 97 97 HIS HA H 97 4.470 4.887 -0.417 1
1 963 . 19 1 1 A 97 97 HIS CA C 97 56.200 52.740 3.460 1
1 964 . 19 1 1 A 97 97 HIS CB C 97 30.400 29.378 1.022 1
1 965 . 19 1 1 A 97 97 HIS N N 97 121.300 119.379 1.921 1
1 966 . 19 1 1 A 98 98 PRO HA H 98 4.340 4.412 -0.072 1
1 973 . 19 1 1 A 98 98 PRO CA C 98 63.700 62.832 0.868 1
1 974 . 19 1 1 A 98 98 PRO CB C 98 31.900 33.211 -1.311 1
1 977 . 19 1 1 A 99 99 GLY H H 99 8.660 8.279 0.381 1
1 978 . 19 1 1 A 99 99 GLY HA2 H 99 3.920 4.157 -0.237 1
1 979 . 19 1 1 A 99 99 GLY HA3 H 99 3.920 4.165 -0.245 1
1 980 . 19 1 1 A 99 99 GLY CA C 99 45.200 45.593 -0.393 1
1 981 . 19 1 1 A 99 99 GLY N N 99 110.000 109.139 0.861 1
1 982 . 19 1 1 A 100 100 SER H H 100 8.170 8.777 -0.607 1
1 983 . 19 1 1 A 100 100 SER HA H 100 4.360 4.941 -0.581 1
1 986 . 19 1 1 A 100 100 SER CA C 100 58.500 57.554 0.946 1
1 987 . 19 1 1 A 100 100 SER CB C 100 64.000 65.929 -1.929 1
1 988 . 19 1 1 A 100 100 SER N N 100 115.600 115.668 -0.068 1
1 989 . 19 1 1 A 101 101 GLY H H 101 8.420 8.318 0.102 1
1 990 . 19 1 1 A 101 101 GLY HA2 H 101 3.890 4.349 -0.459 1
1 991 . 19 1 1 A 101 101 GLY HA3 H 101 3.920 4.349 -0.429 1
1 992 . 19 1 1 A 101 101 GLY CA C 101 45.200 45.834 -0.634 1
1 993 . 19 1 1 A 101 101 GLY N N 101 111.000 107.233 3.767 1
1 994 . 19 1 1 A 102 102 ALA H H 102 8.030 8.383 -0.353 1
1 995 . 19 1 1 A 102 102 ALA HA H 102 4.250 4.765 -0.515 1
1 999 . 19 1 1 A 102 102 ALA CA C 102 52.500 51.265 1.235 1
1 1000 . 19 1 1 A 102 102 ALA CB C 102 19.200 22.582 -3.382 1
1 4 . 20 1 1 A 2 2 SER H H 2 8.160 8.231 -0.071 1
1 5 . 20 1 1 A 2 2 SER HA H 2 4.370 4.274 0.096 1
1 9 . 20 1 1 A 2 2 SER CA C 2 58.300 59.111 -0.811 1
1 10 . 20 1 1 A 2 2 SER CB C 2 63.900 61.090 2.810 1
1 11 . 20 1 1 A 2 2 SER N N 2 115.600 113.854 1.746 1
1 12 . 20 1 1 A 3 3 LEU H H 3 8.250 7.676 0.574 1
1 13 . 20 1 1 A 3 3 LEU HA H 3 4.280 4.419 -0.139 1
1 17 . 20 1 1 A 3 3 LEU CA C 3 55.200 54.728 0.472 1
1 18 . 20 1 1 A 3 3 LEU CB C 3 42.100 43.012 -0.912 1
1 19 . 20 1 1 A 3 3 LEU N N 3 124.100 122.131 1.969 1
1 20 . 20 1 1 A 4 4 VAL H H 4 7.950 8.550 -0.600 1
1 21 . 20 1 1 A 4 4 VAL HA H 4 4.680 4.919 -0.239 1
1 26 . 20 1 1 A 4 4 VAL CA C 4 59.800 58.297 1.503 1
1 27 . 20 1 1 A 4 4 VAL CB C 4 32.500 34.219 -1.719 1
1 28 . 20 1 1 A 4 4 VAL N N 4 122.600 121.650 0.950 1
1 29 . 20 1 1 A 5 5 PRO CA C 5 63.100 62.662 0.438 1
1 30 . 20 1 1 A 5 5 PRO CB C 5 32.000 31.649 0.351 1
1 32 . 20 1 1 A 6 6 ARG H H 6 8.360 8.772 -0.412 1
1 33 . 20 1 1 A 6 6 ARG HA H 6 4.250 4.724 -0.474 1
1 36 . 20 1 1 A 6 6 ARG CA C 6 56.000 55.618 0.382 1
1 37 . 20 1 1 A 6 6 ARG CB C 6 30.900 32.804 -1.904 1
1 38 . 20 1 1 A 6 6 ARG N N 6 121.800 123.843 -2.043 1
1 39 . 20 1 1 A 7 7 GLY H H 7 8.460 8.385 0.075 1
1 40 . 20 1 1 A 7 7 GLY HA2 H 7 3.940 4.244 -0.304 1
1 41 . 20 1 1 A 7 7 GLY HA3 H 7 3.760 4.248 -0.488 1
1 42 . 20 1 1 A 7 7 GLY CA C 7 45.000 45.541 -0.541 1
1 43 . 20 1 1 A 7 7 GLY N N 7 110.700 112.986 -2.286 1
1 44 . 20 1 1 A 8 8 SER H H 8 7.990 8.667 -0.677 1
1 45 . 20 1 1 A 8 8 SER HA H 8 4.450 4.527 -0.077 1
1 48 . 20 1 1 A 8 8 SER CA C 8 58.900 60.247 -1.347 1
1 49 . 20 1 1 A 8 8 SER CB C 8 64.200 63.957 0.243 1
1 50 . 20 1 1 A 8 8 SER N N 8 115.500 114.036 1.464 1
1 51 . 20 1 1 A 9 9 MET H H 9 9.040 7.844 1.196 1
1 52 . 20 1 1 A 9 9 MET HA H 9 4.610 5.026 -0.416 1
1 60 . 20 1 1 A 9 9 MET CA C 9 54.400 53.711 0.689 1
1 61 . 20 1 1 A 9 9 MET CB C 9 35.400 33.604 1.796 1
1 64 . 20 1 1 A 9 9 MET N N 9 120.500 118.711 1.789 1
1 65 . 20 1 1 A 10 10 GLN H H 10 8.270 8.928 -0.658 1
1 66 . 20 1 1 A 10 10 GLN HA H 10 5.270 5.239 0.031 1
1 71 . 20 1 1 A 10 10 GLN CA C 10 54.200 54.465 -0.265 1
1 72 . 20 1 1 A 10 10 GLN CB C 10 30.500 32.344 -1.844 1
1 74 . 20 1 1 A 10 10 GLN N N 10 121.000 122.359 -1.359 1
1 75 . 20 1 1 A 11 11 ILE H H 11 8.270 8.727 -0.457 1
1 76 . 20 1 1 A 11 11 ILE HA H 11 4.100 4.794 -0.694 1
1 86 . 20 1 1 A 11 11 ILE CA C 11 59.400 59.120 0.280 1
1 87 . 20 1 1 A 11 11 ILE CB C 11 41.800 40.870 0.930 1
1 91 . 20 1 1 A 11 11 ILE N N 11 114.600 121.554 -6.954 1
1 92 . 20 1 1 A 12 12 PHE H H 12 8.520 8.759 -0.239 1
1 93 . 20 1 1 A 12 12 PHE HA H 12 5.540 5.365 0.175 1
1 96 . 20 1 1 A 12 12 PHE CA C 12 55.000 56.820 -1.820 1
1 97 . 20 1 1 A 12 12 PHE CB C 12 41.200 40.972 0.228 1
1 98 . 20 1 1 A 12 12 PHE N N 12 118.600 123.656 -5.056 1
1 99 . 20 1 1 A 13 13 VAL H H 13 9.230 9.216 0.014 1
1 100 . 20 1 1 A 13 13 VAL HA H 13 4.740 4.910 -0.170 1
1 108 . 20 1 1 A 13 13 VAL CA C 13 60.300 60.561 -0.261 1
1 109 . 20 1 1 A 13 13 VAL CB C 13 34.100 35.682 -1.582 1
1 112 . 20 1 1 A 13 13 VAL N N 13 121.400 123.174 -1.774 1
1 113 . 20 1 1 A 14 14 LYS H H 14 8.910 8.798 0.112 1
1 114 . 20 1 1 A 14 14 LYS HA H 14 5.190 4.786 0.404 1
1 122 . 20 1 1 A 14 14 LYS CA C 14 54.600 54.864 -0.264 1
1 123 . 20 1 1 A 14 14 LYS CB C 14 34.300 34.459 -0.159 1
1 126 . 20 1 1 A 14 14 LYS N N 14 128.000 126.734 1.266 1
1 127 . 20 1 1 A 15 15 THR H H 15 8.650 8.923 -0.273 1
1 128 . 20 1 1 A 15 15 THR HA H 15 4.870 4.594 0.276 1
1 133 . 20 1 1 A 15 15 THR CA C 15 60.300 60.889 -0.589 1
1 134 . 20 1 1 A 15 15 THR CB C 15 70.600 71.160 -0.560 1
1 136 . 20 1 1 A 15 15 THR N N 15 115.300 117.850 -2.550 1
1 137 . 20 1 1 A 16 16 LEU H H 16 9.070 8.860 0.210 1
1 138 . 20 1 1 A 16 16 LEU HA H 16 4.210 4.019 0.191 1
1 148 . 20 1 1 A 16 16 LEU CA C 16 57.400 57.781 -0.381 1
1 149 . 20 1 1 A 16 16 LEU CB C 16 41.800 41.416 0.384 1
1 153 . 20 1 1 A 16 16 LEU N N 16 121.400 122.454 -1.054 1
1 154 . 20 1 1 A 17 17 THR H H 17 7.560 7.812 -0.252 1
1 155 . 20 1 1 A 17 17 THR HA H 17 4.330 4.294 0.036 1
1 160 . 20 1 1 A 17 17 THR CA C 17 61.400 63.756 -2.356 1
1 161 . 20 1 1 A 17 17 THR CB C 17 68.900 69.525 -0.625 1
1 163 . 20 1 1 A 17 17 THR N N 17 105.900 112.239 -6.339 1
1 164 . 20 1 1 A 18 18 GLY H H 18 7.750 7.741 0.009 1
1 165 . 20 1 1 A 18 18 GLY HA2 H 18 4.250 4.026 0.224 1
1 166 . 20 1 1 A 18 18 GLY HA3 H 18 3.520 4.043 -0.523 1
1 167 . 20 1 1 A 18 18 GLY CA C 18 45.300 45.100 0.200 1
1 168 . 20 1 1 A 18 18 GLY N N 18 109.300 109.304 -0.004 1
1 169 . 20 1 1 A 19 19 LYS H H 19 7.210 7.669 -0.459 1
1 170 . 20 1 1 A 19 19 LYS HA H 19 4.260 4.318 -0.058 1
1 175 . 20 1 1 A 19 19 LYS CA C 19 56.300 56.840 -0.540 1
1 176 . 20 1 1 A 19 19 LYS CB C 19 33.200 33.963 -0.763 1
1 179 . 20 1 1 A 19 19 LYS N N 19 122.000 120.541 1.459 1
1 180 . 20 1 1 A 20 20 THR H H 20 8.570 8.822 -0.252 1
1 181 . 20 1 1 A 20 20 THR HA H 20 4.950 5.670 -0.720 1
1 186 . 20 1 1 A 20 20 THR CA C 20 62.200 60.339 1.861 1
1 187 . 20 1 1 A 20 20 THR CB C 20 69.700 71.122 -1.422 1
1 189 . 20 1 1 A 20 20 THR N N 20 120.700 112.882 7.818 1
1 190 . 20 1 1 A 21 21 ILE H H 21 9.510 9.103 0.407 1
1 191 . 20 1 1 A 21 21 ILE HA H 21 4.390 4.880 -0.490 1
1 201 . 20 1 1 A 21 21 ILE CA C 21 60.000 59.273 0.727 1
1 202 . 20 1 1 A 21 21 ILE CB C 21 40.700 41.211 -0.511 1
1 206 . 20 1 1 A 21 21 ILE N N 21 128.200 122.800 5.400 1
1 207 . 20 1 1 A 22 22 THR H H 22 8.700 8.717 -0.017 1
1 208 . 20 1 1 A 22 22 THR HA H 22 4.860 4.492 0.368 1
1 213 . 20 1 1 A 22 22 THR CA C 22 62.100 62.596 -0.496 1
1 214 . 20 1 1 A 22 22 THR CB C 22 69.500 68.910 0.590 1
1 216 . 20 1 1 A 22 22 THR N N 22 122.300 122.271 0.029 1
1 217 . 20 1 1 A 23 23 LEU H H 23 8.720 8.940 -0.220 1
1 218 . 20 1 1 A 23 23 LEU HA H 23 4.690 5.037 -0.347 1
1 228 . 20 1 1 A 23 23 LEU CA C 23 52.700 53.545 -0.845 1
1 229 . 20 1 1 A 23 23 LEU CB C 23 46.600 45.159 1.441 1
1 233 . 20 1 1 A 23 23 LEU N N 23 125.400 127.838 -2.438 1
