data_16375_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16375
_Entry.PDB_ID 2KKY
_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 7 . 1 1 1 A 2 2 GLN H H 91 8.786 8.670 0.116 1
1 8 . 1 1 1 A 2 2 GLN HA H 91 4.005 3.855 0.150 1
1 15 . 1 1 1 A 2 2 GLN C C 91 177.270 177.204 0.066 1
1 16 . 1 1 1 A 2 2 GLN CA C 91 58.220 59.321 -1.101 1
1 17 . 1 1 1 A 2 2 GLN CB C 91 28.650 28.409 0.241 1
1 19 . 1 1 1 A 2 2 GLN N N 91 121.993 127.131 -5.138 1
1 21 . 1 1 1 A 3 3 GLU H H 92 8.430 8.304 0.126 1
1 22 . 1 1 1 A 3 3 GLU HA H 92 4.007 4.060 -0.053 1
1 27 . 1 1 1 A 3 3 GLU C C 92 178.287 178.970 -0.683 1
1 28 . 1 1 1 A 3 3 GLU CA C 92 59.490 59.327 0.163 1
1 29 . 1 1 1 A 3 3 GLU CB C 92 29.506 29.181 0.325 1
1 31 . 1 1 1 A 3 3 GLU N N 92 120.195 120.033 0.162 1
1 32 . 1 1 1 A 4 4 SER H H 93 8.209 8.140 0.069 1
1 33 . 1 1 1 A 4 4 SER HA H 93 4.272 4.243 0.029 1
1 36 . 1 1 1 A 4 4 SER C C 93 177.369 176.827 0.542 1
1 37 . 1 1 1 A 4 4 SER CA C 93 61.044 62.129 -1.085 1
1 38 . 1 1 1 A 4 4 SER CB C 93 62.950 63.068 -0.118 1
1 39 . 1 1 1 A 4 4 SER N N 93 115.524 116.695 -1.171 1
1 40 . 1 1 1 A 5 5 ILE H H 94 8.080 7.898 0.182 1
1 41 . 1 1 1 A 5 5 ILE HA H 94 3.530 3.645 -0.115 1
1 51 . 1 1 1 A 5 5 ILE C C 94 177.778 177.491 0.287 1
1 52 . 1 1 1 A 5 5 ILE CA C 94 65.710 65.330 0.380 1
1 53 . 1 1 1 A 5 5 ILE CB C 94 37.800 37.234 0.566 1
1 57 . 1 1 1 A 5 5 ILE N N 94 124.148 121.659 2.489 1
1 58 . 1 1 1 A 6 6 GLN H H 95 8.374 8.307 0.067 1
1 59 . 1 1 1 A 6 6 GLN HA H 95 4.125 3.963 0.162 1
1 66 . 1 1 1 A 6 6 GLN C C 95 179.726 179.368 0.358 1
1 67 . 1 1 1 A 6 6 GLN CA C 95 59.190 58.933 0.257 1
1 68 . 1 1 1 A 6 6 GLN CB C 95 27.060 28.453 -1.393 1
1 70 . 1 1 1 A 6 6 GLN N N 95 118.257 118.857 -0.600 1
1 72 . 1 1 1 A 7 7 ASN H H 96 8.456 8.182 0.274 1
1 73 . 1 1 1 A 7 7 ASN HA H 96 4.446 4.537 -0.091 1
1 78 . 1 1 1 A 7 7 ASN C C 96 177.257 177.703 -0.446 1
1 79 . 1 1 1 A 7 7 ASN CA C 96 56.020 56.195 -0.175 1
1 80 . 1 1 1 A 7 7 ASN CB C 96 38.126 37.771 0.355 1
1 81 . 1 1 1 A 7 7 ASN N N 96 118.597 118.446 0.151 1
1 83 . 1 1 1 A 8 8 LYS H H 97 7.732 7.891 -0.159 1
1 84 . 1 1 1 A 8 8 LYS HA H 97 4.129 4.056 0.073 1
1 93 . 1 1 1 A 8 8 LYS C C 97 179.143 179.340 -0.197 1
1 94 . 1 1 1 A 8 8 LYS CA C 97 59.126 59.926 -0.800 1
1 95 . 1 1 1 A 8 8 LYS CB C 97 32.070 32.464 -0.394 1
1 99 . 1 1 1 A 8 8 LYS N N 97 122.381 120.587 1.794 1
1 100 . 1 1 1 A 9 9 ILE H H 98 8.452 8.039 0.413 1
1 101 . 1 1 1 A 9 9 ILE HA H 98 3.480 3.895 -0.415 1
1 111 . 1 1 1 A 9 9 ILE C C 98 177.406 178.955 -1.549 1
1 112 . 1 1 1 A 9 9 ILE CA C 98 66.430 64.801 1.629 1
1 113 . 1 1 1 A 9 9 ILE CB C 98 37.980 37.023 0.957 1
1 117 . 1 1 1 A 9 9 ILE N N 98 119.950 120.245 -0.295 1
1 118 . 1 1 1 A 10 10 SER H H 99 7.924 7.904 0.020 1
1 119 . 1 1 1 A 10 10 SER HA H 99 3.983 4.295 -0.312 1
1 122 . 1 1 1 A 10 10 SER C C 99 176.327 176.256 0.071 1
1 123 . 1 1 1 A 10 10 SER CA C 99 61.990 61.068 0.922 1
1 124 . 1 1 1 A 10 10 SER CB C 99 62.790 63.460 -0.670 1
1 125 . 1 1 1 A 10 10 SER N N 99 113.568 117.297 -3.729 1
1 126 . 1 1 1 A 11 11 GLN H H 100 7.832 7.838 -0.006 1
1 127 . 1 1 1 A 11 11 GLN HA H 100 4.238 4.417 -0.179 1
1 134 . 1 1 1 A 11 11 GLN C C 100 178.088 178.074 0.014 1
1 135 . 1 1 1 A 11 11 GLN CA C 100 57.900 57.577 0.323 1
1 136 . 1 1 1 A 11 11 GLN CB C 100 29.790 29.856 -0.066 1
1 138 . 1 1 1 A 11 11 GLN N N 100 117.487 117.713 -0.226 1
1 140 . 1 1 1 A 12 12 CYS H H 101 7.920 8.299 -0.379 1
1 141 . 1 1 1 A 12 12 CYS HA H 101 4.657 4.525 0.132 1
1 144 . 1 1 1 A 12 12 CYS C C 101 175.439 174.859 0.580 1
1 145 . 1 1 1 A 12 12 CYS CA C 101 60.654 60.297 0.357 1
1 146 . 1 1 1 A 12 12 CYS CB C 101 29.310 27.472 1.838 1
1 147 . 1 1 1 A 12 12 CYS N N 101 114.221 117.520 -3.299 1
1 148 . 1 1 1 A 13 13 LYS H H 102 7.993 7.461 0.532 1
1 149 . 1 1 1 A 13 13 LYS HA H 102 5.038 4.514 0.524 1
1 158 . 1 1 1 A 13 13 LYS C C 102 174.757 176.202 -1.445 1
1 159 . 1 1 1 A 13 13 LYS CA C 102 56.660 56.072 0.588 1
1 160 . 1 1 1 A 13 13 LYS CB C 102 32.970 33.375 -0.405 1
1 164 . 1 1 1 A 13 13 LYS N N 102 123.841 119.507 4.334 1
1 165 . 1 1 1 A 14 14 PHE H H 103 8.822 8.485 0.337 1
1 166 . 1 1 1 A 14 14 PHE HA H 103 5.058 5.080 -0.022 1
1 174 . 1 1 1 A 14 14 PHE C C 103 173.560 173.052 0.508 1
1 175 . 1 1 1 A 14 14 PHE CA C 103 55.470 55.978 -0.508 1
1 176 . 1 1 1 A 14 14 PHE CB C 103 41.760 40.584 1.176 1
1 180 . 1 1 1 A 14 14 PHE N N 103 118.421 116.484 1.937 1
1 181 . 1 1 1 A 15 15 SER H H 104 8.826 8.804 0.022 1
1 182 . 1 1 1 A 15 15 SER HA H 104 4.602 4.693 -0.091 1
1 185 . 1 1 1 A 15 15 SER C C 104 173.851 173.577 0.274 1
1 186 . 1 1 1 A 15 15 SER CA C 104 58.610 58.891 -0.281 1
1 187 . 1 1 1 A 15 15 SER CB C 104 62.690 62.267 0.423 1
1 188 . 1 1 1 A 15 15 SER N N 104 117.781 116.802 0.979 1
1 189 . 1 1 1 A 16 16 VAL H H 105 7.839 8.142 -0.303 1
1 190 . 1 1 1 A 16 16 VAL HA H 105 3.390 4.413 -1.023 1
1 198 . 1 1 1 A 16 16 VAL C C 105 174.987 174.942 0.045 1
1 199 . 1 1 1 A 16 16 VAL CA C 105 63.650 62.334 1.316 1
1 200 . 1 1 1 A 16 16 VAL CB C 105 31.410 30.308 1.102 1
1 203 . 1 1 1 A 16 16 VAL N N 105 129.036 126.492 2.544 1
1 204 . 1 1 1 A 17 17 CYS H H 106 8.536 7.894 0.642 1
1 205 . 1 1 1 A 17 17 CYS HA H 106 5.011 4.938 0.073 1
1 208 . 1 1 1 A 17 17 CYS CA C 106 55.260 56.719 -1.459 1
1 209 . 1 1 1 A 17 17 CYS CB C 106 28.210 30.899 -2.689 1
1 210 . 1 1 1 A 17 17 CYS N N 106 130.045 127.341 2.704 1
1 211 . 1 1 1 A 18 18 PRO HA H 107 3.991 4.372 -0.381 1
1 218 . 1 1 1 A 18 18 PRO C C 107 178.188 177.906 0.282 1
1 219 . 1 1 1 A 18 18 PRO CA C 107 65.940 64.523 1.417 1
1 220 . 1 1 1 A 18 18 PRO CB C 107 32.000 32.061 -0.061 1
1 223 . 1 1 1 A 19 19 GLU H H 108 9.260 9.034 0.226 1
1 224 . 1 1 1 A 19 19 GLU HA H 108 4.119 4.076 0.043 1
1 229 . 1 1 1 A 19 19 GLU C C 108 178.721 179.265 -0.544 1
1 230 . 1 1 1 A 19 19 GLU CA C 108 59.300 59.736 -0.436 1
1 231 . 1 1 1 A 19 19 GLU CB C 108 28.920 28.828 0.092 1
1 233 . 1 1 1 A 19 19 GLU N N 108 118.270 116.095 2.175 1
1 234 . 1 1 1 A 20 20 ARG H H 109 7.672 7.800 -0.128 1
1 235 . 1 1 1 A 20 20 ARG HA H 109 4.331 4.185 0.146 1
1 242 . 1 1 1 A 20 20 ARG C C 109 177.977 178.130 -0.153 1
1 243 . 1 1 1 A 20 20 ARG CA C 109 57.350 59.028 -1.678 1
1 244 . 1 1 1 A 20 20 ARG CB C 109 30.820 30.709 0.111 1
1 247 . 1 1 1 A 20 20 ARG N N 109 118.357 119.275 -0.918 1
1 248 . 1 1 1 A 21 21 LEU H H 110 7.601 7.918 -0.317 1
1 249 . 1 1 1 A 21 21 LEU HA H 110 4.380 4.388 -0.008 1
1 259 . 1 1 1 A 21 21 LEU C C 110 176.562 176.173 0.389 1
1 260 . 1 1 1 A 21 21 LEU CA C 110 56.096 55.252 0.844 1
1 261 . 1 1 1 A 21 21 LEU CB C 110 44.016 42.466 1.550 1
1 265 . 1 1 1 A 21 21 LEU N N 110 118.626 118.228 0.398 1
1 266 . 1 1 1 A 22 22 GLN H H 111 7.750 7.605 0.145 1
1 267 . 1 1 1 A 22 22 GLN HA H 111 3.870 4.113 -0.243 1
1 274 . 1 1 1 A 22 22 GLN C C 111 173.336 174.129 -0.793 1
1 275 . 1 1 1 A 22 22 GLN CA C 111 56.510 57.314 -0.804 1
1 276 . 1 1 1 A 22 22 GLN CB C 111 26.800 26.548 0.252 1
1 278 . 1 1 1 A 22 22 GLN N N 111 113.926 115.874 -1.948 1
1 280 . 1 1 1 A 23 23 CYS H H 112 7.407 7.875 -0.468 1
1 281 . 1 1 1 A 23 23 CYS HA H 112 4.469 4.989 -0.520 1
1 284 . 1 1 1 A 23 23 CYS CA C 112 52.650 56.692 -4.042 1
1 285 . 1 1 1 A 23 23 CYS CB C 112 29.750 28.730 1.020 1
1 286 . 1 1 1 A 23 23 CYS N N 112 112.681 117.622 -4.941 1