1 234 . 20 1 1 A 24 24 GLU H H 24 8.080 8.536 -0.456 1
1 235 . 20 1 1 A 24 24 GLU HA H 24 4.800 4.935 -0.135 1
1 238 . 20 1 1 A 24 24 GLU CA C 24 55.400 55.643 -0.243 1
1 239 . 20 1 1 A 24 24 GLU CB C 24 30.100 31.104 -1.004 1
1 241 . 20 1 1 A 24 24 GLU N N 24 121.800 119.526 2.274 1
1 242 . 20 1 1 A 25 25 VAL H H 25 8.800 8.880 -0.080 1
1 243 . 20 1 1 A 25 25 VAL HA H 25 4.640 4.966 -0.326 1
1 251 . 20 1 1 A 25 25 VAL CA C 25 58.600 59.671 -1.071 1
1 252 . 20 1 1 A 25 25 VAL CB C 25 36.300 36.218 0.082 1
1 255 . 20 1 1 A 25 25 VAL N N 25 116.700 117.727 -1.027 1
1 256 . 20 1 1 A 26 26 GLU H H 26 8.500 8.469 0.031 1
1 257 . 20 1 1 A 26 26 GLU HA H 26 4.900 4.599 0.301 1
1 260 . 20 1 1 A 26 26 GLU CA C 26 53.000 53.496 -0.496 1
1 261 . 20 1 1 A 26 26 GLU CB C 26 31.200 33.809 -2.609 1
1 262 . 20 1 1 A 26 26 GLU N N 26 117.900 121.548 -3.648 1
1 263 . 20 1 1 A 27 27 PRO HA H 27 4.040 4.388 -0.348 1
1 270 . 20 1 1 A 27 27 PRO CA C 27 65.400 64.452 0.948 1
1 271 . 20 1 1 A 27 27 PRO CB C 27 31.700 31.892 -0.192 1
1 274 . 20 1 1 A 28 28 SER H H 28 7.010 8.144 -1.134 1
1 275 . 20 1 1 A 28 28 SER HA H 28 4.280 4.524 -0.244 1
1 278 . 20 1 1 A 28 28 SER CA C 28 57.400 58.231 -0.831 1
1 279 . 20 1 1 A 28 28 SER CB C 28 63.400 64.118 -0.718 1
1 280 . 20 1 1 A 28 28 SER N N 28 103.800 111.020 -7.220 1
1 281 . 20 1 1 A 29 29 ASP H H 29 7.960 7.797 0.163 1
1 282 . 20 1 1 A 29 29 ASP HA H 29 4.600 4.962 -0.362 1
1 285 . 20 1 1 A 29 29 ASP CA C 29 55.900 53.290 2.610 1
1 286 . 20 1 1 A 29 29 ASP CB C 29 41.000 42.575 -1.575 1
1 287 . 20 1 1 A 29 29 ASP N N 29 123.700 121.317 2.383 1
1 288 . 20 1 1 A 30 30 THR H H 30 7.780 8.505 -0.725 1
1 289 . 20 1 1 A 30 30 THR HA H 30 4.850 4.779 0.071 1
1 294 . 20 1 1 A 30 30 THR CA C 30 59.400 59.818 -0.418 1
1 295 . 20 1 1 A 30 30 THR CB C 30 71.100 71.483 -0.383 1
1 297 . 20 1 1 A 30 30 THR N N 30 108.800 116.379 -7.579 1
1 298 . 20 1 1 A 31 31 ILE H H 31 8.320 9.065 -0.745 1
1 299 . 20 1 1 A 31 31 ILE HA H 31 3.580 3.776 -0.196 1
1 309 . 20 1 1 A 31 31 ILE CA C 31 62.200 64.742 -2.542 1
1 310 . 20 1 1 A 31 31 ILE CB C 31 34.300 37.583 -3.283 1
1 314 . 20 1 1 A 31 31 ILE N N 31 121.300 126.842 -5.542 1
1 315 . 20 1 1 A 32 32 GLU H H 32 9.850 8.399 1.451 1
1 316 . 20 1 1 A 32 32 GLU HA H 32 3.780 3.932 -0.152 1
1 321 . 20 1 1 A 32 32 GLU CA C 32 60.500 59.969 0.531 1
1 322 . 20 1 1 A 32 32 GLU CB C 32 28.800 29.336 -0.536 1
1 324 . 20 1 1 A 32 32 GLU N N 32 121.600 122.018 -0.418 1
1 325 . 20 1 1 A 33 33 ASN H H 33 7.810 7.719 0.091 1
1 326 . 20 1 1 A 33 33 ASN HA H 33 4.440 4.483 -0.043 1
1 329 . 20 1 1 A 33 33 ASN CA C 33 55.800 55.759 0.041 1
1 330 . 20 1 1 A 33 33 ASN CB C 33 38.100 38.276 -0.176 1
1 331 . 20 1 1 A 33 33 ASN N N 33 121.000 118.873 2.127 1
1 332 . 20 1 1 A 34 34 VAL H H 34 8.000 7.953 0.047 1
1 333 . 20 1 1 A 34 34 VAL HA H 34 3.300 3.804 -0.504 1
1 341 . 20 1 1 A 34 34 VAL CA C 34 67.600 67.125 0.475 1
1 342 . 20 1 1 A 34 34 VAL CB C 34 30.700 31.286 -0.586 1
1 345 . 20 1 1 A 34 34 VAL N N 34 122.200 119.854 2.346 1
1 346 . 20 1 1 A 35 35 LYS H H 35 8.490 8.597 -0.107 1
1 347 . 20 1 1 A 35 35 LYS HA H 35 4.500 4.069 0.431 1
1 352 . 20 1 1 A 35 35 LYS CA C 35 59.300 58.723 0.577 1
1 353 . 20 1 1 A 35 35 LYS CB C 35 33.500 32.051 1.449 1
1 354 . 20 1 1 A 35 35 LYS N N 35 119.200 120.596 -1.396 1
1 355 . 20 1 1 A 36 36 ALA H H 36 7.880 7.808 0.072 1
1 356 . 20 1 1 A 36 36 ALA HA H 36 4.060 3.984 0.076 1
1 360 . 20 1 1 A 36 36 ALA CA C 36 55.300 55.525 -0.225 1
1 361 . 20 1 1 A 36 36 ALA CB C 36 17.600 18.361 -0.761 1
1 362 . 20 1 1 A 36 36 ALA N N 36 123.300 122.419 0.881 1
1 363 . 20 1 1 A 37 37 LYS H H 37 7.790 7.792 -0.002 1
1 364 . 20 1 1 A 37 37 LYS HA H 37 4.110 3.950 0.160 1
1 373 . 20 1 1 A 37 37 LYS CA C 37 59.700 59.545 0.155 1
1 374 . 20 1 1 A 37 37 LYS CB C 37 33.100 32.439 0.661 1
1 378 . 20 1 1 A 37 37 LYS N N 37 120.400 116.964 3.436 1
1 379 . 20 1 1 A 38 38 ILE H H 38 8.240 7.673 0.567 1
1 380 . 20 1 1 A 38 38 ILE HA H 38 3.410 4.024 -0.614 1
1 390 . 20 1 1 A 38 38 ILE CA C 38 66.200 61.830 4.370 1
1 391 . 20 1 1 A 38 38 ILE CB C 38 36.800 37.865 -1.065 1
1 395 . 20 1 1 A 38 38 ILE N N 38 121.400 119.968 1.432 1
1 396 . 20 1 1 A 39 39 GLN H H 39 8.460 8.582 -0.122 1
1 397 . 20 1 1 A 39 39 GLN HA H 39 3.730 3.903 -0.173 1
1 402 . 20 1 1 A 39 39 GLN CA C 39 60.000 59.064 0.936 1
1 403 . 20 1 1 A 39 39 GLN CB C 39 27.600 28.266 -0.666 1
1 405 . 20 1 1 A 39 39 GLN N N 39 123.500 121.180 2.320 1
1 406 . 20 1 1 A 40 40 ASP H H 40 7.970 7.803 0.167 1
1 407 . 20 1 1 A 40 40 ASP HA H 40 4.240 4.350 -0.110 1
1 410 . 20 1 1 A 40 40 ASP CA C 40 57.400 56.723 0.677 1
1 411 . 20 1 1 A 40 40 ASP CB C 40 41.000 40.664 0.336 1
1 412 . 20 1 1 A 40 40 ASP N N 40 119.900 119.548 0.352 1
1 413 . 20 1 1 A 41 41 LYS H H 41 7.420 7.949 -0.529 1
1 414 . 20 1 1 A 41 41 LYS HA H 41 4.200 4.034 0.166 1
1 423 . 20 1 1 A 41 41 LYS CA C 41 58.200 59.456 -1.256 1
1 424 . 20 1 1 A 41 41 LYS CB C 41 33.900 32.490 1.410 1
1 427 . 20 1 1 A 41 41 LYS N N 41 115.700 119.174 -3.474 1
1 428 . 20 1 1 A 42 42 GLU H H 42 8.650 7.771 0.879 1
1 429 . 20 1 1 A 42 42 GLU HA H 42 4.470 4.514 -0.044 1
1 434 . 20 1 1 A 42 42 GLU CA C 42 55.300 55.726 -0.426 1
1 435 . 20 1 1 A 42 42 GLU CB C 42 33.200 32.081 1.119 1
1 437 . 20 1 1 A 42 42 GLU N N 42 114.200 113.463 0.737 1
1 438 . 20 1 1 A 43 43 GLY H H 43 8.400 7.881 0.519 1
1 439 . 20 1 1 A 43 43 GLY HA2 H 43 4.040 3.953 0.087 1
1 440 . 20 1 1 A 43 43 GLY HA3 H 43 3.820 3.955 -0.135 1
1 441 . 20 1 1 A 43 43 GLY CA C 43 45.900 45.255 0.645 1
1 442 . 20 1 1 A 43 43 GLY N N 43 109.000 109.628 -0.628 1
1 443 . 20 1 1 A 44 44 ILE H H 44 6.080 7.482 -1.402 1
1 444 . 20 1 1 A 44 44 ILE HA H 44 4.290 4.261 0.029 1
1 446 . 20 1 1 A 44 44 ILE CA C 44 57.700 58.691 -0.991 1
1 447 . 20 1 1 A 44 44 ILE CB C 44 40.400 39.053 1.347 1
1 448 . 20 1 1 A 44 44 ILE N N 44 120.500 122.285 -1.785 1
1 449 . 20 1 1 A 46 46 PRO HA H 46 4.030 4.206 -0.176 1
1 454 . 20 1 1 A 46 46 PRO CA C 46 66.100 65.288 0.812 1
1 455 . 20 1 1 A 46 46 PRO CB C 46 32.600 32.084 0.516 1
1 458 . 20 1 1 A 47 47 ASP H H 47 8.470 8.559 -0.089 1
1 459 . 20 1 1 A 47 47 ASP HA H 47 4.310 4.405 -0.095 1
1 462 . 20 1 1 A 47 47 ASP CA C 47 55.700 56.207 -0.507 1
1 463 . 20 1 1 A 47 47 ASP CB C 47 39.700 40.048 -0.348 1
1 464 . 20 1 1 A 47 47 ASP N N 47 113.700 117.151 -3.451 1
1 465 . 20 1 1 A 48 48 GLN H H 48 7.720 7.569 0.151 1
1 466 . 20 1 1 A 48 48 GLN HA H 48 4.340 4.392 -0.052 1
1 471 . 20 1 1 A 48 48 GLN CA C 48 55.500 55.832 -0.332 1
1 472 . 20 1 1 A 48 48 GLN CB C 48 29.900 30.677 -0.777 1
1 474 . 20 1 1 A 48 48 GLN N N 48 116.900 117.160 -0.260 1
1 475 . 20 1 1 A 49 49 GLN H H 49 7.410 7.472 -0.062 1
1 476 . 20 1 1 A 49 49 GLN HA H 49 4.110 4.418 -0.308 1
1 481 . 20 1 1 A 49 49 GLN CA C 49 56.600 55.840 0.760 1
1 482 . 20 1 1 A 49 49 GLN CB C 49 31.300 29.263 2.037 1
1 484 . 20 1 1 A 49 49 GLN N N 49 118.000 118.182 -0.182 1
1 485 . 20 1 1 A 50 50 ARG H H 50 8.400 8.505 -0.105 1
1 486 . 20 1 1 A 50 50 ARG HA H 50 4.380 4.635 -0.255 1
1 491 . 20 1 1 A 50 50 ARG CA C 50 55.100 55.493 -0.393 1
1 492 . 20 1 1 A 50 50 ARG CB C 50 31.600 31.827 -0.227 1
1 494 . 20 1 1 A 50 50 ARG N N 50 123.100 123.866 -0.766 1
1 495 . 20 1 1 A 51 51 LEU H H 51 8.710 8.618 0.092 1
1 496 . 20 1 1 A 51 51 LEU HA H 51 5.300 4.903 0.397 1
1 506 . 20 1 1 A 51 51 LEU CA C 51 52.900 53.866 -0.966 1
1 507 . 20 1 1 A 51 51 LEU CB C 51 45.700 44.270 1.430 1
1 511 . 20 1 1 A 51 51 LEU N N 51 124.400 124.311 0.089 1
1 512 . 20 1 1 A 52 52 ILE H H 52 9.060 8.767 0.293 1
1 513 . 20 1 1 A 52 52 ILE HA H 52 4.840 5.001 -0.161 1
1 523 . 20 1 1 A 52 52 ILE CA C 52 58.900 59.930 -1.030 1
1 524 . 20 1 1 A 52 52 ILE CB C 52 41.200 40.898 0.302 1
1 528 . 20 1 1 A 52 52 ILE N N 52 122.500 127.548 -5.048 1
1 529 . 20 1 1 A 53 53 PHE H H 53 8.730 9.551 -0.821 1
1 530 . 20 1 1 A 53 53 PHE HA H 53 5.100 4.874 0.226 1
1 535 . 20 1 1 A 53 53 PHE CA C 53 56.300 57.521 -1.221 1
1 536 . 20 1 1 A 53 53 PHE CB C 53 43.500 41.951 1.549 1
1 537 . 20 1 1 A 53 53 PHE N N 53 124.800 127.958 -3.158 1
1 538 . 20 1 1 A 54 54 ALA H H 54 8.940 9.151 -0.211 1
1 539 . 20 1 1 A 54 54 ALA HA H 54 3.610 3.880 -0.270 1
1 543 . 20 1 1 A 54 54 ALA CA C 54 52.500 52.991 -0.491 1
1 544 . 20 1 1 A 54 54 ALA CB C 54 16.300 17.293 -0.993 1
1 545 . 20 1 1 A 54 54 ALA N N 54 133.100 130.398 2.702 1
1 546 . 20 1 1 A 55 55 GLY H H 55 8.070 8.448 -0.378 1
1 547 . 20 1 1 A 55 55 GLY HA2 H 55 4.000 3.800 0.200 1
1 548 . 20 1 1 A 55 55 GLY HA3 H 55 3.340 3.837 -0.497 1
1 549 . 20 1 1 A 55 55 GLY CA C 55 45.200 45.237 -0.037 1
1 550 . 20 1 1 A 55 55 GLY N N 55 102.500 102.781 -0.281 1
1 551 . 20 1 1 A 56 56 LYS H H 56 7.860 7.913 -0.053 1
1 552 . 20 1 1 A 56 56 LYS HA H 56 4.510 4.555 -0.045 1
1 558 . 20 1 1 A 56 56 LYS CA C 56 54.500 54.677 -0.177 1
1 559 . 20 1 1 A 56 56 LYS CB C 56 34.400 33.765 0.635 1
1 561 . 20 1 1 A 56 56 LYS N N 56 121.800 121.950 -0.150 1
1 562 . 20 1 1 A 57 57 GLN H H 57 8.600 8.466 0.134 1
1 563 . 20 1 1 A 57 57 GLN HA H 57 4.410 4.857 -0.447 1
1 568 . 20 1 1 A 57 57 GLN CA C 57 55.900 55.704 0.196 1
1 569 . 20 1 1 A 57 57 GLN CB C 57 28.800 29.384 -0.584 1
1 571 . 20 1 1 A 57 57 GLN N N 57 123.200 123.877 -0.677 1
1 572 . 20 1 1 A 58 58 LEU H H 58 8.480 8.537 -0.057 1
1 573 . 20 1 1 A 58 58 LEU HA H 58 4.060 5.013 -0.953 1
1 583 . 20 1 1 A 58 58 LEU CA C 58 54.100 53.076 1.024 1
1 584 . 20 1 1 A 58 58 LEU CB C 58 41.500 45.687 -4.187 1
1 588 . 20 1 1 A 58 58 LEU N N 58 125.900 122.184 3.716 1
1 589 . 20 1 1 A 59 59 GLU H H 59 8.400 8.532 -0.132 1
1 590 . 20 1 1 A 59 59 GLU HA H 59 4.400 4.927 -0.527 1
1 595 . 20 1 1 A 59 59 GLU CA C 59 55.900 54.031 1.869 1
1 596 . 20 1 1 A 59 59 GLU CB C 59 31.900 31.655 0.245 1
1 598 . 20 1 1 A 59 59 GLU N N 59 123.100 117.993 5.107 1
1 599 . 20 1 1 A 60 60 ASP H H 60 8.110 8.600 -0.490 1
1 600 . 20 1 1 A 60 60 ASP HA H 60 4.270 5.516 -1.246 1
1 603 . 20 1 1 A 60 60 ASP CA C 60 57.100 52.767 4.333 1
1 604 . 20 1 1 A 60 60 ASP CB C 60 40.800 45.270 -4.470 1
1 605 . 20 1 1 A 60 60 ASP N N 60 120.300 120.259 0.041 1
1 606 . 20 1 1 A 61 61 GLY HA2 H 61 4.000 4.014 -0.014 1
1 607 . 20 1 1 A 61 61 GLY HA3 H 61 3.830 4.030 -0.200 1
1 608 . 20 1 1 A 61 61 GLY CA C 61 45.000 45.447 -0.447 1
1 609 . 20 1 1 A 62 62 ARG H H 62 7.350 7.948 -0.598 1
1 610 . 20 1 1 A 62 62 ARG HA H 62 4.640 4.895 -0.255 1
1 615 . 20 1 1 A 62 62 ARG CA C 62 54.400 53.913 0.487 1
1 616 . 20 1 1 A 62 62 ARG CB C 62 32.600 34.084 -1.484 1
1 618 . 20 1 1 A 62 62 ARG N N 62 119.300 119.908 -0.608 1
1 619 . 20 1 1 A 63 63 THR H H 63 8.460 8.738 -0.278 1
1 620 . 20 1 1 A 63 63 THR HA H 63 5.060 4.685 0.375 1
1 625 . 20 1 1 A 63 63 THR CA C 63 59.700 60.648 -0.948 1
1 626 . 20 1 1 A 63 63 THR CB C 63 72.000 71.274 0.726 1
1 628 . 20 1 1 A 63 63 THR N N 63 109.100 112.558 -3.458 1
1 629 . 20 1 1 A 64 64 LEU H H 64 8.190 8.764 -0.574 1
1 630 . 20 1 1 A 64 64 LEU HA H 64 3.920 3.974 -0.054 1
1 640 . 20 1 1 A 64 64 LEU CA C 64 58.400 57.921 0.479 1
1 641 . 20 1 1 A 64 64 LEU CB C 64 40.200 41.350 -1.150 1
1 645 . 20 1 1 A 64 64 LEU N N 64 118.100 122.825 -4.725 1
1 646 . 20 1 1 A 65 65 SER H H 65 8.370 7.874 0.496 1
1 647 . 20 1 1 A 65 65 SER HA H 65 4.150 4.153 -0.003 1
1 650 . 20 1 1 A 65 65 SER CA C 65 60.900 60.508 0.392 1
1 651 . 20 1 1 A 65 65 SER CB C 65 62.500 63.304 -0.804 1
1 652 . 20 1 1 A 65 65 SER N N 65 112.200 114.238 -2.038 1
1 653 . 20 1 1 A 66 66 GLU H H 66 7.780 8.194 -0.414 1
1 654 . 20 1 1 A 66 66 GLU HA H 66 3.890 4.101 -0.211 1
1 659 . 20 1 1 A 66 66 GLU CA C 66 59.200 58.729 0.471 1
1 660 . 20 1 1 A 66 66 GLU CB C 66 29.400 29.025 0.375 1
1 662 . 20 1 1 A 66 66 GLU N N 66 123.600 122.095 1.505 1
1 663 . 20 1 1 A 67 67 TYR H H 67 7.290 7.657 -0.367 1
1 664 . 20 1 1 A 67 67 TYR HA H 67 4.590 4.585 0.005 1
1 669 . 20 1 1 A 67 67 TYR CA C 67 58.400 57.648 0.752 1
1 670 . 20 1 1 A 67 67 TYR CB C 67 39.800 39.216 0.584 1
1 671 . 20 1 1 A 67 67 TYR N N 67 116.400 116.957 -0.557 1
1 672 . 20 1 1 A 68 68 ASN H H 68 8.040 7.858 0.182 1
1 673 . 20 1 1 A 68 68 ASN HA H 68 4.240 4.248 -0.008 1
1 676 . 20 1 1 A 68 68 ASN CA C 68 54.100 54.461 -0.361 1
1 677 . 20 1 1 A 68 68 ASN CB C 68 37.200 36.722 0.478 1
1 678 . 20 1 1 A 68 68 ASN N N 68 115.600 115.154 0.446 1
1 679 . 20 1 1 A 69 69 ILE H H 69 7.200 7.781 -0.581 1
1 680 . 20 1 1 A 69 69 ILE HA H 69 3.280 4.837 -1.557 1
1 690 . 20 1 1 A 69 69 ILE CA C 69 59.800 58.705 1.095 1
1 691 . 20 1 1 A 69 69 ILE CB C 69 36.600 40.717 -4.117 1
1 695 . 20 1 1 A 69 69 ILE N N 69 119.100 113.657 5.443 1
1 696 . 20 1 1 A 70 70 GLN H H 70 7.570 8.388 -0.818 1
1 697 . 20 1 1 A 70 70 GLN HA H 70 4.410 4.475 -0.065 1
1 702 . 20 1 1 A 70 70 GLN CA C 70 53.500 55.260 -1.760 1
1 703 . 20 1 1 A 70 70 GLN CB C 70 31.500 27.896 3.604 1
1 705 . 20 1 1 A 70 70 GLN N N 70 124.800 120.863 3.937 1
1 706 . 20 1 1 A 71 71 LYS H H 71 8.370 7.810 0.560 1
1 707 . 20 1 1 A 71 71 LYS HA H 71 3.870 3.710 0.160 1
1 716 . 20 1 1 A 71 71 LYS CA C 71 58.000 57.591 0.409 1
1 717 . 20 1 1 A 71 71 LYS CB C 71 32.500 31.902 0.598 1
1 720 . 20 1 1 A 71 71 LYS N N 71 120.200 122.431 -2.231 1
1 721 . 20 1 1 A 72 72 GLU H H 72 9.230 7.970 1.260 1
1 722 . 20 1 1 A 72 72 GLU HA H 72 3.240 4.473 -1.233 1
1 727 . 20 1 1 A 72 72 GLU CA C 72 58.300 55.319 2.981 1
1 728 . 20 1 1 A 72 72 GLU CB C 72 26.000 30.172 -4.172 1
1 730 . 20 1 1 A 72 72 GLU N N 72 115.100 119.774 -4.674 1
1 731 . 20 1 1 A 73 73 SER H H 73 7.690 8.064 -0.374 1
1 732 . 20 1 1 A 73 73 SER HA H 73 4.520 4.708 -0.188 1
1 735 . 20 1 1 A 73 73 SER CA C 73 61.100 59.714 1.386 1
1 736 . 20 1 1 A 73 73 SER CB C 73 64.800 64.955 -0.155 1
1 737 . 20 1 1 A 73 73 SER N N 73 115.300 116.782 -1.482 1
1 738 . 20 1 1 A 74 74 THR H H 74 8.620 7.812 0.808 1
1 739 . 20 1 1 A 74 74 THR HA H 74 5.200 5.136 0.064 1
1 744 . 20 1 1 A 74 74 THR CA C 74 62.400 61.866 0.534 1
1 745 . 20 1 1 A 74 74 THR CB C 74 70.200 70.775 -0.575 1
1 747 . 20 1 1 A 74 74 THR N N 74 117.500 111.205 6.295 1
1 748 . 20 1 1 A 75 75 LEU H H 75 9.350 9.209 0.141 1
1 749 . 20 1 1 A 75 75 LEU HA H 75 4.990 5.172 -0.182 1
1 759 . 20 1 1 A 75 75 LEU CA C 75 53.800 53.811 -0.011 1
1 760 . 20 1 1 A 75 75 LEU CB C 75 44.400 46.199 -1.799 1
1 764 . 20 1 1 A 75 75 LEU N N 75 128.000 126.247 1.753 1
1 765 . 20 1 1 A 76 76 HIS H H 76 9.140 8.836 0.304 1
1 766 . 20 1 1 A 76 76 HIS HA H 76 5.040 5.256 -0.216 1
1 769 . 20 1 1 A 76 76 HIS CA C 76 56.200 54.423 1.777 1
1 770 . 20 1 1 A 76 76 HIS CB C 76 32.500 32.848 -0.348 1
1 771 . 20 1 1 A 76 76 HIS N N 76 119.600 123.400 -3.800 1
1 772 . 20 1 1 A 77 77 LEU H H 77 8.240 8.969 -0.729 1
1 773 . 20 1 1 A 77 77 LEU HA H 77 5.080 5.284 -0.204 1
1 783 . 20 1 1 A 77 77 LEU CA C 77 53.600 53.643 -0.043 1
1 784 . 20 1 1 A 77 77 LEU CB C 77 44.100 43.335 0.765 1
1 788 . 20 1 1 A 77 77 LEU N N 77 123.800 123.949 -0.149 1
1 789 . 20 1 1 A 78 78 VAL H H 78 9.110 8.731 0.379 1