1 287 . 1 1 1 A 24 24 PRO HA H 113 4.408 4.490 -0.082 1
1 294 . 1 1 1 A 24 24 PRO C C 113 178.175 177.669 0.506 1
1 295 . 1 1 1 A 24 24 PRO CA C 113 62.040 62.606 -0.566 1
1 296 . 1 1 1 A 24 24 PRO CB C 113 31.920 32.589 -0.669 1
1 299 . 1 1 1 A 25 25 LEU H H 114 8.593 8.846 -0.253 1
1 300 . 1 1 1 A 25 25 LEU HA H 114 3.765 4.066 -0.301 1
1 310 . 1 1 1 A 25 25 LEU C C 114 179.950 178.613 1.337 1
1 311 . 1 1 1 A 25 25 LEU CA C 114 57.674 58.061 -0.387 1
1 312 . 1 1 1 A 25 25 LEU CB C 114 40.690 41.438 -0.748 1
1 316 . 1 1 1 A 25 25 LEU N N 114 123.729 124.154 -0.425 1
1 317 . 1 1 1 A 26 26 GLU H H 115 9.108 8.399 0.709 1
1 318 . 1 1 1 A 26 26 GLU HA H 115 3.876 3.985 -0.109 1
1 323 . 1 1 1 A 26 26 GLU C C 115 177.505 179.227 -1.722 1
1 324 . 1 1 1 A 26 26 GLU CA C 115 59.410 59.601 -0.191 1
1 325 . 1 1 1 A 26 26 GLU CB C 115 28.460 29.282 -0.822 1
1 327 . 1 1 1 A 26 26 GLU N N 115 116.817 118.093 -1.276 1
1 328 . 1 1 1 A 27 27 ALA H H 116 7.360 7.812 -0.452 1
1 329 . 1 1 1 A 27 27 ALA HA H 116 4.408 3.914 0.494 1
1 333 . 1 1 1 A 27 27 ALA C C 116 177.046 178.369 -1.323 1
1 334 . 1 1 1 A 27 27 ALA CA C 116 52.970 54.702 -1.732 1
1 335 . 1 1 1 A 27 27 ALA CB C 116 19.916 18.041 1.875 1
1 336 . 1 1 1 A 27 27 ALA N N 116 118.966 121.762 -2.796 1
1 337 . 1 1 1 A 28 28 ILE H H 117 7.168 7.150 0.018 1
1 338 . 1 1 1 A 28 28 ILE HA H 117 4.432 4.727 -0.295 1
1 348 . 1 1 1 A 28 28 ILE C C 117 172.641 175.514 -2.873 1
1 349 . 1 1 1 A 28 28 ILE CA C 117 59.980 60.370 -0.390 1
1 350 . 1 1 1 A 28 28 ILE CB C 117 37.350 37.767 -0.417 1
1 354 . 1 1 1 A 28 28 ILE N N 117 108.913 109.319 -0.406 1
1 355 . 1 1 1 A 29 29 GLN H H 118 6.562 7.347 -0.785 1
1 356 . 1 1 1 A 29 29 GLN HA H 118 3.922 4.182 -0.260 1
1 363 . 1 1 1 A 29 29 GLN C C 118 175.049 175.692 -0.643 1
1 364 . 1 1 1 A 29 29 GLN CA C 118 54.596 56.073 -1.477 1
1 365 . 1 1 1 A 29 29 GLN CB C 118 29.570 29.055 0.515 1
1 367 . 1 1 1 A 29 29 GLN N N 118 116.455 123.275 -6.820 1
1 369 . 1 1 1 A 30 30 CYS H H 119 8.138 8.354 -0.216 1
1 370 . 1 1 1 A 30 30 CYS HA H 119 4.580 4.518 0.062 1
1 373 . 1 1 1 A 30 30 CYS CA C 119 57.810 57.541 0.269 1
1 374 . 1 1 1 A 30 30 CYS CB C 119 30.200 28.689 1.511 1
1 375 . 1 1 1 A 30 30 CYS N N 119 134.136 125.430 8.706 1
1 376 . 1 1 1 A 31 31 PRO HA H 120 4.424 4.369 0.055 1
1 383 . 1 1 1 A 31 31 PRO C C 120 177.431 178.716 -1.285 1
1 384 . 1 1 1 A 31 31 PRO CA C 120 64.060 64.751 -0.691 1
1 385 . 1 1 1 A 31 31 PRO CB C 120 32.776 32.256 0.520 1
1 388 . 1 1 1 A 32 32 ILE H H 121 11.318 7.167 4.151 1
1 389 . 1 1 1 A 32 32 ILE HA H 121 4.038 3.948 0.090 1
1 399 . 1 1 1 A 32 32 ILE C C 121 178.485 177.607 0.878 1
1 400 . 1 1 1 A 32 32 ILE CA C 121 64.060 64.216 -0.156 1
1 401 . 1 1 1 A 32 32 ILE CB C 121 39.340 38.358 0.982 1
1 405 . 1 1 1 A 32 32 ILE N N 121 124.500 116.653 7.847 1
1 406 . 1 1 1 A 33 33 THR H H 122 9.928 7.433 2.495 1
1 407 . 1 1 1 A 33 33 THR HA H 122 4.048 4.470 -0.422 1
1 412 . 1 1 1 A 33 33 THR C C 122 175.793 174.413 1.380 1
1 413 . 1 1 1 A 33 33 THR CA C 122 62.990 61.488 1.502 1
1 414 . 1 1 1 A 33 33 THR CB C 122 70.300 69.085 1.215 1
1 416 . 1 1 1 A 33 33 THR N N 122 115.136 108.793 6.343 1
1 417 . 1 1 1 A 34 34 LEU H H 123 8.439 7.766 0.673 1
1 418 . 1 1 1 A 34 34 LEU HA H 123 3.912 4.104 -0.192 1
1 428 . 1 1 1 A 34 34 LEU C C 123 175.495 175.509 -0.014 1
1 429 . 1 1 1 A 34 34 LEU CA C 123 56.290 55.946 0.344 1
1 430 . 1 1 1 A 34 34 LEU CB C 123 38.500 39.714 -1.214 1
1 434 . 1 1 1 A 34 34 LEU N N 123 117.230 121.130 -3.900 1
1 435 . 1 1 1 A 35 35 GLU H H 124 7.816 7.538 0.278 1
1 436 . 1 1 1 A 35 35 GLU HA H 124 4.634 4.749 -0.115 1
1 441 . 1 1 1 A 35 35 GLU C C 124 174.838 174.046 0.792 1
1 442 . 1 1 1 A 35 35 GLU CA C 124 53.780 54.690 -0.910 1
1 443 . 1 1 1 A 35 35 GLU CB C 124 33.710 32.343 1.367 1
1 445 . 1 1 1 A 35 35 GLU N N 124 116.577 116.444 0.133 1
1 446 . 1 1 1 A 36 36 GLN H H 125 8.532 8.561 -0.029 1
1 447 . 1 1 1 A 36 36 GLN HA H 125 4.958 4.398 0.560 1
1 454 . 1 1 1 A 36 36 GLN CA C 125 53.350 53.783 -0.433 1
1 455 . 1 1 1 A 36 36 GLN CB C 125 29.950 29.804 0.146 1
1 457 . 1 1 1 A 36 36 GLN N N 125 123.034 121.467 1.567 1
1 459 . 1 1 1 A 37 37 PRO HA H 126 4.458 4.403 0.055 1
1 466 . 1 1 1 A 37 37 PRO C C 126 176.314 177.346 -1.032 1
1 467 . 1 1 1 A 37 37 PRO CA C 126 62.816 65.585 -2.769 1
1 468 . 1 1 1 A 37 37 PRO CB C 126 33.070 31.570 1.500 1
1 471 . 1 1 1 A 38 38 GLU H H 127 8.626 7.721 0.905 1
1 472 . 1 1 1 A 38 38 GLU HA H 127 4.274 4.511 -0.237 1
1 477 . 1 1 1 A 38 38 GLU C C 127 177.809 174.977 2.832 1
1 478 . 1 1 1 A 38 38 GLU CA C 127 58.730 58.307 0.423 1
1 479 . 1 1 1 A 38 38 GLU CB C 127 30.340 29.457 0.883 1
1 481 . 1 1 1 A 38 38 GLU N N 127 120.691 119.300 1.391 1
1 482 . 1 1 1 A 39 39 LYS H H 128 7.891 7.888 0.003 1
1 483 . 1 1 1 A 39 39 LYS HA H 128 4.870 4.716 0.154 1
1 492 . 1 1 1 A 39 39 LYS C C 128 175.452 175.641 -0.189 1
1 493 . 1 1 1 A 39 39 LYS CA C 128 53.540 54.723 -1.183 1
1 494 . 1 1 1 A 39 39 LYS CB C 128 33.630 34.410 -0.780 1
1 498 . 1 1 1 A 39 39 LYS N N 128 118.149 118.026 0.123 1
1 499 . 1 1 1 A 40 40 GLY H H 129 8.524 8.115 0.409 1
1 500 . 1 1 1 A 40 40 GLY HA2 H 129 4.973 4.024 0.949 1
1 501 . 1 1 1 A 40 40 GLY HA3 H 129 2.459 4.137 -1.678 1
1 502 . 1 1 1 A 40 40 GLY C C 129 169.943 171.854 -1.911 1
1 503 . 1 1 1 A 40 40 GLY CA C 129 42.910 44.723 -1.813 1
1 504 . 1 1 1 A 40 40 GLY N N 129 112.845 110.632 2.213 1
1 505 . 1 1 1 A 41 41 ILE H H 130 8.659 8.057 0.602 1
1 506 . 1 1 1 A 41 41 ILE HA H 130 4.591 4.629 -0.038 1
1 516 . 1 1 1 A 41 41 ILE C C 130 172.586 173.976 -1.390 1
1 517 . 1 1 1 A 41 41 ILE CA C 130 58.090 59.072 -0.982 1
1 518 . 1 1 1 A 41 41 ILE CB C 130 43.320 41.887 1.433 1
1 522 . 1 1 1 A 41 41 ILE N N 130 114.060 119.451 -5.391 1
1 523 . 1 1 1 A 42 42 PHE H H 131 9.206 8.884 0.322 1
1 524 . 1 1 1 A 42 42 PHE HA H 131 5.159 4.728 0.431 1
1 532 . 1 1 1 A 42 42 PHE C C 131 174.931 175.794 -0.863 1
1 533 . 1 1 1 A 42 42 PHE CA C 131 57.790 58.065 -0.275 1
1 534 . 1 1 1 A 42 42 PHE CB C 131 42.220 39.018 3.202 1
1 538 . 1 1 1 A 42 42 PHE N N 131 126.002 128.431 -2.429 1
1 539 . 1 1 1 A 43 43 VAL H H 132 8.502 8.799 -0.297 1
1 540 . 1 1 1 A 43 43 VAL HA H 132 4.921 4.698 0.223 1
1 548 . 1 1 1 A 43 43 VAL C C 132 178.219 175.528 2.691 1
1 549 . 1 1 1 A 43 43 VAL CA C 132 59.600 60.103 -0.503 1
1 550 . 1 1 1 A 43 43 VAL CB C 132 35.920 35.562 0.358 1
1 553 . 1 1 1 A 43 43 VAL N N 132 119.068 123.234 -4.166 1
1 554 . 1 1 1 A 44 44 LYS H H 133 10.036 8.668 1.368 1
1 555 . 1 1 1 A 44 44 LYS HA H 133 5.070 4.330 0.740 1
1 564 . 1 1 1 A 44 44 LYS C C 133 177.276 177.871 -0.595 1
1 565 . 1 1 1 A 44 44 LYS CA C 133 56.720 57.055 -0.335 1
1 566 . 1 1 1 A 44 44 LYS CB C 133 34.410 33.007 1.403 1
1 570 . 1 1 1 A 44 44 LYS N N 133 130.934 125.352 5.582 1
1 571 . 1 1 1 A 45 45 ASN H H 134 8.093 8.815 -0.722 1
1 572 . 1 1 1 A 45 45 ASN HA H 134 4.152 4.613 -0.461 1
1 577 . 1 1 1 A 45 45 ASN C C 134 174.087 175.163 -1.076 1
1 578 . 1 1 1 A 45 45 ASN CA C 134 55.360 55.723 -0.363 1
1 579 . 1 1 1 A 45 45 ASN CB C 134 37.530 39.118 -1.588 1
1 580 . 1 1 1 A 45 45 ASN N N 134 117.963 121.433 -3.470 1
1 582 . 1 1 1 A 46 46 SER H H 135 7.524 7.848 -0.324 1
1 583 . 1 1 1 A 46 46 SER HA H 135 4.219 4.713 -0.494 1
1 586 . 1 1 1 A 46 46 SER C C 135 174.490 174.349 0.141 1
1 587 . 1 1 1 A 46 46 SER CA C 135 57.090 55.499 1.591 1
1 588 . 1 1 1 A 46 46 SER CB C 135 63.860 66.678 -2.818 1
1 589 . 1 1 1 A 46 46 SER N N 135 105.939 108.658 -2.719 1
1 590 . 1 1 1 A 47 47 ASP H H 136 9.113 9.094 0.019 1
1 591 . 1 1 1 A 47 47 ASP HA H 136 4.220 4.243 -0.023 1
1 594 . 1 1 1 A 47 47 ASP CA C 136 57.610 57.143 0.467 1
1 595 . 1 1 1 A 47 47 ASP CB C 136 40.810 40.661 0.149 1
1 596 . 1 1 1 A 47 47 ASP N N 136 120.995 123.217 -2.222 1
1 597 . 1 1 1 A 48 48 GLY H H 137 8.181 8.142 0.039 1
1 598 . 1 1 1 A 48 48 GLY HA2 H 137 4.120 3.878 0.242 1
1 599 . 1 1 1 A 48 48 GLY HA3 H 137 3.659 3.879 -0.220 1
1 600 . 1 1 1 A 48 48 GLY C C 137 174.062 173.467 0.595 1
1 601 . 1 1 1 A 48 48 GLY CA C 137 45.130 45.637 -0.507 1
1 602 . 1 1 1 A 48 48 GLY N N 137 106.197 106.546 -0.349 1
1 603 . 1 1 1 A 49 49 SER H H 138 7.179 7.734 -0.555 1
1 604 . 1 1 1 A 49 49 SER HA H 138 4.383 4.923 -0.540 1
1 607 . 1 1 1 A 49 49 SER C C 138 173.864 173.515 0.349 1
1 608 . 1 1 1 A 49 49 SER CA C 138 57.614 57.496 0.118 1
1 609 . 1 1 1 A 49 49 SER CB C 138 65.100 67.094 -1.994 1
1 610 . 1 1 1 A 49 49 SER N N 138 115.015 114.130 0.885 1
1 611 . 1 1 1 A 50 50 ASP H H 139 8.078 8.543 -0.465 1
1 612 . 1 1 1 A 50 50 ASP HA H 139 4.642 4.679 -0.037 1
1 615 . 1 1 1 A 50 50 ASP C C 139 174.261 175.804 -1.543 1
1 616 . 1 1 1 A 50 50 ASP CA C 139 52.406 55.232 -2.826 1
1 617 . 1 1 1 A 50 50 ASP CB C 139 40.254 41.452 -1.198 1
1 618 . 1 1 1 A 50 50 ASP N N 139 122.400 121.960 0.440 1
1 619 . 1 1 1 A 51 51 VAL H H 140 8.111 7.455 0.656 1
1 620 . 1 1 1 A 51 51 VAL HA H 140 4.360 4.056 0.304 1
1 628 . 1 1 1 A 51 51 VAL C C 140 176.147 174.501 1.646 1
1 629 . 1 1 1 A 51 51 VAL CA C 140 62.670 62.290 0.380 1
1 630 . 1 1 1 A 51 51 VAL CB C 140 33.930 31.683 2.247 1
1 632 . 1 1 1 A 51 51 VAL N N 140 120.374 120.755 -0.381 1
1 633 . 1 1 1 A 52 52 CYS H H 141 8.358 8.838 -0.480 1
1 634 . 1 1 1 A 52 52 CYS HA H 141 4.957 5.515 -0.558 1
1 637 . 1 1 1 A 52 52 CYS C C 141 173.070 172.910 0.160 1
1 638 . 1 1 1 A 52 52 CYS CA C 141 53.380 54.496 -1.116 1
1 639 . 1 1 1 A 52 52 CYS CB C 141 46.110 46.043 0.067 1
1 640 . 1 1 1 A 52 52 CYS N N 141 121.305 128.868 -7.563 1
1 641 . 1 1 1 A 53 53 THR H H 142 8.929 8.946 -0.017 1
1 642 . 1 1 1 A 53 53 THR HA H 142 4.498 5.181 -0.683 1
1 648 . 1 1 1 A 53 53 THR C C 142 172.151 172.487 -0.336 1
1 649 . 1 1 1 A 53 53 THR CA C 142 62.960 61.213 1.747 1
1 650 . 1 1 1 A 53 53 THR CB C 142 70.540 72.064 -1.524 1
1 652 . 1 1 1 A 53 53 THR N N 142 120.105 120.007 0.098 1
1 653 . 1 1 1 A 54 54 LEU H H 143 8.448 8.887 -0.439 1
1 654 . 1 1 1 A 54 54 LEU HA H 143 4.322 4.767 -0.445 1
1 664 . 1 1 1 A 54 54 LEU C C 143 174.484 174.378 0.106 1
1 665 . 1 1 1 A 54 54 LEU CA C 143 54.596 53.415 1.181 1
1 666 . 1 1 1 A 54 54 LEU CB C 143 42.396 43.656 -1.260 1
1 670 . 1 1 1 A 54 54 LEU N N 143 128.819 128.752 0.067 1
1 671 . 1 1 1 A 55 55 PHE H H 144 8.661 8.687 -0.026 1
1 672 . 1 1 1 A 55 55 PHE HA H 144 5.459 4.998 0.461 1
1 680 . 1 1 1 A 55 55 PHE C C 144 176.035 174.896 1.139 1
1 681 . 1 1 1 A 55 55 PHE CA C 144 55.020 56.625 -1.605 1
1 682 . 1 1 1 A 55 55 PHE CB C 144 44.100 42.662 1.438 1
1 686 . 1 1 1 A 55 55 PHE N N 144 121.897 126.027 -4.130 1
1 687 . 1 1 1 A 56 56 ASP H H 145 11.616 8.557 3.059 1
1 688 . 1 1 1 A 56 56 ASP HA H 145 4.417 4.679 -0.262 1
1 691 . 1 1 1 A 56 56 ASP C C 145 176.748 177.337 -0.589 1
1 692 . 1 1 1 A 56 56 ASP CA C 145 55.844 54.324 1.520 1
1 693 . 1 1 1 A 56 56 ASP CB C 145 44.390 43.220 1.170 1
1 694 . 1 1 1 A 56 56 ASP N N 145 122.131 121.895 0.236 1
1 695 . 1 1 1 A 57 57 ALA H H 146 8.508 8.819 -0.311 1
1 696 . 1 1 1 A 57 57 ALA HA H 146 3.797 4.066 -0.269 1
1 700 . 1 1 1 A 57 57 ALA C C 146 178.696 180.066 -1.370 1
1 701 . 1 1 1 A 57 57 ALA CA C 146 55.990 55.334 0.656 1
1 702 . 1 1 1 A 57 57 ALA CB C 146 18.840 18.131 0.709 1
1 703 . 1 1 1 A 57 57 ALA N N 146 130.243 128.604 1.639 1
1 704 . 1 1 1 A 58 58 ALA H H 147 8.378 8.071 0.307 1
1 705 . 1 1 1 A 58 58 ALA HA H 147 4.078 4.204 -0.126 1
1 709 . 1 1 1 A 58 58 ALA C C 147 181.091 179.430 1.661 1
1 710 . 1 1 1 A 58 58 ALA CA C 147 54.770 54.929 -0.159 1
1 711 . 1 1 1 A 58 58 ALA CB C 147 17.700 18.497 -0.797 1
1 712 . 1 1 1 A 58 58 ALA N N 147 121.997 119.785 2.212 1
1 713 . 1 1 1 A 59 59 ALA H H 148 9.138 8.010 1.128 1
1 714 . 1 1 1 A 59 59 ALA HA H 148 3.975 4.057 -0.082 1
1 718 . 1 1 1 A 59 59 ALA C C 148 180.508 179.965 0.543 1
1 719 . 1 1 1 A 59 59 ALA CA C 148 54.840 55.108 -0.268 1
1 720 . 1 1 1 A 59 59 ALA CB C 148 18.600 18.547 0.053 1
1 721 . 1 1 1 A 59 59 ALA N N 148 123.595 120.577 3.018 1
1 722 . 1 1 1 A 60 60 PHE H H 149 8.814 8.042 0.772 1
1 723 . 1 1 1 A 60 60 PHE HA H 149 3.722 3.987 -0.265 1
1 731 . 1 1 1 A 60 60 PHE C C 149 176.773 177.528 -0.755 1
1 732 . 1 1 1 A 60 60 PHE CA C 149 62.030 61.487 0.543 1
1 733 . 1 1 1 A 60 60 PHE CB C 149 39.960 38.955 1.005 1
1 737 . 1 1 1 A 60 60 PHE N N 149 120.354 119.861 0.493 1
1 738 . 1 1 1 A 61 61 SER H H 150 8.276 8.290 -0.014 1
1 739 . 1 1 1 A 61 61 SER HA H 150 3.880 3.978 -0.098 1
1 742 . 1 1 1 A 61 61 SER C C 150 177.691 176.419 1.272 1
1 743 . 1 1 1 A 61 61 SER CA C 150 62.190 61.607 0.583 1
1 744 . 1 1 1 A 61 61 SER CB C 150 63.016 62.905 0.111 1
1 745 . 1 1 1 A 61 61 SER N N 150 112.086 114.148 -2.062 1
1 746 . 1 1 1 A 62 62 ARG H H 151 7.829 7.909 -0.080 1
1 747 . 1 1 1 A 62 62 ARG HA H 151 3.971 4.017 -0.046 1
1 754 . 1 1 1 A 62 62 ARG C C 151 178.287 178.406 -0.119 1
1 755 . 1 1 1 A 62 62 ARG CA C 151 59.340 58.747 0.593 1
1 756 . 1 1 1 A 62 62 ARG CB C 151 29.760 29.714 0.046 1
1 759 . 1 1 1 A 62 62 ARG N N 151 121.090 119.346 1.744 1
1 760 . 1 1 1 A 63 63 LEU H H 152 7.390 7.479 -0.089 1
1 761 . 1 1 1 A 63 63 LEU HA H 152 3.791 3.944 -0.153 1
1 771 . 1 1 1 A 63 63 LEU C C 152 179.106 178.129 0.977 1
1 772 . 1 1 1 A 63 63 LEU CA C 152 58.900 58.182 0.718 1
1 773 . 1 1 1 A 63 63 LEU CB C 152 41.140 41.142 -0.002 1
1 777 . 1 1 1 A 63 63 LEU N N 152 121.129 122.050 -0.921 1
1 778 . 1 1 1 A 64 64 VAL H H 153 7.552 7.893 -0.341 1
1 779 . 1 1 1 A 64 64 VAL HA H 153 3.411 3.443 -0.032 1
1 787 . 1 1 1 A 64 64 VAL C C 153 180.595 178.317 2.278 1
1 788 . 1 1 1 A 64 64 VAL CA C 153 65.644 66.065 -0.421 1
1 789 . 1 1 1 A 64 64 VAL CB C 153 31.410 31.356 0.054 1
1 792 . 1 1 1 A 64 64 VAL N N 153 118.280 118.894 -0.614 1
1 793 . 1 1 1 A 65 65 GLY H H 154 8.061 8.187 -0.126 1
1 794 . 1 1 1 A 65 65 GLY HA2 H 154 3.846 3.718 0.128 1
1 795 . 1 1 1 A 65 65 GLY HA3 H 154 3.809 3.719 0.090 1
1 796 . 1 1 1 A 65 65 GLY C C 154 175.235 176.065 -0.830 1
1 797 . 1 1 1 A 65 65 GLY CA C 154 46.630 47.088 -0.458 1
1 798 . 1 1 1 A 65 65 GLY N N 154 108.622 107.783 0.839 1
1 799 . 1 1 1 A 66 66 GLU H H 155 7.528 7.576 -0.048 1
1 800 . 1 1 1 A 66 66 GLU HA H 155 4.228 4.317 -0.089 1
1 805 . 1 1 1 A 66 66 GLU C C 155 176.761 176.942 -0.181 1
1 806 . 1 1 1 A 66 66 GLU CA C 155 56.590 56.261 0.329 1
1 807 . 1 1 1 A 66 66 GLU CB C 155 30.490 30.064 0.426 1
1 809 . 1 1 1 A 66 66 GLU N N 155 118.361 119.367 -1.006 1
1 810 . 1 1 1 A 67 67 GLY H H 156 7.884 7.804 0.080 1
1 811 . 1 1 1 A 67 67 GLY HA2 H 156 3.918 3.890 0.028 1
1 812 . 1 1 1 A 67 67 GLY HA3 H 156 3.747 3.904 -0.157 1
1 813 . 1 1 1 A 67 67 GLY C C 156 174.788 174.735 0.053 1
1 814 . 1 1 1 A 67 67 GLY CA C 156 45.890 46.371 -0.481 1
1 815 . 1 1 1 A 67 67 GLY N N 156 108.465 109.644 -1.179 1