1 790 . 20 1 1 A 78 78 VAL HA H 78 4.260 4.676 -0.416 1
1 798 . 20 1 1 A 78 78 VAL CA C 78 60.400 60.897 -0.497 1
1 799 . 20 1 1 A 78 78 VAL CB C 78 34.700 36.048 -1.348 1
1 802 . 20 1 1 A 78 78 VAL N N 78 127.100 123.953 3.147 1
1 803 . 20 1 1 A 79 79 LEU H H 79 8.050 8.938 -0.888 1
1 804 . 20 1 1 A 79 79 LEU HA H 79 4.950 4.897 0.053 1
1 813 . 20 1 1 A 79 79 LEU CA C 79 53.800 53.194 0.606 1
1 814 . 20 1 1 A 79 79 LEU CB C 79 42.700 44.343 -1.643 1
1 818 . 20 1 1 A 79 79 LEU N N 79 123.400 128.651 -5.251 1
1 819 . 20 1 1 A 80 80 ARG H H 80 8.540 9.102 -0.562 1
1 820 . 20 1 1 A 80 80 ARG HA H 80 4.170 3.960 0.210 1
1 827 . 20 1 1 A 80 80 ARG CA C 80 55.800 56.968 -1.168 1
1 828 . 20 1 1 A 80 80 ARG CB C 80 31.100 28.804 2.296 1
1 830 . 20 1 1 A 80 80 ARG N N 80 123.500 126.414 -2.914 1
1 831 . 20 1 1 A 81 81 LEU H H 81 8.250 7.815 0.435 1
1 832 . 20 1 1 A 81 81 LEU HA H 81 4.270 4.364 -0.094 1
1 842 . 20 1 1 A 81 81 LEU CA C 81 55.000 54.802 0.198 1
1 843 . 20 1 1 A 81 81 LEU CB C 81 42.200 43.156 -0.956 1
1 847 . 20 1 1 A 81 81 LEU N N 81 124.100 118.614 5.486 1
1 848 . 20 1 1 A 82 82 ARG H H 82 8.310 8.615 -0.305 1
1 849 . 20 1 1 A 82 82 ARG HA H 82 4.200 4.915 -0.715 1
1 852 . 20 1 1 A 82 82 ARG CA C 82 56.300 55.715 0.585 1
1 853 . 20 1 1 A 82 82 ARG CB C 82 30.700 33.267 -2.567 1
1 855 . 20 1 1 A 82 82 ARG N N 82 121.500 120.158 1.342 1
1 856 . 20 1 1 A 83 83 GLY H H 83 8.410 8.454 -0.044 1
1 857 . 20 1 1 A 83 83 GLY HA2 H 83 3.750 4.100 -0.350 1
1 858 . 20 1 1 A 83 83 GLY HA3 H 83 3.754 4.238 -0.484 1
1 859 . 20 1 1 A 83 83 GLY CA C 83 45.100 44.453 0.647 1
1 860 . 20 1 1 A 83 83 GLY N N 83 110.200 112.574 -2.374 1
1 861 . 20 1 1 A 84 84 TYR H H 84 7.950 8.329 -0.379 1
1 862 . 20 1 1 A 84 84 TYR HA H 84 4.400 5.273 -0.873 1
1 865 . 20 1 1 A 84 84 TYR CA C 84 58.100 56.360 1.740 1
1 866 . 20 1 1 A 84 84 TYR CB C 84 38.800 40.337 -1.537 1
1 867 . 20 1 1 A 84 84 TYR N N 84 119.900 116.755 3.145 1
1 868 . 20 1 1 A 85 85 ALA H H 85 8.150 8.476 -0.326 1
1 869 . 20 1 1 A 85 85 ALA HA H 85 4.150 4.682 -0.532 1
1 873 . 20 1 1 A 85 85 ALA CA C 85 52.600 51.524 1.076 1
1 874 . 20 1 1 A 85 85 ALA CB C 85 19.200 19.802 -0.602 1
1 875 . 20 1 1 A 85 85 ALA N N 85 124.800 122.680 2.120 1
1 876 . 20 1 1 A 86 86 ASP H H 86 8.020 8.628 -0.608 1
1 877 . 20 1 1 A 86 86 ASP HA H 86 4.450 5.123 -0.673 1
1 880 . 20 1 1 A 86 86 ASP CA C 86 54.100 53.326 0.774 1
1 881 . 20 1 1 A 86 86 ASP CB C 86 41.100 44.714 -3.614 1
1 882 . 20 1 1 A 86 86 ASP N N 86 118.900 122.067 -3.167 1
1 883 . 20 1 1 A 87 87 LEU H H 87 8.010 8.484 -0.474 1
1 884 . 20 1 1 A 87 87 LEU HA H 87 4.210 5.163 -0.953 1
1 893 . 20 1 1 A 87 87 LEU CA C 87 55.300 53.265 2.035 1
1 894 . 20 1 1 A 87 87 LEU CB C 87 42.000 45.528 -3.528 1
1 898 . 20 1 1 A 87 87 LEU N N 87 122.400 121.867 0.533 1
1 899 . 20 1 1 A 88 88 ARG H H 88 8.170 8.605 -0.435 1
1 900 . 20 1 1 A 88 88 ARG HA H 88 4.210 4.663 -0.453 1
1 903 . 20 1 1 A 88 88 ARG CA C 88 56.300 55.214 1.086 1
1 904 . 20 1 1 A 88 88 ARG CB C 88 30.600 33.857 -3.257 1
1 905 . 20 1 1 A 88 88 ARG N N 88 121.200 122.092 -0.892 1
1 906 . 20 1 1 A 91 91 PRO HA H 91 4.290 4.465 -0.175 1
1 911 . 20 1 1 A 91 91 PRO CA C 91 63.800 64.503 -0.703 1
1 912 . 20 1 1 A 91 91 PRO CB C 91 32.100 32.206 -0.106 1
1 915 . 20 1 1 A 92 92 ASP H H 92 8.280 7.796 0.484 1
1 916 . 20 1 1 A 92 92 ASP HA H 92 4.540 5.003 -0.463 1
1 919 . 20 1 1 A 92 92 ASP CA C 92 54.600 53.264 1.336 1
1 920 . 20 1 1 A 92 92 ASP CB C 92 41.000 45.031 -4.031 1
1 921 . 20 1 1 A 92 92 ASP N N 92 118.700 118.123 0.577 1
1 922 . 20 1 1 A 93 93 ARG H H 93 7.780 8.551 -0.771 1
1 923 . 20 1 1 A 93 93 ARG HA H 93 4.190 4.444 -0.254 1
1 930 . 20 1 1 A 93 93 ARG CA C 93 56.300 56.257 0.043 1
1 931 . 20 1 1 A 93 93 ARG CB C 93 30.700 31.631 -0.931 1
1 934 . 20 1 1 A 93 93 ARG N N 93 120.700 122.633 -1.933 1
1 935 . 20 1 1 A 94 94 GLN H H 94 8.280 8.761 -0.481 1
1 936 . 20 1 1 A 94 94 GLN HA H 94 4.210 5.124 -0.914 1
1 941 . 20 1 1 A 94 94 GLN CA C 94 55.800 53.689 2.111 1
1 942 . 20 1 1 A 94 94 GLN CB C 94 29.300 31.756 -2.456 1
1 944 . 20 1 1 A 94 94 GLN N N 94 121.000 116.520 4.480 1
1 945 . 20 1 1 A 95 95 ASP H H 95 8.270 8.648 -0.378 1
1 946 . 20 1 1 A 95 95 ASP HA H 95 4.450 5.443 -0.993 1
1 949 . 20 1 1 A 95 95 ASP CA C 95 54.300 52.790 1.510 1
1 950 . 20 1 1 A 95 95 ASP CB C 95 41.000 44.373 -3.373 1
1 951 . 20 1 1 A 95 95 ASP N N 95 121.000 118.856 2.144 1
1 952 . 20 1 1 A 96 96 HIS H H 96 8.090 8.590 -0.500 1
1 953 . 20 1 1 A 96 96 HIS HA H 96 4.470 5.480 -1.010 1
1 956 . 20 1 1 A 96 96 HIS CA C 96 55.900 53.514 2.386 1
1 957 . 20 1 1 A 96 96 HIS CB C 96 30.500 32.809 -2.309 1
1 958 . 20 1 1 A 96 96 HIS N N 96 119.300 115.871 3.429 1
1 959 . 20 1 1 A 97 97 HIS H H 97 8.240 8.671 -0.431 1
1 960 . 20 1 1 A 97 97 HIS HA H 97 4.470 5.004 -0.534 1
1 963 . 20 1 1 A 97 97 HIS CA C 97 56.200 53.710 2.490 1
1 964 . 20 1 1 A 97 97 HIS CB C 97 30.400 30.928 -0.528 1
1 965 . 20 1 1 A 97 97 HIS N N 97 121.300 114.469 6.831 1
1 966 . 20 1 1 A 98 98 PRO HA H 98 4.340 4.465 -0.125 1
1 973 . 20 1 1 A 98 98 PRO CA C 98 63.700 62.462 1.238 1
1 974 . 20 1 1 A 98 98 PRO CB C 98 31.900 33.172 -1.272 1
1 977 . 20 1 1 A 99 99 GLY H H 99 8.660 8.278 0.382 1
1 978 . 20 1 1 A 99 99 GLY HA2 H 99 3.920 4.279 -0.359 1
1 979 . 20 1 1 A 99 99 GLY HA3 H 99 3.920 4.303 -0.383 1
1 980 . 20 1 1 A 99 99 GLY CA C 99 45.200 45.778 -0.578 1
1 981 . 20 1 1 A 99 99 GLY N N 99 110.000 106.702 3.298 1
1 982 . 20 1 1 A 100 100 SER H H 100 8.170 8.663 -0.493 1
1 983 . 20 1 1 A 100 100 SER HA H 100 4.360 5.042 -0.682 1
1 986 . 20 1 1 A 100 100 SER CA C 100 58.500 56.978 1.522 1
1 987 . 20 1 1 A 100 100 SER CB C 100 64.000 65.374 -1.374 1
1 988 . 20 1 1 A 100 100 SER N N 100 115.600 114.296 1.304 1
1 989 . 20 1 1 A 101 101 GLY H H 101 8.420 8.355 0.065 1
1 990 . 20 1 1 A 101 101 GLY HA2 H 101 3.890 4.251 -0.361 1
1 991 . 20 1 1 A 101 101 GLY HA3 H 101 3.920 4.252 -0.332 1
1 992 . 20 1 1 A 101 101 GLY CA C 101 45.200 46.048 -0.848 1
1 993 . 20 1 1 A 101 101 GLY N N 101 111.000 109.819 1.181 1
1 994 . 20 1 1 A 102 102 ALA H H 102 8.030 8.297 -0.267 1
1 995 . 20 1 1 A 102 102 ALA HA H 102 4.250 4.772 -0.522 1
1 999 . 20 1 1 A 102 102 ALA CA C 102 52.500 51.286 1.214 1
1 1000 . 20 1 1 A 102 102 ALA CB C 102 19.200 22.778 -3.578 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 0 0.000 1
2 1 1 1 "RMS(OBS, PRED)" CA 98 1.225 1
3 1 1 1 "RMS(OBS, PRED)" CB 90 1.722 1
4 1 1 1 "RMS(OBS, PRED)" H 92 0.549 1
5 1 1 1 "RMS(OBS, PRED)" HA 105 0.383 1
6 1 1 1 "RMS(OBS, PRED)" N 91 3.316 1
7 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1
8 1 2 1 "RMS(OBS, PRED)" CA 98 1.251 1
9 1 2 1 "RMS(OBS, PRED)" CB 90 1.554 1
10 1 2 1 "RMS(OBS, PRED)" H 92 0.598 1
11 1 2 1 "RMS(OBS, PRED)" HA 105 0.419 1
12 1 2 1 "RMS(OBS, PRED)" N 91 3.645 1
13 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1
14 1 3 1 "RMS(OBS, PRED)" CA 98 1.193 1
15 1 3 1 "RMS(OBS, PRED)" CB 90 1.580 1
16 1 3 1 "RMS(OBS, PRED)" H 92 0.547 1
17 1 3 1 "RMS(OBS, PRED)" HA 105 0.397 1
18 1 3 1 "RMS(OBS, PRED)" N 91 3.518 1
19 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1
20 1 4 1 "RMS(OBS, PRED)" CA 98 1.331 1
21 1 4 1 "RMS(OBS, PRED)" CB 90 1.654 1
22 1 4 1 "RMS(OBS, PRED)" H 92 0.570 1
23 1 4 1 "RMS(OBS, PRED)" HA 105 0.425 1
24 1 4 1 "RMS(OBS, PRED)" N 91 3.623 1
25 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1
26 1 5 1 "RMS(OBS, PRED)" CA 98 1.171 1
27 1 5 1 "RMS(OBS, PRED)" CB 90 1.544 1