1 816 . 1 1 1 A 68 68 LEU H H 157 7.332 7.684 -0.352 1
1 817 . 1 1 1 A 68 68 LEU HA H 157 4.361 4.565 -0.204 1
1 827 . 1 1 1 A 68 68 LEU CA C 157 53.060 52.498 0.562 1
1 828 . 1 1 1 A 68 68 LEU CB C 157 41.100 41.340 -0.240 1
1 832 . 1 1 1 A 68 68 LEU N N 157 121.920 121.578 0.342 1
1 833 . 1 1 1 A 69 69 PRO HA H 158 4.485 4.567 -0.082 1
1 840 . 1 1 1 A 69 69 PRO C C 158 174.602 176.239 -1.637 1
1 841 . 1 1 1 A 69 69 PRO CA C 158 61.556 62.307 -0.751 1
1 842 . 1 1 1 A 69 69 PRO CB C 158 32.370 32.461 -0.091 1
1 845 . 1 1 1 A 70 70 HIS H H 159 8.734 8.676 0.058 1
1 846 . 1 1 1 A 70 70 HIS HA H 159 3.947 4.526 -0.579 1
1 852 . 1 1 1 A 70 70 HIS CA C 159 56.250 55.241 1.009 1
1 853 . 1 1 1 A 70 70 HIS CB C 159 32.280 31.011 1.269 1
1 856 . 1 1 1 A 70 70 HIS N N 159 119.423 120.857 -1.434 1
1 857 . 1 1 1 A 71 71 PRO HA H 160 4.424 4.159 0.265 1
1 864 . 1 1 1 A 71 71 PRO C C 160 177.567 178.768 -1.201 1
1 865 . 1 1 1 A 71 71 PRO CA C 160 64.574 65.876 -1.302 1
1 866 . 1 1 1 A 71 71 PRO CB C 160 32.340 31.684 0.656 1
1 869 . 1 1 1 A 72 72 LEU H H 161 10.123 7.410 2.713 1
1 870 . 1 1 1 A 72 72 LEU HA H 161 4.778 4.279 0.499 1
1 880 . 1 1 1 A 72 72 LEU C C 161 178.721 177.847 0.874 1
1 881 . 1 1 1 A 72 72 LEU CA C 161 55.800 57.618 -1.818 1
1 882 . 1 1 1 A 72 72 LEU CB C 161 42.440 42.982 -0.542 1
1 886 . 1 1 1 A 72 72 LEU N N 161 117.374 117.524 -0.150 1
1 887 . 1 1 1 A 73 73 THR H H 162 7.523 7.837 -0.314 1
1 888 . 1 1 1 A 73 73 THR HA H 162 4.291 4.594 -0.303 1
1 893 . 1 1 1 A 73 73 THR C C 162 175.557 174.442 1.115 1
1 894 . 1 1 1 A 73 73 THR CA C 162 61.440 62.257 -0.817 1
1 895 . 1 1 1 A 73 73 THR CB C 162 70.500 70.121 0.379 1
1 897 . 1 1 1 A 73 73 THR N N 162 107.787 112.128 -4.341 1
1 898 . 1 1 1 A 74 74 ARG H H 163 8.361 7.937 0.424 1
1 899 . 1 1 1 A 74 74 ARG HA H 163 3.836 4.290 -0.454 1
1 906 . 1 1 1 A 74 74 ARG C C 163 174.701 175.137 -0.436 1
1 907 . 1 1 1 A 74 74 ARG CA C 163 57.980 57.606 0.374 1
1 908 . 1 1 1 A 74 74 ARG CB C 163 26.770 27.083 -0.313 1
1 911 . 1 1 1 A 74 74 ARG N N 163 115.130 118.780 -3.650 1
1 912 . 1 1 1 A 75 75 GLU H H 164 7.430 8.068 -0.638 1
1 913 . 1 1 1 A 75 75 GLU HA H 164 4.636 4.531 0.105 1
1 918 . 1 1 1 A 75 75 GLU CA C 164 53.699 55.008 -1.309 1
1 919 . 1 1 1 A 75 75 GLU CB C 164 29.550 28.264 1.286 1
1 921 . 1 1 1 A 75 75 GLU N N 164 120.076 119.011 1.065 1
1 922 . 1 1 1 A 76 76 PRO HA H 165 4.272 4.517 -0.245 1
1 929 . 1 1 1 A 76 76 PRO C C 165 176.649 176.963 -0.314 1
1 930 . 1 1 1 A 76 76 PRO CA C 165 63.204 63.123 0.081 1
1 931 . 1 1 1 A 76 76 PRO CB C 165 31.680 31.697 -0.017 1
1 934 . 1 1 1 A 77 77 ILE H H 166 8.812 8.245 0.567 1
1 935 . 1 1 1 A 77 77 ILE HA H 166 3.838 4.348 -0.510 1
1 945 . 1 1 1 A 77 77 ILE C C 166 175.235 175.779 -0.544 1
1 946 . 1 1 1 A 77 77 ILE CA C 166 62.816 61.082 1.734 1
1 947 . 1 1 1 A 77 77 ILE CB C 166 37.750 37.509 0.241 1
1 951 . 1 1 1 A 77 77 ILE N N 166 123.831 124.143 -0.312 1
1 952 . 1 1 1 A 78 78 THR H H 167 6.625 8.633 -2.008 1
1 953 . 1 1 1 A 78 78 THR HA H 167 4.632 4.939 -0.307 1
1 958 . 1 1 1 A 78 78 THR C C 167 174.143 174.289 -0.146 1
1 959 . 1 1 1 A 78 78 THR CA C 167 58.750 59.878 -1.128 1
1 960 . 1 1 1 A 78 78 THR CB C 167 71.320 71.059 0.261 1
1 962 . 1 1 1 A 78 78 THR N N 167 115.293 117.887 -2.594 1
1 963 . 1 1 1 A 79 79 ALA H H 168 9.088 8.927 0.161 1
1 964 . 1 1 1 A 79 79 ALA HA H 168 3.916 4.188 -0.272 1
1 968 . 1 1 1 A 79 79 ALA C C 168 179.770 179.443 0.327 1
1 969 . 1 1 1 A 79 79 ALA CA C 168 55.480 54.804 0.676 1
1 970 . 1 1 1 A 79 79 ALA CB C 168 17.630 18.272 -0.642 1
1 971 . 1 1 1 A 79 79 ALA N N 168 122.102 127.086 -4.984 1
1 972 . 1 1 1 A 80 80 SER H H 169 7.988 7.750 0.238 1
1 973 . 1 1 1 A 80 80 SER HA H 169 4.091 4.247 -0.156 1
1 976 . 1 1 1 A 80 80 SER C C 169 175.836 176.583 -0.747 1
1 977 . 1 1 1 A 80 80 SER CA C 169 60.750 61.285 -0.535 1
1 978 . 1 1 1 A 80 80 SER CB C 169 62.510 63.238 -0.728 1
1 979 . 1 1 1 A 80 80 SER N N 169 109.660 113.450 -3.790 1
1 980 . 1 1 1 A 81 81 ILE H H 170 7.052 7.686 -0.634 1
1 981 . 1 1 1 A 81 81 ILE HA H 170 4.344 4.087 0.257 1
1 991 . 1 1 1 A 81 81 ILE C C 170 174.236 176.534 -2.298 1
1 992 . 1 1 1 A 81 81 ILE CA C 170 61.760 64.007 -2.247 1
1 993 . 1 1 1 A 81 81 ILE CB C 170 37.950 37.616 0.334 1
1 997 . 1 1 1 A 81 81 ILE N N 170 112.623 114.047 -1.424 1
1 998 . 1 1 1 A 82 82 ILE H H 171 7.345 7.586 -0.241 1
1 999 . 1 1 1 A 82 82 ILE HA H 171 4.288 4.061 0.227 1
1 1009 . 1 1 1 A 82 82 ILE C C 171 174.931 175.387 -0.456 1
1 1010 . 1 1 1 A 82 82 ILE CA C 171 61.420 61.747 -0.327 1
1 1011 . 1 1 1 A 82 82 ILE CB C 171 37.230 37.768 -0.538 1
1 1015 . 1 1 1 A 82 82 ILE N N 171 124.260 124.629 -0.369 1
1 1016 . 1 1 1 A 83 83 VAL H H 172 7.843 8.683 -0.840 1
1 1017 . 1 1 1 A 83 83 VAL HA H 172 4.818 5.007 -0.189 1
1 1025 . 1 1 1 A 83 83 VAL C C 172 174.918 175.501 -0.583 1
1 1026 . 1 1 1 A 83 83 VAL CA C 172 58.910 59.066 -0.156 1
1 1027 . 1 1 1 A 83 83 VAL CB C 172 34.570 35.187 -0.617 1
1 1030 . 1 1 1 A 83 83 VAL N N 172 118.856 121.600 -2.744 1
1 1031 . 1 1 1 A 84 84 LYS H H 173 8.347 8.719 -0.372 1
1 1032 . 1 1 1 A 84 84 LYS HA H 173 4.356 4.530 -0.174 1
1 1041 . 1 1 1 A 84 84 LYS C C 173 178.653 178.365 0.288 1
1 1042 . 1 1 1 A 84 84 LYS CA C 173 56.360 55.700 0.660 1
1 1043 . 1 1 1 A 84 84 LYS CB C 173 33.366 33.380 -0.014 1
1 1047 . 1 1 1 A 84 84 LYS N N 173 119.602 121.564 -1.962 1
1 1048 . 1 1 1 A 85 85 HIS H H 174 9.143 9.007 0.136 1
1 1049 . 1 1 1 A 85 85 HIS HA H 174 4.013 4.334 -0.321 1
1 1053 . 1 1 1 A 85 85 HIS C C 174 176.606 176.967 -0.361 1
1 1054 . 1 1 1 A 85 85 HIS CA C 174 58.820 60.440 -1.620 1
1 1055 . 1 1 1 A 85 85 HIS CB C 174 28.186 29.758 -1.572 1
1 1057 . 1 1 1 A 85 85 HIS N N 174 120.022 122.589 -2.567 1
1 1058 . 1 1 1 A 86 86 GLU H H 175 8.403 8.236 0.167 1
1 1059 . 1 1 1 A 86 86 GLU HA H 175 3.863 3.691 0.172 1
1 1064 . 1 1 1 A 86 86 GLU C C 175 177.040 179.003 -1.963 1
1 1065 . 1 1 1 A 86 86 GLU CA C 175 57.830 59.988 -2.158 1
1 1066 . 1 1 1 A 86 86 GLU CB C 175 28.690 29.377 -0.687 1
1 1068 . 1 1 1 A 86 86 GLU N N 175 116.124 118.297 -2.173 1
1 1069 . 1 1 1 A 87 87 GLU H H 176 7.669 8.029 -0.360 1
1 1070 . 1 1 1 A 87 87 GLU HA H 176 4.039 3.927 0.112 1
1 1075 . 1 1 1 A 87 87 GLU C C 176 175.688 177.158 -1.470 1
1 1076 . 1 1 1 A 87 87 GLU CA C 176 57.906 59.375 -1.469 1
1 1077 . 1 1 1 A 87 87 GLU CB C 176 30.430 29.141 1.289 1
1 1079 . 1 1 1 A 87 87 GLU N N 176 116.183 119.464 -3.281 1
1 1080 . 1 1 1 A 88 88 CYS H H 177 6.750 7.201 -0.451 1
1 1081 . 1 1 1 A 88 88 CYS HA H 177 4.991 4.680 0.311 1
1 1084 . 1 1 1 A 88 88 CYS C C 177 172.325 173.360 -1.035 1
1 1085 . 1 1 1 A 88 88 CYS CA C 177 55.030 54.089 0.941 1
1 1086 . 1 1 1 A 88 88 CYS CB C 177 45.610 41.918 3.692 1
1 1087 . 1 1 1 A 88 88 CYS N N 177 114.838 116.521 -1.683 1
1 1088 . 1 1 1 A 89 89 ILE H H 178 9.128 8.849 0.279 1
1 1089 . 1 1 1 A 89 89 ILE HA H 178 4.536 4.884 -0.348 1
1 1099 . 1 1 1 A 89 89 ILE C C 178 174.893 174.433 0.460 1
1 1100 . 1 1 1 A 89 89 ILE CA C 178 59.160 59.408 -0.248 1
1 1101 . 1 1 1 A 89 89 ILE CB C 178 41.840 40.668 1.172 1
1 1105 . 1 1 1 A 89 89 ILE N N 178 120.564 121.018 -0.454 1
1 1106 . 1 1 1 A 90 90 TYR H H 179 9.349 9.129 0.220 1
1 1107 . 1 1 1 A 90 90 TYR HA H 179 3.568 4.226 -0.658 1
1 1112 . 1 1 1 A 90 90 TYR C C 179 173.950 174.001 -0.051 1
1 1113 . 1 1 1 A 90 90 TYR CA C 179 61.180 58.025 3.155 1
1 1114 . 1 1 1 A 90 90 TYR CB C 179 37.530 38.434 -0.904 1
1 1116 . 1 1 1 A 90 90 TYR N N 179 129.033 126.952 2.081 1
1 1117 . 1 1 1 A 91 91 ASP H H 180 7.367 8.238 -0.871 1
1 1118 . 1 1 1 A 91 91 ASP HA H 180 4.662 4.535 0.127 1
1 1121 . 1 1 1 A 91 91 ASP C C 180 175.291 175.399 -0.108 1
1 1122 . 1 1 1 A 91 91 ASP CA C 180 52.230 52.307 -0.077 1
1 1123 . 1 1 1 A 91 91 ASP CB C 180 43.650 41.432 2.218 1
1 1124 . 1 1 1 A 91 91 ASP N N 180 129.305 128.673 0.632 1
1 1125 . 1 1 1 A 92 92 ASP H H 181 8.783 8.539 0.244 1
1 1126 . 1 1 1 A 92 92 ASP HA H 181 4.114 3.623 0.491 1
1 1129 . 1 1 1 A 92 92 ASP C C 181 177.573 177.594 -0.021 1
1 1130 . 1 1 1 A 92 92 ASP CA C 181 56.390 56.693 -0.303 1
1 1131 . 1 1 1 A 92 92 ASP CB C 181 41.330 40.247 1.083 1
1 1132 . 1 1 1 A 92 92 ASP N N 181 125.665 127.620 -1.955 1
1 1133 . 1 1 1 A 93 93 THR H H 182 8.284 7.880 0.404 1
1 1134 . 1 1 1 A 93 93 THR HA H 182 4.037 3.843 0.194 1
1 1139 . 1 1 1 A 93 93 THR C C 182 176.333 176.163 0.170 1
1 1140 . 1 1 1 A 93 93 THR CA C 182 65.320 66.922 -1.602 1
1 1141 . 1 1 1 A 93 93 THR CB C 182 68.560 68.261 0.299 1
1 1143 . 1 1 1 A 93 93 THR N N 182 114.688 116.331 -1.643 1
1 1144 . 1 1 1 A 94 94 ARG H H 183 7.784 7.355 0.429 1
1 1145 . 1 1 1 A 94 94 ARG HA H 183 4.142 4.224 -0.082 1
1 1152 . 1 1 1 A 94 94 ARG C C 183 177.015 176.982 0.033 1
1 1153 . 1 1 1 A 94 94 ARG CA C 183 55.350 56.236 -0.886 1
1 1154 . 1 1 1 A 94 94 ARG CB C 183 30.930 30.807 0.123 1
1 1157 . 1 1 1 A 94 94 ARG N N 183 120.156 118.397 1.759 1
1 1158 . 1 1 1 A 95 95 GLY H H 184 8.144 8.853 -0.709 1
1 1159 . 1 1 1 A 95 95 GLY HA2 H 184 3.839 3.858 -0.019 1
1 1160 . 1 1 1 A 95 95 GLY HA3 H 184 3.681 3.868 -0.187 1
1 1161 . 1 1 1 A 95 95 GLY C C 184 173.653 173.349 0.304 1
1 1162 . 1 1 1 A 95 95 GLY CA C 184 46.160 45.924 0.236 1
1 1163 . 1 1 1 A 95 95 GLY N N 184 107.879 108.912 -1.033 1
1 1164 . 1 1 1 A 96 96 ASN H H 185 6.855 7.267 -0.412 1
1 1165 . 1 1 1 A 96 96 ASN HA H 185 4.909 5.059 -0.150 1
1 1170 . 1 1 1 A 96 96 ASN C C 185 174.223 173.278 0.945 1
1 1171 . 1 1 1 A 96 96 ASN CA C 185 52.720 52.126 0.594 1
1 1172 . 1 1 1 A 96 96 ASN CB C 185 45.620 41.846 3.774 1
1 1173 . 1 1 1 A 96 96 ASN N N 185 113.382 116.913 -3.531 1
1 1175 . 1 1 1 A 97 97 PHE H H 186 9.228 8.176 1.052 1
1 1176 . 1 1 1 A 97 97 PHE HA H 186 4.579 4.870 -0.291 1
1 1183 . 1 1 1 A 97 97 PHE C C 186 174.794 175.330 -0.536 1
1 1184 . 1 1 1 A 97 97 PHE CA C 186 59.384 58.322 1.062 1
1 1185 . 1 1 1 A 97 97 PHE CB C 186 40.450 39.382 1.068 1
1 1188 . 1 1 1 A 97 97 PHE N N 186 118.661 119.674 -1.013 1
1 1189 . 1 1 1 A 98 98 ILE H H 187 8.908 9.068 -0.160 1
1 1190 . 1 1 1 A 98 98 ILE HA H 187 5.440 4.821 0.619 1
1 1200 . 1 1 1 A 98 98 ILE C C 187 176.171 174.974 1.197 1
1 1201 . 1 1 1 A 98 98 ILE CA C 187 57.610 60.011 -2.401 1
1 1202 . 1 1 1 A 98 98 ILE CB C 187 41.280 40.122 1.158 1
1 1206 . 1 1 1 A 98 98 ILE N N 187 120.585 123.459 -2.874 1
1 1207 . 1 1 1 A 99 99 ILE H H 188 8.602 8.336 0.266 1
1 1208 . 1 1 1 A 99 99 ILE HA H 188 4.546 4.926 -0.380 1
1 1218 . 1 1 1 A 99 99 ILE C C 188 176.668 174.981 1.687 1
1 1219 . 1 1 1 A 99 99 ILE CA C 188 58.920 60.244 -1.324 1
1 1220 . 1 1 1 A 99 99 ILE CB C 188 37.960 39.392 -1.432 1
1 1224 . 1 1 1 A 99 99 ILE N N 188 124.500 125.098 -0.598 1
1 1225 . 1 1 1 A 100 100 LYS H H 189 8.449 8.413 0.036 1
1 1226 . 1 1 1 A 100 100 LYS HA H 189 4.108 4.617 -0.509 1
1 1235 . 1 1 1 A 100 100 LYS C C 189 176.866 176.035 0.831 1
1 1236 . 1 1 1 A 100 100 LYS CA C 189 56.800 55.056 1.744 1
1 1237 . 1 1 1 A 100 100 LYS CB C 189 33.400 33.774 -0.374 1
1 1241 . 1 1 1 A 100 100 LYS N N 189 128.581 126.150 2.431 1
1 1242 . 1 1 1 A 101 101 GLY H H 190 8.381 8.149 0.232 1
1 1243 . 1 1 1 A 101 101 GLY HA2 H 190 3.946 4.010 -0.064 1
1 1244 . 1 1 1 A 101 101 GLY HA3 H 190 3.828 4.012 -0.184 1
1 1245 . 1 1 1 A 101 101 GLY C C 190 172.902 174.574 -1.672 1
1 1246 . 1 1 1 A 101 101 GLY CA C 190 44.920 45.452 -0.532 1
1 1247 . 1 1 1 A 101 101 GLY N N 190 111.183 111.919 -0.736 1
1 7 . 2 1 1 A 2 2 GLN H H 91 8.786 8.821 -0.035 1
1 8 . 2 1 1 A 2 2 GLN HA H 91 4.005 3.954 0.051 1
1 15 . 2 1 1 A 2 2 GLN C C 91 177.270 177.125 0.145 1
1 16 . 2 1 1 A 2 2 GLN CA C 91 58.220 59.265 -1.045 1
1 17 . 2 1 1 A 2 2 GLN CB C 91 28.650 28.420 0.230 1
1 19 . 2 1 1 A 2 2 GLN N N 91 121.993 123.272 -1.279 1
1 21 . 2 1 1 A 3 3 GLU H H 92 8.430 8.198 0.232 1
1 22 . 2 1 1 A 3 3 GLU HA H 92 4.007 4.102 -0.095 1
1 27 . 2 1 1 A 3 3 GLU C C 92 178.287 179.341 -1.054 1
1 28 . 2 1 1 A 3 3 GLU CA C 92 59.490 59.064 0.426 1
1 29 . 2 1 1 A 3 3 GLU CB C 92 29.506 29.184 0.322 1
1 31 . 2 1 1 A 3 3 GLU N N 92 120.195 119.753 0.442 1
1 32 . 2 1 1 A 4 4 SER H H 93 8.209 8.086 0.123 1
1 33 . 2 1 1 A 4 4 SER HA H 93 4.272 4.172 0.100 1
1 36 . 2 1 1 A 4 4 SER C C 93 177.369 176.826 0.543 1
1 37 . 2 1 1 A 4 4 SER CA C 93 61.044 62.440 -1.396 1
1 38 . 2 1 1 A 4 4 SER CB C 93 62.950 62.948 0.002 1
1 39 . 2 1 1 A 4 4 SER N N 93 115.524 117.038 -1.514 1
1 40 . 2 1 1 A 5 5 ILE H H 94 8.080 7.584 0.496 1
1 41 . 2 1 1 A 5 5 ILE HA H 94 3.530 3.620 -0.090 1
1 51 . 2 1 1 A 5 5 ILE C C 94 177.778 177.612 0.166 1
1 52 . 2 1 1 A 5 5 ILE CA C 94 65.710 65.436 0.274 1
1 53 . 2 1 1 A 5 5 ILE CB C 94 37.800 37.661 0.139 1
1 57 . 2 1 1 A 5 5 ILE N N 94 124.148 121.554 2.594 1
1 58 . 2 1 1 A 6 6 GLN H H 95 8.374 7.936 0.438 1
1 59 . 2 1 1 A 6 6 GLN HA H 95 4.125 3.938 0.187 1
1 66 . 2 1 1 A 6 6 GLN C C 95 179.726 179.080 0.646 1
1 67 . 2 1 1 A 6 6 GLN CA C 95 59.190 58.810 0.380 1
1 68 . 2 1 1 A 6 6 GLN CB C 95 27.060 28.208 -1.148 1
1 70 . 2 1 1 A 6 6 GLN N N 95 118.257 119.128 -0.871 1
1 72 . 2 1 1 A 7 7 ASN H H 96 8.456 8.292 0.164 1
1 73 . 2 1 1 A 7 7 ASN HA H 96 4.446 4.558 -0.112 1
1 78 . 2 1 1 A 7 7 ASN C C 96 177.257 177.466 -0.209 1
1 79 . 2 1 1 A 7 7 ASN CA C 96 56.020 55.853 0.167 1
1 80 . 2 1 1 A 7 7 ASN CB C 96 38.126 37.874 0.252 1
1 81 . 2 1 1 A 7 7 ASN N N 96 118.597 118.610 -0.013 1
1 83 . 2 1 1 A 8 8 LYS H H 97 7.732 7.897 -0.165 1
1 84 . 2 1 1 A 8 8 LYS HA H 97 4.129 4.047 0.082 1
1 93 . 2 1 1 A 8 8 LYS C C 97 179.143 179.326 -0.183 1
1 94 . 2 1 1 A 8 8 LYS CA C 97 59.126 59.946 -0.820 1
1 95 . 2 1 1 A 8 8 LYS CB C 97 32.070 32.534 -0.464 1
1 99 . 2 1 1 A 8 8 LYS N N 97 122.381 121.047 1.334 1
1 100 . 2 1 1 A 9 9 ILE H H 98 8.452 7.991 0.461 1
1 101 . 2 1 1 A 9 9 ILE HA H 98 3.480 3.885 -0.405 1
1 111 . 2 1 1 A 9 9 ILE C C 98 177.406 178.598 -1.192 1
1 112 . 2 1 1 A 9 9 ILE CA C 98 66.430 64.943 1.487 1
1 113 . 2 1 1 A 9 9 ILE CB C 98 37.980 37.332 0.648 1
1 117 . 2 1 1 A 9 9 ILE N N 98 119.950 120.095 -0.145 1
1 118 . 2 1 1 A 10 10 SER H H 99 7.924 7.726 0.198 1
1 119 . 2 1 1 A 10 10 SER HA H 99 3.983 4.181 -0.198 1
1 122 . 2 1 1 A 10 10 SER C C 99 176.327 176.327 0.000 1
1 123 . 2 1 1 A 10 10 SER CA C 99 61.990 61.286 0.704 1
1 124 . 2 1 1 A 10 10 SER CB C 99 62.790 63.023 -0.233 1
1 125 . 2 1 1 A 10 10 SER N N 99 113.568 117.108 -3.540 1
1 126 . 2 1 1 A 11 11 GLN H H 100 7.832 7.944 -0.112 1
1 127 . 2 1 1 A 11 11 GLN HA H 100 4.238 4.375 -0.137 1
1 134 . 2 1 1 A 11 11 GLN C C 100 178.088 177.842 0.246 1
1 135 . 2 1 1 A 11 11 GLN CA C 100 57.900 56.625 1.275 1
1 136 . 2 1 1 A 11 11 GLN CB C 100 29.790 29.345 0.445 1
1 138 . 2 1 1 A 11 11 GLN N N 100 117.487 117.398 0.089 1