28 1 5 1 "RMS(OBS, PRED)" H 92 0.596 1
29 1 5 1 "RMS(OBS, PRED)" HA 105 0.400 1
30 1 5 1 "RMS(OBS, PRED)" N 91 3.574 1
31 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1
32 1 6 1 "RMS(OBS, PRED)" CA 98 1.151 1
33 1 6 1 "RMS(OBS, PRED)" CB 90 1.623 1
34 1 6 1 "RMS(OBS, PRED)" H 92 0.584 1
35 1 6 1 "RMS(OBS, PRED)" HA 105 0.391 1
36 1 6 1 "RMS(OBS, PRED)" N 91 3.322 1
37 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1
38 1 7 1 "RMS(OBS, PRED)" CA 98 1.166 1
39 1 7 1 "RMS(OBS, PRED)" CB 90 1.692 1
40 1 7 1 "RMS(OBS, PRED)" H 92 0.553 1
41 1 7 1 "RMS(OBS, PRED)" HA 105 0.391 1
42 1 7 1 "RMS(OBS, PRED)" N 91 3.406 1
43 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1
44 1 8 1 "RMS(OBS, PRED)" CA 98 1.154 1
45 1 8 1 "RMS(OBS, PRED)" CB 90 1.529 1
46 1 8 1 "RMS(OBS, PRED)" H 92 0.568 1
47 1 8 1 "RMS(OBS, PRED)" HA 105 0.392 1
48 1 8 1 "RMS(OBS, PRED)" N 91 3.387 1
49 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1
50 1 9 1 "RMS(OBS, PRED)" CA 98 1.282 1
51 1 9 1 "RMS(OBS, PRED)" CB 90 1.615 1
52 1 9 1 "RMS(OBS, PRED)" H 92 0.590 1
53 1 9 1 "RMS(OBS, PRED)" HA 105 0.422 1
54 1 9 1 "RMS(OBS, PRED)" N 91 3.313 1
55 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1
56 1 10 1 "RMS(OBS, PRED)" CA 98 1.171 1
57 1 10 1 "RMS(OBS, PRED)" CB 90 1.823 1
58 1 10 1 "RMS(OBS, PRED)" H 92 0.612 1
59 1 10 1 "RMS(OBS, PRED)" HA 105 0.447 1
60 1 10 1 "RMS(OBS, PRED)" N 91 3.309 1
61 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1
62 1 11 1 "RMS(OBS, PRED)" CA 98 1.214 1
63 1 11 1 "RMS(OBS, PRED)" CB 90 1.695 1
64 1 11 1 "RMS(OBS, PRED)" H 92 0.590 1
65 1 11 1 "RMS(OBS, PRED)" HA 105 0.389 1
66 1 11 1 "RMS(OBS, PRED)" N 91 3.564 1
67 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1
68 1 12 1 "RMS(OBS, PRED)" CA 98 1.117 1
69 1 12 1 "RMS(OBS, PRED)" CB 90 1.592 1
70 1 12 1 "RMS(OBS, PRED)" H 92 0.585 1
71 1 12 1 "RMS(OBS, PRED)" HA 105 0.392 1
72 1 12 1 "RMS(OBS, PRED)" N 91 3.368 1
73 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1
74 1 13 1 "RMS(OBS, PRED)" CA 98 1.280 1
75 1 13 1 "RMS(OBS, PRED)" CB 90 1.575 1
76 1 13 1 "RMS(OBS, PRED)" H 92 0.573 1
77 1 13 1 "RMS(OBS, PRED)" HA 105 0.406 1
78 1 13 1 "RMS(OBS, PRED)" N 91 3.221 1
79 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1
80 1 14 1 "RMS(OBS, PRED)" CA 98 1.202 1
81 1 14 1 "RMS(OBS, PRED)" CB 90 1.659 1
82 1 14 1 "RMS(OBS, PRED)" H 92 0.582 1
83 1 14 1 "RMS(OBS, PRED)" HA 105 0.387 1
84 1 14 1 "RMS(OBS, PRED)" N 91 3.451 1
85 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1
86 1 15 1 "RMS(OBS, PRED)" CA 98 1.239 1
87 1 15 1 "RMS(OBS, PRED)" CB 90 1.786 1
88 1 15 1 "RMS(OBS, PRED)" H 92 0.593 1
89 1 15 1 "RMS(OBS, PRED)" HA 105 0.445 1
90 1 15 1 "RMS(OBS, PRED)" N 91 3.717 1
91 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1
92 1 16 1 "RMS(OBS, PRED)" CA 98 1.294 1
93 1 16 1 "RMS(OBS, PRED)" CB 90 1.771 1
94 1 16 1 "RMS(OBS, PRED)" H 92 0.590 1
95 1 16 1 "RMS(OBS, PRED)" HA 105 0.450 1
96 1 16 1 "RMS(OBS, PRED)" N 91 3.428 1
97 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1
98 1 17 1 "RMS(OBS, PRED)" CA 98 1.325 1
99 1 17 1 "RMS(OBS, PRED)" CB 90 1.786 1
100 1 17 1 "RMS(OBS, PRED)" H 92 0.589 1
101 1 17 1 "RMS(OBS, PRED)" HA 105 0.441 1
102 1 17 1 "RMS(OBS, PRED)" N 91 3.693 1
103 1 18 1 "RMS(OBS, PRED)" C 0 0.000 1
104 1 18 1 "RMS(OBS, PRED)" CA 98 1.078 1
105 1 18 1 "RMS(OBS, PRED)" CB 90 1.602 1
106 1 18 1 "RMS(OBS, PRED)" H 92 0.610 1
107 1 18 1 "RMS(OBS, PRED)" HA 105 0.375 1
108 1 18 1 "RMS(OBS, PRED)" N 91 3.358 1
109 1 19 1 "RMS(OBS, PRED)" C 0 0.000 1
110 1 19 1 "RMS(OBS, PRED)" CA 98 1.341 1
111 1 19 1 "RMS(OBS, PRED)" CB 90 1.673 1
112 1 19 1 "RMS(OBS, PRED)" H 92 0.627 1
113 1 19 1 "RMS(OBS, PRED)" HA 105 0.424 1
114 1 19 1 "RMS(OBS, PRED)" N 91 3.295 1
115 1 20 1 "RMS(OBS, PRED)" C 0 0.000 1
116 1 20 1 "RMS(OBS, PRED)" CA 98 1.253 1
117 1 20 1 "RMS(OBS, PRED)" CB 90 1.783 1
118 1 20 1 "RMS(OBS, PRED)" H 92 0.515 1
119 1 20 1 "RMS(OBS, PRED)" HA 105 0.450 1
120 1 20 1 "RMS(OBS, PRED)" N 91 3.235 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 4 . 1 1 A 2 2 SER H H 2 8.160 8.420 -0.260 2
1 5 . 1 1 A 2 2 SER HA H 2 4.370 4.760 -0.390 2
1 9 . 1 1 A 2 2 SER CA C 2 58.300 58.076 0.224 2
1 10 . 1 1 A 2 2 SER CB C 2 63.900 64.446 -0.546 2
1 11 . 1 1 A 2 2 SER N N 2 115.600 117.010 -1.410 2
1 12 . 1 1 A 3 3 LEU H H 3 8.250 8.236 0.014 2
1 13 . 1 1 A 3 3 LEU HA H 3 4.280 4.748 -0.468 2
1 17 . 1 1 A 3 3 LEU CA C 3 55.200 53.803 1.397 2
1 18 . 1 1 A 3 3 LEU CB C 3 42.100 44.341 -2.241 2
1 19 . 1 1 A 3 3 LEU N N 3 124.100 121.342 2.758 2
1 20 . 1 1 A 4 4 VAL H H 4 7.950 8.700 -0.750 2
1 21 . 1 1 A 4 4 VAL HA H 4 4.680 4.688 -0.008 2
1 26 . 1 1 A 4 4 VAL CA C 4 59.800 58.582 1.218 2
1 27 . 1 1 A 4 4 VAL CB C 4 32.500 33.574 -1.074 2
1 28 . 1 1 A 4 4 VAL N N 4 122.600 118.750 3.850 2
1 29 . 1 1 A 5 5 PRO CA C 5 63.100 62.833 0.267 2
1 30 . 1 1 A 5 5 PRO CB C 5 32.000 32.450 -0.450 2
1 32 . 1 1 A 6 6 ARG H H 6 8.360 8.515 -0.155 2
1 33 . 1 1 A 6 6 ARG HA H 6 4.250 4.798 -0.548 2
1 36 . 1 1 A 6 6 ARG CA C 6 56.000 55.302 0.698 2
1 37 . 1 1 A 6 6 ARG CB C 6 30.900 32.686 -1.786 2
1 38 . 1 1 A 6 6 ARG N N 6 121.800 121.048 0.752 2
1 39 . 1 1 A 7 7 GLY H H 7 8.460 8.299 0.161 2
1 40 . 1 1 A 7 7 GLY HA2 H 7 3.940 4.200 -0.260 2
1 41 . 1 1 A 7 7 GLY HA3 H 7 3.760 4.203 -0.443 2
1 42 . 1 1 A 7 7 GLY CA C 7 45.000 45.239 -0.239 2
1 43 . 1 1 A 7 7 GLY N N 7 110.700 110.208 0.492 2
1 44 . 1 1 A 8 8 SER H H 8 7.990 8.591 -0.601 2
1 45 . 1 1 A 8 8 SER HA H 8 4.450 4.523 -0.073 2
1 48 . 1 1 A 8 8 SER CA C 8 58.900 59.442 -0.542 2
1 49 . 1 1 A 8 8 SER CB C 8 64.200 64.298 -0.098 2
1 50 . 1 1 A 8 8 SER N N 8 115.500 115.425 0.075 2
1 51 . 1 1 A 9 9 MET H H 9 9.040 7.627 1.413 2
1 52 . 1 1 A 9 9 MET HA H 9 4.610 5.079 -0.469 2
1 60 . 1 1 A 9 9 MET CA C 9 54.400 53.592 0.808 2
1 61 . 1 1 A 9 9 MET CB C 9 35.400 33.930 1.470 2
1 64 . 1 1 A 9 9 MET N N 9 120.500 119.409 1.091 2
1 65 . 1 1 A 10 10 GLN H H 10 8.270 8.946 -0.676 2
1 66 . 1 1 A 10 10 GLN HA H 10 5.270 5.298 -0.028 2
1 71 . 1 1 A 10 10 GLN CA C 10 54.200 54.363 -0.163 2
1 72 . 1 1 A 10 10 GLN CB C 10 30.500 32.368 -1.868 2
1 74 . 1 1 A 10 10 GLN N N 10 121.000 122.346 -1.346 2
1 75 . 1 1 A 11 11 ILE H H 11 8.270 8.778 -0.508 2
1 76 . 1 1 A 11 11 ILE HA H 11 4.100 4.805 -0.705 2
1 86 . 1 1 A 11 11 ILE CA C 11 59.400 59.218 0.182 2
1 87 . 1 1 A 11 11 ILE CB C 11 41.800 40.681 1.119 2
1 91 . 1 1 A 11 11 ILE N N 11 114.600 121.425 -6.825 2
1 92 . 1 1 A 12 12 PHE H H 12 8.520 8.829 -0.309 2
1 93 . 1 1 A 12 12 PHE HA H 12 5.540 5.352 0.188 2
1 96 . 1 1 A 12 12 PHE CA C 12 55.000 56.750 -1.750 2
1 97 . 1 1 A 12 12 PHE CB C 12 41.200 40.984 0.216 2
1 98 . 1 1 A 12 12 PHE N N 12 118.600 123.595 -4.995 2
1 99 . 1 1 A 13 13 VAL H H 13 9.230 8.944 0.286 2
1 100 . 1 1 A 13 13 VAL HA H 13 4.740 5.093 -0.353 2
1 108 . 1 1 A 13 13 VAL CA C 13 60.300 60.481 -0.181 2
1 109 . 1 1 A 13 13 VAL CB C 13 34.100 35.193 -1.093 2
1 112 . 1 1 A 13 13 VAL N N 13 121.400 123.390 -1.990 2
1 113 . 1 1 A 14 14 LYS H H 14 8.910 8.672 0.238 2
1 114 . 1 1 A 14 14 LYS HA H 14 5.190 4.800 0.390 2
1 122 . 1 1 A 14 14 LYS CA C 14 54.600 54.859 -0.259 2
1 123 . 1 1 A 14 14 LYS CB C 14 34.300 34.631 -0.331 2
1 126 . 1 1 A 14 14 LYS N N 14 128.000 126.706 1.294 2
1 127 . 1 1 A 15 15 THR H H 15 8.650 8.838 -0.188 2
1 128 . 1 1 A 15 15 THR HA H 15 4.870 4.671 0.199 2
1 133 . 1 1 A 15 15 THR CA C 15 60.300 60.710 -0.410 2