1 140 . 2 1 1 A 12 12 CYS H H 101 7.920 7.886 0.034 1
1 141 . 2 1 1 A 12 12 CYS HA H 101 4.657 4.559 0.098 1
1 144 . 2 1 1 A 12 12 CYS C C 101 175.439 174.499 0.940 1
1 145 . 2 1 1 A 12 12 CYS CA C 101 60.654 59.304 1.350 1
1 146 . 2 1 1 A 12 12 CYS CB C 101 29.310 28.652 0.658 1
1 147 . 2 1 1 A 12 12 CYS N N 101 114.221 118.563 -4.342 1
1 148 . 2 1 1 A 13 13 LYS H H 102 7.993 7.490 0.503 1
1 149 . 2 1 1 A 13 13 LYS HA H 102 5.038 4.522 0.516 1
1 158 . 2 1 1 A 13 13 LYS C C 102 174.757 176.128 -1.371 1
1 159 . 2 1 1 A 13 13 LYS CA C 102 56.660 55.974 0.686 1
1 160 . 2 1 1 A 13 13 LYS CB C 102 32.970 33.411 -0.441 1
1 164 . 2 1 1 A 13 13 LYS N N 102 123.841 118.375 5.466 1
1 165 . 2 1 1 A 14 14 PHE H H 103 8.822 8.527 0.295 1
1 166 . 2 1 1 A 14 14 PHE HA H 103 5.058 5.060 -0.002 1
1 174 . 2 1 1 A 14 14 PHE C C 103 173.560 172.782 0.778 1
1 175 . 2 1 1 A 14 14 PHE CA C 103 55.470 56.036 -0.566 1
1 176 . 2 1 1 A 14 14 PHE CB C 103 41.760 40.960 0.800 1
1 180 . 2 1 1 A 14 14 PHE N N 103 118.421 116.267 2.154 1
1 181 . 2 1 1 A 15 15 SER H H 104 8.826 8.814 0.012 1
1 182 . 2 1 1 A 15 15 SER HA H 104 4.602 4.747 -0.145 1
1 185 . 2 1 1 A 15 15 SER C C 104 173.851 173.458 0.393 1
1 186 . 2 1 1 A 15 15 SER CA C 104 58.610 58.629 -0.019 1
1 187 . 2 1 1 A 15 15 SER CB C 104 62.690 62.672 0.018 1
1 188 . 2 1 1 A 15 15 SER N N 104 117.781 117.028 0.753 1
1 189 . 2 1 1 A 16 16 VAL H H 105 7.839 7.904 -0.065 1
1 190 . 2 1 1 A 16 16 VAL HA H 105 3.390 4.384 -0.994 1
1 198 . 2 1 1 A 16 16 VAL C C 105 174.987 175.217 -0.230 1
1 199 . 2 1 1 A 16 16 VAL CA C 105 63.650 62.793 0.857 1
1 200 . 2 1 1 A 16 16 VAL CB C 105 31.410 30.562 0.848 1
1 203 . 2 1 1 A 16 16 VAL N N 105 129.036 126.449 2.587 1
1 204 . 2 1 1 A 17 17 CYS H H 106 8.536 8.098 0.438 1
1 205 . 2 1 1 A 17 17 CYS HA H 106 5.011 4.960 0.051 1
1 208 . 2 1 1 A 17 17 CYS CA C 106 55.260 56.508 -1.248 1
1 209 . 2 1 1 A 17 17 CYS CB C 106 28.210 29.964 -1.754 1
1 210 . 2 1 1 A 17 17 CYS N N 106 130.045 127.060 2.985 1
1 211 . 2 1 1 A 18 18 PRO HA H 107 3.991 4.353 -0.362 1
1 218 . 2 1 1 A 18 18 PRO C C 107 178.188 178.269 -0.081 1
1 219 . 2 1 1 A 18 18 PRO CA C 107 65.940 64.828 1.112 1
1 220 . 2 1 1 A 18 18 PRO CB C 107 32.000 32.139 -0.139 1
1 223 . 2 1 1 A 19 19 GLU H H 108 9.260 9.045 0.215 1
1 224 . 2 1 1 A 19 19 GLU HA H 108 4.119 4.060 0.059 1
1 229 . 2 1 1 A 19 19 GLU C C 108 178.721 178.852 -0.131 1
1 230 . 2 1 1 A 19 19 GLU CA C 108 59.300 59.790 -0.490 1
1 231 . 2 1 1 A 19 19 GLU CB C 108 28.920 28.702 0.218 1
1 233 . 2 1 1 A 19 19 GLU N N 108 118.270 116.333 1.937 1
1 234 . 2 1 1 A 20 20 ARG H H 109 7.672 7.473 0.199 1
1 235 . 2 1 1 A 20 20 ARG HA H 109 4.331 4.171 0.160 1
1 242 . 2 1 1 A 20 20 ARG C C 109 177.977 178.032 -0.055 1
1 243 . 2 1 1 A 20 20 ARG CA C 109 57.350 58.788 -1.438 1
1 244 . 2 1 1 A 20 20 ARG CB C 109 30.820 30.302 0.518 1
1 247 . 2 1 1 A 20 20 ARG N N 109 118.357 119.272 -0.915 1
1 248 . 2 1 1 A 21 21 LEU H H 110 7.601 7.784 -0.183 1
1 249 . 2 1 1 A 21 21 LEU HA H 110 4.380 4.384 -0.004 1
1 259 . 2 1 1 A 21 21 LEU C C 110 176.562 175.918 0.644 1
1 260 . 2 1 1 A 21 21 LEU CA C 110 56.096 55.237 0.859 1
1 261 . 2 1 1 A 21 21 LEU CB C 110 44.016 42.569 1.447 1
1 265 . 2 1 1 A 21 21 LEU N N 110 118.626 117.734 0.892 1
1 266 . 2 1 1 A 22 22 GLN H H 111 7.750 7.510 0.240 1
1 267 . 2 1 1 A 22 22 GLN HA H 111 3.870 3.888 -0.018 1
1 274 . 2 1 1 A 22 22 GLN C C 111 173.336 174.165 -0.829 1
1 275 . 2 1 1 A 22 22 GLN CA C 111 56.510 56.933 -0.423 1
1 276 . 2 1 1 A 22 22 GLN CB C 111 26.800 26.184 0.616 1
1 278 . 2 1 1 A 22 22 GLN N N 111 113.926 116.102 -2.176 1
1 280 . 2 1 1 A 23 23 CYS H H 112 7.407 7.462 -0.055 1
1 281 . 2 1 1 A 23 23 CYS HA H 112 4.469 4.977 -0.508 1
1 284 . 2 1 1 A 23 23 CYS CA C 112 52.650 56.849 -4.199 1
1 285 . 2 1 1 A 23 23 CYS CB C 112 29.750 31.029 -1.279 1
1 286 . 2 1 1 A 23 23 CYS N N 112 112.681 117.198 -4.517 1
1 287 . 2 1 1 A 24 24 PRO HA H 113 4.408 4.473 -0.065 1
1 294 . 2 1 1 A 24 24 PRO C C 113 178.175 177.458 0.717 1
1 295 . 2 1 1 A 24 24 PRO CA C 113 62.040 62.531 -0.491 1
1 296 . 2 1 1 A 24 24 PRO CB C 113 31.920 33.083 -1.163 1
1 299 . 2 1 1 A 25 25 LEU H H 114 8.593 8.830 -0.237 1
1 300 . 2 1 1 A 25 25 LEU HA H 114 3.765 4.037 -0.272 1
1 310 . 2 1 1 A 25 25 LEU C C 114 179.950 178.685 1.265 1
1 311 . 2 1 1 A 25 25 LEU CA C 114 57.674 58.127 -0.453 1
1 312 . 2 1 1 A 25 25 LEU CB C 114 40.690 41.346 -0.656 1
1 316 . 2 1 1 A 25 25 LEU N N 114 123.729 123.762 -0.033 1
1 317 . 2 1 1 A 26 26 GLU H H 115 9.108 8.466 0.642 1
1 318 . 2 1 1 A 26 26 GLU HA H 115 3.876 3.965 -0.089 1
1 323 . 2 1 1 A 26 26 GLU C C 115 177.505 179.417 -1.912 1
1 324 . 2 1 1 A 26 26 GLU CA C 115 59.410 59.561 -0.151 1
1 325 . 2 1 1 A 26 26 GLU CB C 115 28.460 29.265 -0.805 1
1 327 . 2 1 1 A 26 26 GLU N N 115 116.817 118.433 -1.616 1
1 328 . 2 1 1 A 27 27 ALA H H 116 7.360 7.668 -0.308 1
1 329 . 2 1 1 A 27 27 ALA HA H 116 4.408 3.658 0.750 1
1 333 . 2 1 1 A 27 27 ALA C C 116 177.046 178.095 -1.049 1
1 334 . 2 1 1 A 27 27 ALA CA C 116 52.970 54.451 -1.481 1
1 335 . 2 1 1 A 27 27 ALA CB C 116 19.916 17.736 2.180 1
1 336 . 2 1 1 A 27 27 ALA N N 116 118.966 121.604 -2.638 1
1 337 . 2 1 1 A 28 28 ILE H H 117 7.168 7.162 0.006 1
1 338 . 2 1 1 A 28 28 ILE HA H 117 4.432 4.692 -0.260 1
1 348 . 2 1 1 A 28 28 ILE C C 117 172.641 175.526 -2.885 1
1 349 . 2 1 1 A 28 28 ILE CA C 117 59.980 60.326 -0.346 1
1 350 . 2 1 1 A 28 28 ILE CB C 117 37.350 38.044 -0.694 1
1 354 . 2 1 1 A 28 28 ILE N N 117 108.913 108.828 0.085 1
1 355 . 2 1 1 A 29 29 GLN H H 118 6.562 7.416 -0.854 1
1 356 . 2 1 1 A 29 29 GLN HA H 118 3.922 4.242 -0.320 1
1 363 . 2 1 1 A 29 29 GLN C C 118 175.049 175.691 -0.642 1
1 364 . 2 1 1 A 29 29 GLN CA C 118 54.596 56.008 -1.412 1
1 365 . 2 1 1 A 29 29 GLN CB C 118 29.570 29.266 0.304 1
1 367 . 2 1 1 A 29 29 GLN N N 118 116.455 123.287 -6.832 1
1 369 . 2 1 1 A 30 30 CYS H H 119 8.138 8.464 -0.326 1
1 370 . 2 1 1 A 30 30 CYS HA H 119 4.580 4.505 0.075 1
1 373 . 2 1 1 A 30 30 CYS CA C 119 57.810 57.701 0.109 1
1 374 . 2 1 1 A 30 30 CYS CB C 119 30.200 28.718 1.482 1
1 375 . 2 1 1 A 30 30 CYS N N 119 134.136 125.303 8.833 1
1 376 . 2 1 1 A 31 31 PRO HA H 120 4.424 4.390 0.034 1
1 383 . 2 1 1 A 31 31 PRO C C 120 177.431 178.521 -1.090 1
1 384 . 2 1 1 A 31 31 PRO CA C 120 64.060 64.737 -0.677 1
1 385 . 2 1 1 A 31 31 PRO CB C 120 32.776 32.162 0.614 1
1 388 . 2 1 1 A 32 32 ILE H H 121 11.318 7.362 3.956 1
1 389 . 2 1 1 A 32 32 ILE HA H 121 4.038 4.020 0.018 1
1 399 . 2 1 1 A 32 32 ILE C C 121 178.485 177.713 0.772 1
1 400 . 2 1 1 A 32 32 ILE CA C 121 64.060 63.642 0.418 1
1 401 . 2 1 1 A 32 32 ILE CB C 121 39.340 38.256 1.084 1
1 405 . 2 1 1 A 32 32 ILE N N 121 124.500 116.690 7.810 1
1 406 . 2 1 1 A 33 33 THR H H 122 9.928 7.554 2.374 1
1 407 . 2 1 1 A 33 33 THR HA H 122 4.048 4.391 -0.343 1
1 412 . 2 1 1 A 33 33 THR C C 122 175.793 174.834 0.959 1
1 413 . 2 1 1 A 33 33 THR CA C 122 62.990 61.734 1.256 1
1 414 . 2 1 1 A 33 33 THR CB C 122 70.300 69.197 1.103 1
1 416 . 2 1 1 A 33 33 THR N N 122 115.136 109.431 5.705 1
1 417 . 2 1 1 A 34 34 LEU H H 123 8.439 7.784 0.655 1
1 418 . 2 1 1 A 34 34 LEU HA H 123 3.912 4.098 -0.186 1
1 428 . 2 1 1 A 34 34 LEU C C 123 175.495 175.514 -0.019 1
1 429 . 2 1 1 A 34 34 LEU CA C 123 56.290 55.954 0.336 1
1 430 . 2 1 1 A 34 34 LEU CB C 123 38.500 39.718 -1.218 1
1 434 . 2 1 1 A 34 34 LEU N N 123 117.230 121.145 -3.915 1
1 435 . 2 1 1 A 35 35 GLU H H 124 7.816 7.545 0.271 1
1 436 . 2 1 1 A 35 35 GLU HA H 124 4.634 4.754 -0.120 1
1 441 . 2 1 1 A 35 35 GLU C C 124 174.838 174.134 0.704 1
1 442 . 2 1 1 A 35 35 GLU CA C 124 53.780 54.676 -0.896 1
1 443 . 2 1 1 A 35 35 GLU CB C 124 33.710 32.442 1.268 1
1 445 . 2 1 1 A 35 35 GLU N N 124 116.577 116.449 0.128 1
1 446 . 2 1 1 A 36 36 GLN H H 125 8.532 8.564 -0.032 1
1 447 . 2 1 1 A 36 36 GLN HA H 125 4.958 4.419 0.539 1
1 454 . 2 1 1 A 36 36 GLN CA C 125 53.350 53.691 -0.341 1
1 455 . 2 1 1 A 36 36 GLN CB C 125 29.950 29.821 0.129 1
1 457 . 2 1 1 A 36 36 GLN N N 125 123.034 121.473 1.561 1
1 459 . 2 1 1 A 37 37 PRO HA H 126 4.458 4.402 0.056 1
1 466 . 2 1 1 A 37 37 PRO C C 126 176.314 177.280 -0.966 1
1 467 . 2 1 1 A 37 37 PRO CA C 126 62.816 65.665 -2.849 1
1 468 . 2 1 1 A 37 37 PRO CB C 126 33.070 31.590 1.480 1
1 471 . 2 1 1 A 38 38 GLU H H 127 8.626 8.089 0.537 1
1 472 . 2 1 1 A 38 38 GLU HA H 127 4.274 4.436 -0.162 1
1 477 . 2 1 1 A 38 38 GLU C C 127 177.809 175.022 2.787 1
1 478 . 2 1 1 A 38 38 GLU CA C 127 58.730 58.353 0.377 1
1 479 . 2 1 1 A 38 38 GLU CB C 127 30.340 29.457 0.883 1
1 481 . 2 1 1 A 38 38 GLU N N 127 120.691 119.319 1.372 1
1 482 . 2 1 1 A 39 39 LYS H H 128 7.891 7.881 0.010 1
1 483 . 2 1 1 A 39 39 LYS HA H 128 4.870 4.705 0.165 1
1 492 . 2 1 1 A 39 39 LYS C C 128 175.452 175.802 -0.350 1
1 493 . 2 1 1 A 39 39 LYS CA C 128 53.540 54.715 -1.175 1
1 494 . 2 1 1 A 39 39 LYS CB C 128 33.630 34.624 -0.994 1
1 498 . 2 1 1 A 39 39 LYS N N 128 118.149 118.254 -0.105 1
1 499 . 2 1 1 A 40 40 GLY H H 129 8.524 8.094 0.430 1
1 500 . 2 1 1 A 40 40 GLY HA2 H 129 4.973 4.049 0.924 1
1 501 . 2 1 1 A 40 40 GLY HA3 H 129 2.459 4.176 -1.717 1
1 502 . 2 1 1 A 40 40 GLY C C 129 169.943 171.842 -1.899 1
1 503 . 2 1 1 A 40 40 GLY CA C 129 42.910 44.935 -2.025 1
1 504 . 2 1 1 A 40 40 GLY N N 129 112.845 110.590 2.255 1
1 505 . 2 1 1 A 41 41 ILE H H 130 8.659 8.329 0.330 1
1 506 . 2 1 1 A 41 41 ILE HA H 130 4.591 4.740 -0.149 1
1 516 . 2 1 1 A 41 41 ILE C C 130 172.586 174.211 -1.625 1
1 517 . 2 1 1 A 41 41 ILE CA C 130 58.090 59.053 -0.963 1
1 518 . 2 1 1 A 41 41 ILE CB C 130 43.320 41.754 1.566 1
1 522 . 2 1 1 A 41 41 ILE N N 130 114.060 119.268 -5.208 1
1 523 . 2 1 1 A 42 42 PHE H H 131 9.206 8.962 0.244 1
1 524 . 2 1 1 A 42 42 PHE HA H 131 5.159 4.693 0.466 1
1 532 . 2 1 1 A 42 42 PHE C C 131 174.931 175.654 -0.723 1
1 533 . 2 1 1 A 42 42 PHE CA C 131 57.790 57.966 -0.176 1
1 534 . 2 1 1 A 42 42 PHE CB C 131 42.220 39.007 3.213 1
1 538 . 2 1 1 A 42 42 PHE N N 131 126.002 128.430 -2.428 1
1 539 . 2 1 1 A 43 43 VAL H H 132 8.502 8.902 -0.400 1
1 540 . 2 1 1 A 43 43 VAL HA H 132 4.921 4.727 0.194 1
1 548 . 2 1 1 A 43 43 VAL C C 132 178.219 175.356 2.863 1
1 549 . 2 1 1 A 43 43 VAL CA C 132 59.600 59.987 -0.387 1
1 550 . 2 1 1 A 43 43 VAL CB C 132 35.920 35.511 0.409 1
1 553 . 2 1 1 A 43 43 VAL N N 132 119.068 123.157 -4.089 1
1 554 . 2 1 1 A 44 44 LYS H H 133 10.036 8.728 1.308 1
1 555 . 2 1 1 A 44 44 LYS HA H 133 5.070 4.310 0.760 1
1 564 . 2 1 1 A 44 44 LYS C C 133 177.276 177.727 -0.451 1
1 565 . 2 1 1 A 44 44 LYS CA C 133 56.720 57.071 -0.351 1
1 566 . 2 1 1 A 44 44 LYS CB C 133 34.410 32.958 1.452 1
1 570 . 2 1 1 A 44 44 LYS N N 133 130.934 125.106 5.828 1
1 571 . 2 1 1 A 45 45 ASN H H 134 8.093 8.722 -0.629 1
1 572 . 2 1 1 A 45 45 ASN HA H 134 4.152 4.453 -0.301 1
1 577 . 2 1 1 A 45 45 ASN C C 134 174.087 175.139 -1.052 1
1 578 . 2 1 1 A 45 45 ASN CA C 134 55.360 55.653 -0.293 1
1 579 . 2 1 1 A 45 45 ASN CB C 134 37.530 39.163 -1.633 1
1 580 . 2 1 1 A 45 45 ASN N N 134 117.963 121.559 -3.596 1
1 582 . 2 1 1 A 46 46 SER H H 135 7.524 7.845 -0.321 1
1 583 . 2 1 1 A 46 46 SER HA H 135 4.219 4.736 -0.517 1
1 586 . 2 1 1 A 46 46 SER C C 135 174.490 174.350 0.140 1
1 587 . 2 1 1 A 46 46 SER CA C 135 57.090 55.854 1.236 1
1 588 . 2 1 1 A 46 46 SER CB C 135 63.860 66.428 -2.568 1
1 589 . 2 1 1 A 46 46 SER N N 135 105.939 108.602 -2.663 1
1 590 . 2 1 1 A 47 47 ASP H H 136 9.113 9.146 -0.033 1
1 591 . 2 1 1 A 47 47 ASP HA H 136 4.220 4.295 -0.075 1
1 594 . 2 1 1 A 47 47 ASP CA C 136 57.610 57.142 0.468 1
1 595 . 2 1 1 A 47 47 ASP CB C 136 40.810 40.671 0.139 1
1 596 . 2 1 1 A 47 47 ASP N N 136 120.995 123.346 -2.351 1
1 597 . 2 1 1 A 48 48 GLY H H 137 8.181 8.050 0.131 1
1 598 . 2 1 1 A 48 48 GLY HA2 H 137 4.120 3.883 0.237 1
1 599 . 2 1 1 A 48 48 GLY HA3 H 137 3.659 3.884 -0.225 1
1 600 . 2 1 1 A 48 48 GLY C C 137 174.062 173.388 0.674 1
1 601 . 2 1 1 A 48 48 GLY CA C 137 45.130 45.610 -0.480 1
1 602 . 2 1 1 A 48 48 GLY N N 137 106.197 106.522 -0.325 1
1 603 . 2 1 1 A 49 49 SER H H 138 7.179 7.668 -0.489 1
1 604 . 2 1 1 A 49 49 SER HA H 138 4.383 4.941 -0.558 1
1 607 . 2 1 1 A 49 49 SER C C 138 173.864 173.249 0.615 1
1 608 . 2 1 1 A 49 49 SER CA C 138 57.614 57.460 0.154 1
1 609 . 2 1 1 A 49 49 SER CB C 138 65.100 67.013 -1.913 1
1 610 . 2 1 1 A 49 49 SER N N 138 115.015 114.668 0.347 1
1 611 . 2 1 1 A 50 50 ASP H H 139 8.078 8.522 -0.444 1
1 612 . 2 1 1 A 50 50 ASP HA H 139 4.642 4.801 -0.159 1
1 615 . 2 1 1 A 50 50 ASP C C 139 174.261 175.015 -0.754 1
1 616 . 2 1 1 A 50 50 ASP CA C 139 52.406 54.289 -1.883 1
1 617 . 2 1 1 A 50 50 ASP CB C 139 40.254 41.490 -1.236 1
1 618 . 2 1 1 A 50 50 ASP N N 139 122.400 121.832 0.568 1
1 619 . 2 1 1 A 51 51 VAL H H 140 8.111 7.422 0.689 1
1 620 . 2 1 1 A 51 51 VAL HA H 140 4.360 4.537 -0.177 1
1 628 . 2 1 1 A 51 51 VAL C C 140 176.147 174.032 2.115 1
1 629 . 2 1 1 A 51 51 VAL CA C 140 62.670 60.455 2.215 1
1 630 . 2 1 1 A 51 51 VAL CB C 140 33.930 33.616 0.314 1
1 632 . 2 1 1 A 51 51 VAL N N 140 120.374 119.580 0.794 1
1 633 . 2 1 1 A 52 52 CYS H H 141 8.358 8.950 -0.592 1
1 634 . 2 1 1 A 52 52 CYS HA H 141 4.957 5.586 -0.629 1
1 637 . 2 1 1 A 52 52 CYS C C 141 173.070 172.617 0.453 1
1 638 . 2 1 1 A 52 52 CYS CA C 141 53.380 54.327 -0.947 1
1 639 . 2 1 1 A 52 52 CYS CB C 141 46.110 46.194 -0.084 1
1 640 . 2 1 1 A 52 52 CYS N N 141 121.305 128.923 -7.618 1
1 641 . 2 1 1 A 53 53 THR H H 142 8.929 8.721 0.208 1
1 642 . 2 1 1 A 53 53 THR HA H 142 4.498 4.851 -0.353 1
1 648 . 2 1 1 A 53 53 THR C C 142 172.151 172.152 -0.001 1
1 649 . 2 1 1 A 53 53 THR CA C 142 62.960 60.980 1.980 1
1 650 . 2 1 1 A 53 53 THR CB C 142 70.540 72.572 -2.032 1
1 652 . 2 1 1 A 53 53 THR N N 142 120.105 117.924 2.181 1
1 653 . 2 1 1 A 54 54 LEU H H 143 8.448 8.505 -0.057 1
1 654 . 2 1 1 A 54 54 LEU HA H 143 4.322 4.767 -0.445 1
1 664 . 2 1 1 A 54 54 LEU C C 143 174.484 174.521 -0.037 1
1 665 . 2 1 1 A 54 54 LEU CA C 143 54.596 53.483 1.113 1
1 666 . 2 1 1 A 54 54 LEU CB C 143 42.396 44.041 -1.645 1
1 670 . 2 1 1 A 54 54 LEU N N 143 128.819 128.208 0.611 1
1 671 . 2 1 1 A 55 55 PHE H H 144 8.661 8.890 -0.229 1
1 672 . 2 1 1 A 55 55 PHE HA H 144 5.459 5.030 0.429 1
1 680 . 2 1 1 A 55 55 PHE C C 144 176.035 174.705 1.330 1
1 681 . 2 1 1 A 55 55 PHE CA C 144 55.020 56.556 -1.536 1
1 682 . 2 1 1 A 55 55 PHE CB C 144 44.100 42.790 1.310 1
1 686 . 2 1 1 A 55 55 PHE N N 144 121.897 125.526 -3.629 1
1 687 . 2 1 1 A 56 56 ASP H H 145 11.616 8.605 3.011 1
1 688 . 2 1 1 A 56 56 ASP HA H 145 4.417 4.595 -0.178 1
1 691 . 2 1 1 A 56 56 ASP C C 145 176.748 177.401 -0.653 1
1 692 . 2 1 1 A 56 56 ASP CA C 145 55.844 54.502 1.342 1