1 134 . 1 1 A 15 15 THR CB C 15 70.600 71.314 -0.714 2
1 136 . 1 1 A 15 15 THR N N 15 115.300 117.042 -1.742 2
1 137 . 1 1 A 16 16 LEU H H 16 9.070 8.816 0.254 2
1 138 . 1 1 A 16 16 LEU HA H 16 4.210 4.035 0.175 2
1 148 . 1 1 A 16 16 LEU CA C 16 57.400 57.593 -0.193 2
1 149 . 1 1 A 16 16 LEU CB C 16 41.800 41.553 0.246 2
1 153 . 1 1 A 16 16 LEU N N 16 121.400 121.386 0.014 2
1 154 . 1 1 A 17 17 THR H H 17 7.560 7.771 -0.211 2
1 155 . 1 1 A 17 17 THR HA H 17 4.330 4.306 0.024 2
1 160 . 1 1 A 17 17 THR CA C 17 61.400 63.532 -2.132 2
1 161 . 1 1 A 17 17 THR CB C 17 68.900 69.630 -0.730 2
1 163 . 1 1 A 17 17 THR N N 17 105.900 112.601 -6.701 2
1 164 . 1 1 A 18 18 GLY H H 18 7.750 7.768 -0.018 2
1 165 . 1 1 A 18 18 GLY HA2 H 18 4.250 4.027 0.223 2
1 166 . 1 1 A 18 18 GLY HA3 H 18 3.520 4.039 -0.519 2
1 167 . 1 1 A 18 18 GLY CA C 18 45.300 45.051 0.249 2
1 168 . 1 1 A 18 18 GLY N N 18 109.300 109.281 0.019 2
1 169 . 1 1 A 19 19 LYS H H 19 7.210 7.730 -0.520 2
1 170 . 1 1 A 19 19 LYS HA H 19 4.260 4.289 -0.029 2
1 175 . 1 1 A 19 19 LYS CA C 19 56.300 56.683 -0.383 2
1 176 . 1 1 A 19 19 LYS CB C 19 33.200 33.891 -0.691 2
1 179 . 1 1 A 19 19 LYS N N 19 122.000 120.841 1.158 2
1 180 . 1 1 A 20 20 THR H H 20 8.570 8.666 -0.096 2
1 181 . 1 1 A 20 20 THR HA H 20 4.950 5.437 -0.487 2
1 186 . 1 1 A 20 20 THR CA C 20 62.200 60.895 1.305 2
1 187 . 1 1 A 20 20 THR CB C 20 69.700 70.682 -0.982 2
1 189 . 1 1 A 20 20 THR N N 20 120.700 114.618 6.082 2
1 190 . 1 1 A 21 21 ILE H H 21 9.510 8.692 0.818 2
1 191 . 1 1 A 21 21 ILE HA H 21 4.390 4.861 -0.471 2
1 201 . 1 1 A 21 21 ILE CA C 21 60.000 59.066 0.934 2
1 202 . 1 1 A 21 21 ILE CB C 21 40.700 41.576 -0.876 2
1 206 . 1 1 A 21 21 ILE N N 21 128.200 122.731 5.469 2
1 207 . 1 1 A 22 22 THR H H 22 8.700 8.719 -0.019 2
1 208 . 1 1 A 22 22 THR HA H 22 4.860 4.492 0.368 2
1 213 . 1 1 A 22 22 THR CA C 22 62.100 62.817 -0.717 2
1 214 . 1 1 A 22 22 THR CB C 22 69.500 69.102 0.398 2
1 216 . 1 1 A 22 22 THR N N 22 122.300 121.259 1.041 2
1 217 . 1 1 A 23 23 LEU H H 23 8.720 8.898 -0.178 2
1 218 . 1 1 A 23 23 LEU HA H 23 4.690 5.017 -0.327 2
1 228 . 1 1 A 23 23 LEU CA C 23 52.700 53.484 -0.784 2
1 229 . 1 1 A 23 23 LEU CB C 23 46.600 45.374 1.226 2
1 233 . 1 1 A 23 23 LEU N N 23 125.400 127.349 -1.949 2
1 234 . 1 1 A 24 24 GLU H H 24 8.080 8.648 -0.568 2
1 235 . 1 1 A 24 24 GLU HA H 24 4.800 4.919 -0.119 2
1 238 . 1 1 A 24 24 GLU CA C 24 55.400 55.532 -0.132 2
1 239 . 1 1 A 24 24 GLU CB C 24 30.100 31.415 -1.315 2
1 241 . 1 1 A 24 24 GLU N N 24 121.800 120.629 1.172 2
1 242 . 1 1 A 25 25 VAL H H 25 8.800 8.774 0.026 2
1 243 . 1 1 A 25 25 VAL HA H 25 4.640 4.932 -0.292 2
1 251 . 1 1 A 25 25 VAL CA C 25 58.600 59.723 -1.123 2
1 252 . 1 1 A 25 25 VAL CB C 25 36.300 35.760 0.540 2
1 255 . 1 1 A 25 25 VAL N N 25 116.700 119.865 -3.165 2
1 256 . 1 1 A 26 26 GLU H H 26 8.500 8.417 0.083 2
1 257 . 1 1 A 26 26 GLU HA H 26 4.900 4.617 0.283 2
1 260 . 1 1 A 26 26 GLU CA C 26 53.000 54.010 -1.010 2
1 261 . 1 1 A 26 26 GLU CB C 26 31.200 33.655 -2.455 2
1 262 . 1 1 A 26 26 GLU N N 26 117.900 122.903 -5.003 2
1 263 . 1 1 A 27 27 PRO HA H 27 4.040 4.399 -0.359 2
1 270 . 1 1 A 27 27 PRO CA C 27 65.400 64.684 0.716 2
1 271 . 1 1 A 27 27 PRO CB C 27 31.700 31.962 -0.262 2
1 274 . 1 1 A 28 28 SER H H 28 7.010 8.112 -1.102 2
1 275 . 1 1 A 28 28 SER HA H 28 4.280 4.533 -0.253 2
1 278 . 1 1 A 28 28 SER CA C 28 57.400 58.418 -1.018 2
1 279 . 1 1 A 28 28 SER CB C 28 63.400 64.148 -0.748 2
1 280 . 1 1 A 28 28 SER N N 28 103.800 110.958 -7.158 2
1 281 . 1 1 A 29 29 ASP H H 29 7.960 7.748 0.212 2
1 282 . 1 1 A 29 29 ASP HA H 29 4.600 5.032 -0.432 2
1 285 . 1 1 A 29 29 ASP CA C 29 55.900 53.161 2.739 2
1 286 . 1 1 A 29 29 ASP CB C 29 41.000 42.579 -1.579 2
1 287 . 1 1 A 29 29 ASP N N 29 123.700 121.680 2.020 2
1 288 . 1 1 A 30 30 THR H H 30 7.780 8.714 -0.934 2
1 289 . 1 1 A 30 30 THR HA H 30 4.850 4.668 0.182 2
1 294 . 1 1 A 30 30 THR CA C 30 59.400 60.474 -1.074 2
1 295 . 1 1 A 30 30 THR CB C 30 71.100 70.945 0.155 2
1 297 . 1 1 A 30 30 THR N N 30 108.800 118.516 -9.716 2
1 298 . 1 1 A 31 31 ILE H H 31 8.320 8.982 -0.662 2
1 299 . 1 1 A 31 31 ILE HA H 31 3.580 3.749 -0.169 2
1 309 . 1 1 A 31 31 ILE CA C 31 62.200 64.759 -2.559 2
1 310 . 1 1 A 31 31 ILE CB C 31 34.300 37.582 -3.282 2
1 314 . 1 1 A 31 31 ILE N N 31 121.300 126.041 -4.741 2
1 315 . 1 1 A 32 32 GLU H H 32 9.850 8.353 1.497 2
1 316 . 1 1 A 32 32 GLU HA H 32 3.780 3.935 -0.155 2
1 321 . 1 1 A 32 32 GLU CA C 32 60.500 59.853 0.647 2
1 322 . 1 1 A 32 32 GLU CB C 32 28.800 29.280 -0.480 2
1 324 . 1 1 A 32 32 GLU N N 32 121.600 122.077 -0.477 2
1 325 . 1 1 A 33 33 ASN H H 33 7.810 7.658 0.152 2
1 326 . 1 1 A 33 33 ASN HA H 33 4.440 4.572 -0.132 2
1 329 . 1 1 A 33 33 ASN CA C 33 55.800 55.896 -0.096 2
1 330 . 1 1 A 33 33 ASN CB C 33 38.100 38.560 -0.460 2
1 331 . 1 1 A 33 33 ASN N N 33 121.000 118.355 2.645 2
1 332 . 1 1 A 34 34 VAL H H 34 8.000 7.928 0.072 2
1 333 . 1 1 A 34 34 VAL HA H 34 3.300 3.674 -0.374 2
1 341 . 1 1 A 34 34 VAL CA C 34 67.600 66.660 0.940 2
1 342 . 1 1 A 34 34 VAL CB C 34 30.700 31.497 -0.797 2
1 345 . 1 1 A 34 34 VAL N N 34 122.200 119.907 2.293 2
1 346 . 1 1 A 35 35 LYS H H 35 8.490 8.347 0.143 2
1 347 . 1 1 A 35 35 LYS HA H 35 4.500 4.056 0.443 2
1 352 . 1 1 A 35 35 LYS CA C 35 59.300 58.778 0.522 2
1 353 . 1 1 A 35 35 LYS CB C 35 33.500 32.011 1.489 2
1 354 . 1 1 A 35 35 LYS N N 35 119.200 120.272 -1.072 2
1 355 . 1 1 A 36 36 ALA H H 36 7.880 8.224 -0.344 2
1 356 . 1 1 A 36 36 ALA HA H 36 4.060 4.058 0.002 2
1 360 . 1 1 A 36 36 ALA CA C 36 55.300 55.027 0.273 2
1 361 . 1 1 A 36 36 ALA CB C 36 17.600 18.226 -0.626 2
1 362 . 1 1 A 36 36 ALA N N 36 123.300 122.071 1.229 2
1 363 . 1 1 A 37 37 LYS H H 37 7.790 7.886 -0.096 2
1 364 . 1 1 A 37 37 LYS HA H 37 4.110 4.055 0.055 2
1 373 . 1 1 A 37 37 LYS CA C 37 59.700 59.486 0.214 2
1 374 . 1 1 A 37 37 LYS CB C 37 33.100 32.382 0.718 2
1 378 . 1 1 A 37 37 LYS N N 37 120.400 117.257 3.143 2
1 379 . 1 1 A 38 38 ILE H H 38 8.240 7.864 0.376 2
1 380 . 1 1 A 38 38 ILE HA H 38 3.410 3.967 -0.557 2
1 390 . 1 1 A 38 38 ILE CA C 38 66.200 62.394 3.806 2
1 391 . 1 1 A 38 38 ILE CB C 38 36.800 37.651 -0.851 2
1 395 . 1 1 A 38 38 ILE N N 38 121.400 120.015 1.385 2
1 396 . 1 1 A 39 39 GLN H H 39 8.460 8.377 0.083 2
1 397 . 1 1 A 39 39 GLN HA H 39 3.730 3.975 -0.245 2
1 402 . 1 1 A 39 39 GLN CA C 39 60.000 58.847 1.153 2
1 403 . 1 1 A 39 39 GLN CB C 39 27.600 28.399 -0.799 2
1 405 . 1 1 A 39 39 GLN N N 39 123.500 121.066 2.434 2
1 406 . 1 1 A 40 40 ASP H H 40 7.970 7.941 0.029 2
1 407 . 1 1 A 40 40 ASP HA H 40 4.240 4.395 -0.155 2
1 410 . 1 1 A 40 40 ASP CA C 40 57.400 56.679 0.721 2
1 411 . 1 1 A 40 40 ASP CB C 40 41.000 40.655 0.345 2
1 412 . 1 1 A 40 40 ASP N N 40 119.900 119.337 0.563 2
1 413 . 1 1 A 41 41 LYS H H 41 7.420 7.767 -0.347 2
1 414 . 1 1 A 41 41 LYS HA H 41 4.200 4.113 0.087 2
1 423 . 1 1 A 41 41 LYS CA C 41 58.200 59.151 -0.951 2
1 424 . 1 1 A 41 41 LYS CB C 41 33.900 32.787 1.113 2
1 427 . 1 1 A 41 41 LYS N N 41 115.700 119.432 -3.732 2
1 428 . 1 1 A 42 42 GLU H H 42 8.650 7.905 0.745 2
1 429 . 1 1 A 42 42 GLU HA H 42 4.470 4.548 -0.078 2
1 434 . 1 1 A 42 42 GLU CA C 42 55.300 55.922 -0.622 2
1 435 . 1 1 A 42 42 GLU CB C 42 33.200 32.020 1.180 2
1 437 . 1 1 A 42 42 GLU N N 42 114.200 114.610 -0.410 2
1 438 . 1 1 A 43 43 GLY H H 43 8.400 7.925 0.475 2
1 439 . 1 1 A 43 43 GLY HA2 H 43 4.040 3.942 0.098 2
1 440 . 1 1 A 43 43 GLY HA3 H 43 3.820 3.950 -0.130 2
1 441 . 1 1 A 43 43 GLY CA C 43 45.900 45.688 0.212 2
1 442 . 1 1 A 43 43 GLY N N 43 109.000 109.117 -0.117 2
1 443 . 1 1 A 44 44 ILE H H 44 6.080 7.776 -1.696 2
1 444 . 1 1 A 44 44 ILE HA H 44 4.290 4.221 0.069 2
1 446 . 1 1 A 44 44 ILE CA C 44 57.700 59.009 -1.309 2
1 447 . 1 1 A 44 44 ILE CB C 44 40.400 38.544 1.856 2
1 448 . 1 1 A 44 44 ILE N N 44 120.500 121.945 -1.445 2
1 449 . 1 1 A 46 46 PRO HA H 46 4.030 4.285 -0.255 2
1 454 . 1 1 A 46 46 PRO CA C 46 66.100 65.157 0.943 2
1 455 . 1 1 A 46 46 PRO CB C 46 32.600 31.974 0.626 2
1 458 . 1 1 A 47 47 ASP H H 47 8.470 8.605 -0.135 2
1 459 . 1 1 A 47 47 ASP HA H 47 4.310 4.393 -0.083 2
1 462 . 1 1 A 47 47 ASP CA C 47 55.700 56.601 -0.901 2
1 463 . 1 1 A 47 47 ASP CB C 47 39.700 40.206 -0.506 2
1 464 . 1 1 A 47 47 ASP N N 47 113.700 117.179 -3.479 2
1 465 . 1 1 A 48 48 GLN H H 48 7.720 7.570 0.150 2
1 466 . 1 1 A 48 48 GLN HA H 48 4.340 4.433 -0.093 2
1 471 . 1 1 A 48 48 GLN CA C 48 55.500 55.688 -0.188 2
1 472 . 1 1 A 48 48 GLN CB C 48 29.900 30.031 -0.131 2
1 474 . 1 1 A 48 48 GLN N N 48 116.900 116.370 0.530 2
1 475 . 1 1 A 49 49 GLN H H 49 7.410 7.703 -0.293 2
1 476 . 1 1 A 49 49 GLN HA H 49 4.110 4.326 -0.216 2
1 481 . 1 1 A 49 49 GLN CA C 49 56.600 55.791 0.809 2
1 482 . 1 1 A 49 49 GLN CB C 49 31.300 29.822 1.478 2
1 484 . 1 1 A 49 49 GLN N N 49 118.000 119.978 -1.978 2
1 485 . 1 1 A 50 50 ARG H H 50 8.400 8.649 -0.249 2
1 486 . 1 1 A 50 50 ARG HA H 50 4.380 4.810 -0.430 2
1 491 . 1 1 A 50 50 ARG CA C 50 55.100 54.984 0.116 2
1 492 . 1 1 A 50 50 ARG CB C 50 31.600 32.360 -0.760 2
1 494 . 1 1 A 50 50 ARG N N 50 123.100 123.480 -0.380 2
1 495 . 1 1 A 51 51 LEU H H 51 8.710 8.657 0.053 2
1 496 . 1 1 A 51 51 LEU HA H 51 5.300 5.114 0.186 2
1 506 . 1 1 A 51 51 LEU CA C 51 52.900 53.530 -0.630 2
1 507 . 1 1 A 51 51 LEU CB C 51 45.700 44.631 1.069 2
1 511 . 1 1 A 51 51 LEU N N 51 124.400 122.690 1.710 2
1 512 . 1 1 A 52 52 ILE H H 52 9.060 8.936 0.124 2
1 513 . 1 1 A 52 52 ILE HA H 52 4.840 5.040 -0.200 2
1 523 . 1 1 A 52 52 ILE CA C 52 58.900 60.134 -1.234 2
1 524 . 1 1 A 52 52 ILE CB C 52 41.200 40.715 0.485 2
1 528 . 1 1 A 52 52 ILE N N 52 122.500 124.866 -2.366 2
1 529 . 1 1 A 53 53 PHE H H 53 8.730 9.472 -0.742 2
1 530 . 1 1 A 53 53 PHE HA H 53 5.100 4.817 0.283 2
1 535 . 1 1 A 53 53 PHE CA C 53 56.300 57.481 -1.181 2
1 536 . 1 1 A 53 53 PHE CB C 53 43.500 41.895 1.605 2
1 537 . 1 1 A 53 53 PHE N N 53 124.800 127.761 -2.961 2
1 538 . 1 1 A 54 54 ALA H H 54 8.940 9.138 -0.198 2
1 539 . 1 1 A 54 54 ALA HA H 54 3.610 3.895 -0.285 2
1 543 . 1 1 A 54 54 ALA CA C 54 52.500 53.014 -0.514 2
1 544 . 1 1 A 54 54 ALA CB C 54 16.300 17.361 -1.061 2
1 545 . 1 1 A 54 54 ALA N N 54 133.100 130.327 2.773 2
1 546 . 1 1 A 55 55 GLY H H 55 8.070 8.449 -0.379 2
1 547 . 1 1 A 55 55 GLY HA2 H 55 4.000 3.810 0.190 2
1 548 . 1 1 A 55 55 GLY HA3 H 55 3.340 3.844 -0.504 2
1 549 . 1 1 A 55 55 GLY CA C 55 45.200 45.319 -0.119 2
1 550 . 1 1 A 55 55 GLY N N 55 102.500 102.658 -0.158 2
1 551 . 1 1 A 56 56 LYS H H 56 7.860 7.885 -0.025 2
1 552 . 1 1 A 56 56 LYS HA H 56 4.510 4.605 -0.095 2
1 558 . 1 1 A 56 56 LYS CA C 56 54.500 54.760 -0.260 2
1 559 . 1 1 A 56 56 LYS CB C 56 34.400 34.046 0.354 2
1 561 . 1 1 A 56 56 LYS N N 56 121.800 121.498 0.302 2
1 562 . 1 1 A 57 57 GLN H H 57 8.600 8.571 0.029 2
1 563 . 1 1 A 57 57 GLN HA H 57 4.410 4.905 -0.495 2
1 568 . 1 1 A 57 57 GLN CA C 57 55.900 55.617 0.283 2
1 569 . 1 1 A 57 57 GLN CB C 57 28.800 29.772 -0.972 2
1 571 . 1 1 A 57 57 GLN N N 57 123.200 125.281 -2.081 2
1 572 . 1 1 A 58 58 LEU H H 58 8.480 8.547 -0.067 2
1 573 . 1 1 A 58 58 LEU HA H 58 4.060 4.948 -0.888 2
1 583 . 1 1 A 58 58 LEU CA C 58 54.100 53.308 0.792 2
1 584 . 1 1 A 58 58 LEU CB C 58 41.500 44.811 -3.311 2
1 588 . 1 1 A 58 58 LEU N N 58 125.900 122.149 3.751 2
1 589 . 1 1 A 59 59 GLU H H 59 8.400 8.632 -0.232 2
1 590 . 1 1 A 59 59 GLU HA H 59 4.400 4.746 -0.346 2
1 595 . 1 1 A 59 59 GLU CA C 59 55.900 56.075 -0.175 2
1 596 . 1 1 A 59 59 GLU CB C 59 31.900 32.222 -0.322 2
1 598 . 1 1 A 59 59 GLU N N 59 123.100 118.816 4.284 2
1 599 . 1 1 A 60 60 ASP H H 60 8.110 8.285 -0.175 2
1 600 . 1 1 A 60 60 ASP HA H 60 4.270 4.951 -0.681 2
1 603 . 1 1 A 60 60 ASP CA C 60 57.100 53.671 3.429 2
1 604 . 1 1 A 60 60 ASP CB C 60 40.800 43.230 -2.430 2
1 605 . 1 1 A 60 60 ASP N N 60 120.300 119.775 0.525 2
1 606 . 1 1 A 61 61 GLY HA2 H 61 4.000 4.069 -0.069 2
1 607 . 1 1 A 61 61 GLY HA3 H 61 3.830 4.094 -0.264 2
1 608 . 1 1 A 61 61 GLY CA C 61 45.000 45.584 -0.584 2
1 609 . 1 1 A 62 62 ARG H H 62 7.350 8.324 -0.974 2
1 610 . 1 1 A 62 62 ARG HA H 62 4.640 4.846 -0.206 2
1 615 . 1 1 A 62 62 ARG CA C 62 54.400 54.276 0.124 2
1 616 . 1 1 A 62 62 ARG CB C 62 32.600 33.503 -0.903 2
1 618 . 1 1 A 62 62 ARG N N 62 119.300 122.673 -3.373 2
1 619 . 1 1 A 63 63 THR H H 63 8.460 8.730 -0.270 2
1 620 . 1 1 A 63 63 THR HA H 63 5.060 4.638 0.422 2
1 625 . 1 1 A 63 63 THR CA C 63 59.700 60.807 -1.107 2
1 626 . 1 1 A 63 63 THR CB C 63 72.000 71.081 0.919 2
1 628 . 1 1 A 63 63 THR N N 63 109.100 113.037 -3.937 2
1 629 . 1 1 A 64 64 LEU H H 64 8.190 8.769 -0.579 2
1 630 . 1 1 A 64 64 LEU HA H 64 3.920 3.988 -0.068 2
1 640 . 1 1 A 64 64 LEU CA C 64 58.400 57.969 0.431 2
1 641 . 1 1 A 64 64 LEU CB C 64 40.200 41.350 -1.150 2
1 645 . 1 1 A 64 64 LEU N N 64 118.100 123.142 -5.042 2
1 646 . 1 1 A 65 65 SER H H 65 8.370 7.838 0.532 2
1 647 . 1 1 A 65 65 SER HA H 65 4.150 4.177 -0.027 2
1 650 . 1 1 A 65 65 SER CA C 65 60.900 60.716 0.184 2
1 651 . 1 1 A 65 65 SER CB C 65 62.500 63.262 -0.762 2
1 652 . 1 1 A 65 65 SER N N 65 112.200 114.342 -2.142 2
1 653 . 1 1 A 66 66 GLU H H 66 7.780 7.883 -0.103 2
1 654 . 1 1 A 66 66 GLU HA H 66 3.890 4.141 -0.251 2
1 659 . 1 1 A 66 66 GLU CA C 66 59.200 58.864 0.336 2
1 660 . 1 1 A 66 66 GLU CB C 66 29.400 29.469 -0.069 2
1 662 . 1 1 A 66 66 GLU N N 66 123.600 121.681 1.919 2
1 663 . 1 1 A 67 67 TYR H H 67 7.290 7.730 -0.440 2
1 664 . 1 1 A 67 67 TYR HA H 67 4.590 4.570 0.020 2
1 669 . 1 1 A 67 67 TYR CA C 67 58.400 58.771 -0.371 2
1 670 . 1 1 A 67 67 TYR CB C 67 39.800 38.915 0.885 2
1 671 . 1 1 A 67 67 TYR N N 67 116.400 119.219 -2.819 2
1 672 . 1 1 A 68 68 ASN H H 68 8.040 7.965 0.075 2
1 673 . 1 1 A 68 68 ASN HA H 68 4.240 4.331 -0.091 2
1 676 . 1 1 A 68 68 ASN CA C 68 54.100 54.383 -0.283 2
1 677 . 1 1 A 68 68 ASN CB C 68 37.200 37.199 0.001 2
1 678 . 1 1 A 68 68 ASN N N 68 115.600 116.338 -0.738 2
1 679 . 1 1 A 69 69 ILE H H 69 7.200 7.483 -0.283 2
1 680 . 1 1 A 69 69 ILE HA H 69 3.280 4.612 -1.332 2
1 690 . 1 1 A 69 69 ILE CA C 69 59.800 59.273 0.527 2
1 691 . 1 1 A 69 69 ILE CB C 69 36.600 39.784 -3.184 2
1 695 . 1 1 A 69 69 ILE N N 69 119.100 114.735 4.365 2
1 696 . 1 1 A 70 70 GLN H H 70 7.570 8.524 -0.954 2
1 697 . 1 1 A 70 70 GLN HA H 70 4.410 4.498 -0.088 2
1 702 . 1 1 A 70 70 GLN CA C 70 53.500 55.245 -1.744 2
1 703 . 1 1 A 70 70 GLN CB C 70 31.500 28.524 2.976 2
1 705 . 1 1 A 70 70 GLN N N 70 124.800 120.963 3.837 2
1 706 . 1 1 A 71 71 LYS H H 71 8.370 7.868 0.502 2
1 707 . 1 1 A 71 71 LYS HA H 71 3.870 3.913 -0.043 2
1 716 . 1 1 A 71 71 LYS CA C 71 58.000 56.742 1.258 2
1 717 . 1 1 A 71 71 LYS CB C 71 32.500 32.066 0.434 2
1 720 . 1 1 A 71 71 LYS N N 71 120.200 121.811 -1.611 2
1 721 . 1 1 A 72 72 GLU H H 72 9.230 8.082 1.148 2
1 722 . 1 1 A 72 72 GLU HA H 72 3.240 4.365 -1.125 2
1 727 . 1 1 A 72 72 GLU CA C 72 58.300 56.136 2.164 2
1 728 . 1 1 A 72 72 GLU CB C 72 26.000 29.467 -3.467 2
1 730 . 1 1 A 72 72 GLU N N 72 115.100 118.775 -3.675 2
1 731 . 1 1 A 73 73 SER H H 73 7.690 8.165 -0.475 2
1 732 . 1 1 A 73 73 SER HA H 73 4.520 4.753 -0.234 2
1 735 . 1 1 A 73 73 SER CA C 73 61.100 59.137 1.963 2
1 736 . 1 1 A 73 73 SER CB C 73 64.800 64.635 0.165 2
1 737 . 1 1 A 73 73 SER N N 73 115.300 114.731 0.569 2
1 738 . 1 1 A 74 74 THR H H 74 8.620 7.850 0.770 2
1 739 . 1 1 A 74 74 THR HA H 74 5.200 5.092 0.108 2
1 744 . 1 1 A 74 74 THR CA C 74 62.400 61.786 0.614 2
1 745 . 1 1 A 74 74 THR CB C 74 70.200 70.802 -0.602 2
1 747 . 1 1 A 74 74 THR N N 74 117.500 111.879 5.621 2
1 748 . 1 1 A 75 75 LEU H H 75 9.350 9.026 0.324 2
1 749 . 1 1 A 75 75 LEU HA H 75 4.990 5.029 -0.039 2
1 759 . 1 1 A 75 75 LEU CA C 75 53.800 53.734 0.066 2
1 760 . 1 1 A 75 75 LEU CB C 75 44.400 45.976 -1.576 2
1 764 . 1 1 A 75 75 LEU N N 75 128.000 127.272 0.728 2
1 765 . 1 1 A 76 76 HIS H H 76 9.140 8.445 0.695 2
1 766 . 1 1 A 76 76 HIS HA H 76 5.040 5.179 -0.139 2
1 769 . 1 1 A 76 76 HIS CA C 76 56.200 54.322 1.878 2
1 770 . 1 1 A 76 76 HIS CB C 76 32.500 32.036 0.464 2
1 771 . 1 1 A 76 76 HIS N N 76 119.600 122.654 -3.054 2
1 772 . 1 1 A 77 77 LEU H H 77 8.240 8.972 -0.732 2
1 773 . 1 1 A 77 77 LEU HA H 77 5.080 5.216 -0.136 2
1 783 . 1 1 A 77 77 LEU CA C 77 53.600 53.776 -0.176 2
1 784 . 1 1 A 77 77 LEU CB C 77 44.100 43.422 0.678 2
1 788 . 1 1 A 77 77 LEU N N 77 123.800 122.537 1.263 2
1 789 . 1 1 A 78 78 VAL H H 78 9.110 8.739 0.371 2
1 790 . 1 1 A 78 78 VAL HA H 78 4.260 4.715 -0.455 2
1 798 . 1 1 A 78 78 VAL CA C 78 60.400 60.874 -0.474 2
1 799 . 1 1 A 78 78 VAL CB C 78 34.700 35.759 -1.059 2
1 802 . 1 1 A 78 78 VAL N N 78 127.100 124.265 2.835 2
1 803 . 1 1 A 79 79 LEU H H 79 8.050 8.860 -0.810 2
1 804 . 1 1 A 79 79 LEU HA H 79 4.950 4.906 0.044 2
1 813 . 1 1 A 79 79 LEU CA C 79 53.800 53.247 0.553 2
1 814 . 1 1 A 79 79 LEU CB C 79 42.700 44.375 -1.675 2
1 818 . 1 1 A 79 79 LEU N N 79 123.400 128.729 -5.329 2
1 819 . 1 1 A 80 80 ARG H H 80 8.540 8.927 -0.387 2
1 820 . 1 1 A 80 80 ARG HA H 80 4.170 3.966 0.204 2
1 827 . 1 1 A 80 80 ARG CA C 80 55.800 56.969 -1.169 2
1 828 . 1 1 A 80 80 ARG CB C 80 31.100 28.921 2.179 2
1 830 . 1 1 A 80 80 ARG N N 80 123.500 126.264 -2.764 2
1 831 . 1 1 A 81 81 LEU H H 81 8.250 7.874 0.376 2
1 832 . 1 1 A 81 81 LEU HA H 81 4.270 4.309 -0.039 2
1 842 . 1 1 A 81 81 LEU CA C 81 55.000 54.749 0.251 2
1 843 . 1 1 A 81 81 LEU CB C 81 42.200 43.043 -0.843 2
1 847 . 1 1 A 81 81 LEU N N 81 124.100 120.147 3.953 2
1 848 . 1 1 A 82 82 ARG H H 82 8.310 8.720 -0.410 2
1 849 . 1 1 A 82 82 ARG HA H 82 4.200 4.565 -0.365 2
1 852 . 1 1 A 82 82 ARG CA C 82 56.300 56.264 0.036 2
1 853 . 1 1 A 82 82 ARG CB C 82 30.700 32.780 -2.080 2
1 855 . 1 1 A 82 82 ARG N N 82 121.500 120.492 1.008 2
1 856 . 1 1 A 83 83 GLY H H 83 8.410 8.127 0.283 2
1 857 . 1 1 A 83 83 GLY HA2 H 83 3.750 4.004 -0.254 2
1 858 . 1 1 A 83 83 GLY HA3 H 83 3.754 4.069 -0.315 2
1 859 . 1 1 A 83 83 GLY CA C 83 45.100 45.264 -0.164 2
1 860 . 1 1 A 83 83 GLY N N 83 110.200 108.569 1.631 2
1 861 . 1 1 A 84 84 TYR H H 84 7.950 8.333 -0.383 2
1 862 . 1 1 A 84 84 TYR HA H 84 4.400 5.049 -0.649 2
1 865 . 1 1 A 84 84 TYR CA C 84 58.100 57.148 0.952 2
1 866 . 1 1 A 84 84 TYR CB C 84 38.800 40.709 -1.909 2
1 867 . 1 1 A 84 84 TYR N N 84 119.900 119.791 0.109 2
1 868 . 1 1 A 85 85 ALA H H 85 8.150 8.495 -0.345 2
1 869 . 1 1 A 85 85 ALA HA H 85 4.150 4.774 -0.624 2
1 873 . 1 1 A 85 85 ALA CA C 85 52.600 51.443 1.157 2
1 874 . 1 1 A 85 85 ALA CB C 85 19.200 21.628 -2.428 2
1 875 . 1 1 A 85 85 ALA N N 85 124.800 123.337 1.463 2
1 876 . 1 1 A 86 86 ASP H H 86 8.020 8.621 -0.601 2
1 877 . 1 1 A 86 86 ASP HA H 86 4.450 4.977 -0.527 2
1 880 . 1 1 A 86 86 ASP CA C 86 54.100 53.401 0.699 2
1 881 . 1 1 A 86 86 ASP CB C 86 41.100 43.614 -2.514 2
1 882 . 1 1 A 86 86 ASP N N 86 118.900 119.031 -0.131 2
1 883 . 1 1 A 87 87 LEU H H 87 8.010 8.473 -0.463 2
1 884 . 1 1 A 87 87 LEU HA H 87 4.210 4.522 -0.312 2
1 893 . 1 1 A 87 87 LEU CA C 87 55.300 54.768 0.532 2
1 894 . 1 1 A 87 87 LEU CB C 87 42.000 42.451 -0.451 2
1 898 . 1 1 A 87 87 LEU N N 87 122.400 121.298 1.102 2
1 899 . 1 1 A 88 88 ARG H H 88 8.170 8.253 -0.083 2
1 900 . 1 1 A 88 88 ARG HA H 88 4.210 4.582 -0.371 2
1 903 . 1 1 A 88 88 ARG CA C 88 56.300 55.852 0.448 2
1 904 . 1 1 A 88 88 ARG CB C 88 30.600 32.532 -1.932 2
1 905 . 1 1 A 88 88 ARG N N 88 121.200 121.282 -0.082 2
1 906 . 1 1 A 91 91 PRO HA H 91 4.290 4.613 -0.323 2
1 911 . 1 1 A 91 91 PRO CA C 91 63.800 63.089 0.711 2
1 912 . 1 1 A 91 91 PRO CB C 91 32.100 31.180 0.920 2
1 915 . 1 1 A 92 92 ASP H H 92 8.280 8.240 0.040 2
1 916 . 1 1 A 92 92 ASP HA H 92 4.540 4.998 -0.458 2
1 919 . 1 1 A 92 92 ASP CA C 92 54.600 53.484 1.116 2
1 920 . 1 1 A 92 92 ASP CB C 92 41.000 43.865 -2.865 2
1 921 . 1 1 A 92 92 ASP N N 92 118.700 119.639 -0.939 2
1 922 . 1 1 A 93 93 ARG H H 93 7.780 8.542 -0.762 2
1 923 . 1 1 A 93 93 ARG HA H 93 4.190 4.613 -0.423 2
1 930 . 1 1 A 93 93 ARG CA C 93 56.300 55.385 0.915 2
1 931 . 1 1 A 93 93 ARG CB C 93 30.700 32.189 -1.489 2
1 934 . 1 1 A 93 93 ARG N N 93 120.700 122.042 -1.342 2
1 935 . 1 1 A 94 94 GLN H H 94 8.280 8.380 -0.101 2
1 936 . 1 1 A 94 94 GLN HA H 94 4.210 4.617 -0.407 2
1 941 . 1 1 A 94 94 GLN CA C 94 55.800 54.969 0.831 2
1 942 . 1 1 A 94 94 GLN CB C 94 29.300 30.134 -0.834 2
1 944 . 1 1 A 94 94 GLN N N 94 121.000 118.603 2.397 2
1 945 . 1 1 A 95 95 ASP H H 95 8.270 8.692 -0.422 2
1 946 . 1 1 A 95 95 ASP HA H 95 4.450 5.083 -0.633 2
1 949 . 1 1 A 95 95 ASP CA C 95 54.300 53.730 0.570 2
1 950 . 1 1 A 95 95 ASP CB C 95 41.000 43.272 -2.272 2
1 951 . 1 1 A 95 95 ASP N N 95 121.000 120.715 0.285 2
1 952 . 1 1 A 96 96 HIS H H 96 8.090 8.638 -0.548 2
1 953 . 1 1 A 96 96 HIS HA H 96 4.470 5.206 -0.736 2
1 956 . 1 1 A 96 96 HIS CA C 96 55.900 54.822 1.078 2
1 957 . 1 1 A 96 96 HIS CB C 96 30.500 32.688 -2.188 2
1 958 . 1 1 A 96 96 HIS N N 96 119.300 118.943 0.357 2
1 959 . 1 1 A 97 97 HIS H H 97 8.240 8.627 -0.387 2
1 960 . 1 1 A 97 97 HIS HA H 97 4.470 4.882 -0.412 2
1 963 . 1 1 A 97 97 HIS CA C 97 56.200 54.271 1.929 2
1 964 . 1 1 A 97 97 HIS CB C 97 30.400 31.015 -0.615 2
1 965 . 1 1 A 97 97 HIS N N 97 121.300 119.239 2.061 2
1 966 . 1 1 A 98 98 PRO HA H 98 4.340 4.476 -0.136 2
1 973 . 1 1 A 98 98 PRO CA C 98 63.700 62.692 1.008 2
1 974 . 1 1 A 98 98 PRO CB C 98 31.900 32.983 -1.083 2
1 977 . 1 1 A 99 99 GLY H H 99 8.660 8.272 0.388 2
1 978 . 1 1 A 99 99 GLY HA2 H 99 3.920 4.183 -0.263 2
1 979 . 1 1 A 99 99 GLY HA3 H 99 3.920 4.200 -0.280 2
1 980 . 1 1 A 99 99 GLY CA C 99 45.200 45.336 -0.136 2
1 981 . 1 1 A 99 99 GLY N N 99 110.000 108.184 1.816 2
1 982 . 1 1 A 100 100 SER H H 100 8.170 8.642 -0.472 2
1 983 . 1 1 A 100 100 SER HA H 100 4.360 4.871 -0.511 2
1 986 . 1 1 A 100 100 SER CA C 100 58.500 57.765 0.735 2
1 987 . 1 1 A 100 100 SER CB C 100 64.000 65.345 -1.345 2
1 988 . 1 1 A 100 100 SER N N 100 115.600 116.043 -0.443 2
1 989 . 1 1 A 101 101 GLY H H 101 8.420 8.408 0.012 2
1 990 . 1 1 A 101 101 GLY HA2 H 101 3.890 4.182 -0.292 2
1 991 . 1 1 A 101 101 GLY HA3 H 101 3.920 4.184 -0.264 2
1 992 . 1 1 A 101 101 GLY CA C 101 45.200 45.167 0.033 2
1 993 . 1 1 A 101 101 GLY N N 101 111.000 109.028 1.972 2
1 994 . 1 1 A 102 102 ALA H H 102 8.030 8.486 -0.456 2
1 995 . 1 1 A 102 102 ALA HA H 102 4.250 4.775 -0.525 2
1 999 . 1 1 A 102 102 ALA CA C 102 52.500 51.416 1.084 2
1 1000 . 1 1 A 102 102 ALA CB C 102 19.200 22.167 -2.967 2
stop_
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