1 693 . 2 1 1 A 56 56 ASP CB C 145 44.390 42.914 1.476 1
1 694 . 2 1 1 A 56 56 ASP N N 145 122.131 122.003 0.128 1
1 695 . 2 1 1 A 57 57 ALA H H 146 8.508 8.881 -0.373 1
1 696 . 2 1 1 A 57 57 ALA HA H 146 3.797 4.043 -0.246 1
1 700 . 2 1 1 A 57 57 ALA C C 146 178.696 180.104 -1.408 1
1 701 . 2 1 1 A 57 57 ALA CA C 146 55.990 55.374 0.616 1
1 702 . 2 1 1 A 57 57 ALA CB C 146 18.840 18.100 0.740 1
1 703 . 2 1 1 A 57 57 ALA N N 146 130.243 128.811 1.432 1
1 704 . 2 1 1 A 58 58 ALA H H 147 8.378 7.625 0.753 1
1 705 . 2 1 1 A 58 58 ALA HA H 147 4.078 4.209 -0.131 1
1 709 . 2 1 1 A 58 58 ALA C C 147 181.091 179.512 1.579 1
1 710 . 2 1 1 A 58 58 ALA CA C 147 54.770 54.998 -0.228 1
1 711 . 2 1 1 A 58 58 ALA CB C 147 17.700 18.422 -0.722 1
1 712 . 2 1 1 A 58 58 ALA N N 147 121.997 119.435 2.562 1
1 713 . 2 1 1 A 59 59 ALA H H 148 9.138 8.034 1.104 1
1 714 . 2 1 1 A 59 59 ALA HA H 148 3.975 4.048 -0.073 1
1 718 . 2 1 1 A 59 59 ALA C C 148 180.508 179.897 0.611 1
1 719 . 2 1 1 A 59 59 ALA CA C 148 54.840 55.134 -0.294 1
1 720 . 2 1 1 A 59 59 ALA CB C 148 18.600 18.593 0.007 1
1 721 . 2 1 1 A 59 59 ALA N N 148 123.595 120.467 3.128 1
1 722 . 2 1 1 A 60 60 PHE H H 149 8.814 8.094 0.720 1
1 723 . 2 1 1 A 60 60 PHE HA H 149 3.722 3.969 -0.247 1
1 731 . 2 1 1 A 60 60 PHE C C 149 176.773 177.468 -0.695 1
1 732 . 2 1 1 A 60 60 PHE CA C 149 62.030 61.554 0.476 1
1 733 . 2 1 1 A 60 60 PHE CB C 149 39.960 38.954 1.006 1
1 737 . 2 1 1 A 60 60 PHE N N 149 120.354 119.855 0.499 1
1 738 . 2 1 1 A 61 61 SER H H 150 8.276 8.175 0.101 1
1 739 . 2 1 1 A 61 61 SER HA H 150 3.880 4.022 -0.142 1
1 742 . 2 1 1 A 61 61 SER C C 150 177.691 176.424 1.267 1
1 743 . 2 1 1 A 61 61 SER CA C 150 62.190 61.504 0.686 1
1 744 . 2 1 1 A 61 61 SER CB C 150 63.016 62.902 0.114 1
1 745 . 2 1 1 A 61 61 SER N N 150 112.086 114.108 -2.022 1
1 746 . 2 1 1 A 62 62 ARG H H 151 7.829 7.923 -0.094 1
1 747 . 2 1 1 A 62 62 ARG HA H 151 3.971 4.033 -0.062 1
1 754 . 2 1 1 A 62 62 ARG C C 151 178.287 178.362 -0.075 1
1 755 . 2 1 1 A 62 62 ARG CA C 151 59.340 58.894 0.446 1
1 756 . 2 1 1 A 62 62 ARG CB C 151 29.760 29.787 -0.027 1
1 759 . 2 1 1 A 62 62 ARG N N 151 121.090 119.176 1.914 1
1 760 . 2 1 1 A 63 63 LEU H H 152 7.390 7.487 -0.097 1
1 761 . 2 1 1 A 63 63 LEU HA H 152 3.791 3.944 -0.153 1
1 771 . 2 1 1 A 63 63 LEU C C 152 179.106 178.159 0.947 1
1 772 . 2 1 1 A 63 63 LEU CA C 152 58.900 58.150 0.750 1
1 773 . 2 1 1 A 63 63 LEU CB C 152 41.140 41.064 0.076 1
1 777 . 2 1 1 A 63 63 LEU N N 152 121.129 122.001 -0.872 1
1 778 . 2 1 1 A 64 64 VAL H H 153 7.552 8.024 -0.472 1
1 779 . 2 1 1 A 64 64 VAL HA H 153 3.411 3.475 -0.064 1
1 787 . 2 1 1 A 64 64 VAL C C 153 180.595 178.988 1.607 1
1 788 . 2 1 1 A 64 64 VAL CA C 153 65.644 66.047 -0.403 1
1 789 . 2 1 1 A 64 64 VAL CB C 153 31.410 31.322 0.088 1
1 792 . 2 1 1 A 64 64 VAL N N 153 118.280 118.874 -0.594 1
1 793 . 2 1 1 A 65 65 GLY H H 154 8.061 8.205 -0.144 1
1 794 . 2 1 1 A 65 65 GLY HA2 H 154 3.846 3.814 0.032 1
1 795 . 2 1 1 A 65 65 GLY HA3 H 154 3.809 3.816 -0.007 1
1 796 . 2 1 1 A 65 65 GLY C C 154 175.235 175.588 -0.353 1
1 797 . 2 1 1 A 65 65 GLY CA C 154 46.630 46.695 -0.065 1
1 798 . 2 1 1 A 65 65 GLY N N 154 108.622 107.720 0.902 1
1 799 . 2 1 1 A 66 66 GLU H H 155 7.528 7.492 0.036 1
1 800 . 2 1 1 A 66 66 GLU HA H 155 4.228 4.318 -0.090 1
1 805 . 2 1 1 A 66 66 GLU C C 155 176.761 177.105 -0.344 1
1 806 . 2 1 1 A 66 66 GLU CA C 155 56.590 56.304 0.286 1
1 807 . 2 1 1 A 66 66 GLU CB C 155 30.490 30.381 0.109 1
1 809 . 2 1 1 A 66 66 GLU N N 155 118.361 118.514 -0.153 1
1 810 . 2 1 1 A 67 67 GLY H H 156 7.884 7.772 0.112 1
1 811 . 2 1 1 A 67 67 GLY HA2 H 156 3.918 3.841 0.077 1
1 812 . 2 1 1 A 67 67 GLY HA3 H 156 3.747 3.857 -0.110 1
1 813 . 2 1 1 A 67 67 GLY C C 156 174.788 174.679 0.109 1
1 814 . 2 1 1 A 67 67 GLY CA C 156 45.890 46.073 -0.183 1
1 815 . 2 1 1 A 67 67 GLY N N 156 108.465 109.383 -0.918 1
1 816 . 2 1 1 A 68 68 LEU H H 157 7.332 7.854 -0.522 1
1 817 . 2 1 1 A 68 68 LEU HA H 157 4.361 4.517 -0.156 1
1 827 . 2 1 1 A 68 68 LEU CA C 157 53.060 52.452 0.608 1
1 828 . 2 1 1 A 68 68 LEU CB C 157 41.100 41.391 -0.291 1
1 832 . 2 1 1 A 68 68 LEU N N 157 121.920 121.752 0.168 1
1 833 . 2 1 1 A 69 69 PRO HA H 158 4.485 4.602 -0.117 1
1 840 . 2 1 1 A 69 69 PRO C C 158 174.602 176.328 -1.726 1
1 841 . 2 1 1 A 69 69 PRO CA C 158 61.556 62.256 -0.700 1
1 842 . 2 1 1 A 69 69 PRO CB C 158 32.370 32.681 -0.311 1
1 845 . 2 1 1 A 70 70 HIS H H 159 8.734 8.509 0.225 1
1 846 . 2 1 1 A 70 70 HIS HA H 159 3.947 4.503 -0.556 1
1 852 . 2 1 1 A 70 70 HIS CA C 159 56.250 55.248 1.002 1
1 853 . 2 1 1 A 70 70 HIS CB C 159 32.280 31.021 1.259 1
1 856 . 2 1 1 A 70 70 HIS N N 159 119.423 121.719 -2.296 1
1 857 . 2 1 1 A 71 71 PRO HA H 160 4.424 4.211 0.213 1
1 864 . 2 1 1 A 71 71 PRO C C 160 177.567 178.569 -1.002 1
1 865 . 2 1 1 A 71 71 PRO CA C 160 64.574 65.220 -0.646 1
1 866 . 2 1 1 A 71 71 PRO CB C 160 32.340 31.916 0.424 1
1 869 . 2 1 1 A 72 72 LEU H H 161 10.123 7.528 2.595 1
1 870 . 2 1 1 A 72 72 LEU HA H 161 4.778 4.311 0.467 1
1 880 . 2 1 1 A 72 72 LEU C C 161 178.721 178.019 0.702 1
1 881 . 2 1 1 A 72 72 LEU CA C 161 55.800 57.069 -1.269 1
1 882 . 2 1 1 A 72 72 LEU CB C 161 42.440 42.449 -0.009 1
1 886 . 2 1 1 A 72 72 LEU N N 161 117.374 117.375 -0.001 1
1 887 . 2 1 1 A 73 73 THR H H 162 7.523 7.778 -0.255 1
1 888 . 2 1 1 A 73 73 THR HA H 162 4.291 4.566 -0.275 1
1 893 . 2 1 1 A 73 73 THR C C 162 175.557 174.385 1.172 1
1 894 . 2 1 1 A 73 73 THR CA C 162 61.440 62.145 -0.705 1
1 895 . 2 1 1 A 73 73 THR CB C 162 70.500 69.604 0.896 1
1 897 . 2 1 1 A 73 73 THR N N 162 107.787 111.545 -3.758 1
1 898 . 2 1 1 A 74 74 ARG H H 163 8.361 8.018 0.343 1
1 899 . 2 1 1 A 74 74 ARG HA H 163 3.836 4.002 -0.166 1
1 906 . 2 1 1 A 74 74 ARG C C 163 174.701 175.222 -0.521 1
1 907 . 2 1 1 A 74 74 ARG CA C 163 57.980 57.666 0.314 1
1 908 . 2 1 1 A 74 74 ARG CB C 163 26.770 26.942 -0.172 1
1 911 . 2 1 1 A 74 74 ARG N N 163 115.130 118.350 -3.220 1
1 912 . 2 1 1 A 75 75 GLU H H 164 7.430 8.088 -0.658 1
1 913 . 2 1 1 A 75 75 GLU HA H 164 4.636 4.488 0.148 1
1 918 . 2 1 1 A 75 75 GLU CA C 164 53.699 55.021 -1.322 1
1 919 . 2 1 1 A 75 75 GLU CB C 164 29.550 28.459 1.091 1
1 921 . 2 1 1 A 75 75 GLU N N 164 120.076 119.044 1.032 1
1 922 . 2 1 1 A 76 76 PRO HA H 165 4.272 4.615 -0.343 1
1 929 . 2 1 1 A 76 76 PRO C C 165 176.649 176.915 -0.266 1
1 930 . 2 1 1 A 76 76 PRO CA C 165 63.204 62.990 0.214 1
1 931 . 2 1 1 A 76 76 PRO CB C 165 31.680 31.560 0.120 1
1 934 . 2 1 1 A 77 77 ILE H H 166 8.812 8.226 0.586 1
1 935 . 2 1 1 A 77 77 ILE HA H 166 3.838 4.287 -0.449 1
1 945 . 2 1 1 A 77 77 ILE C C 166 175.235 175.457 -0.222 1
1 946 . 2 1 1 A 77 77 ILE CA C 166 62.816 61.001 1.815 1
1 947 . 2 1 1 A 77 77 ILE CB C 166 37.750 36.503 1.247 1
1 951 . 2 1 1 A 77 77 ILE N N 166 123.831 124.147 -0.316 1
1 952 . 2 1 1 A 78 78 THR H H 167 6.625 8.557 -1.932 1
1 953 . 2 1 1 A 78 78 THR HA H 167 4.632 4.947 -0.315 1
1 958 . 2 1 1 A 78 78 THR C C 167 174.143 175.205 -1.062 1
1 959 . 2 1 1 A 78 78 THR CA C 167 58.750 59.626 -0.876 1
1 960 . 2 1 1 A 78 78 THR CB C 167 71.320 71.259 0.061 1
1 962 . 2 1 1 A 78 78 THR N N 167 115.293 120.757 -5.464 1
1 963 . 2 1 1 A 79 79 ALA H H 168 9.088 9.110 -0.022 1
1 964 . 2 1 1 A 79 79 ALA HA H 168 3.916 4.089 -0.173 1
1 968 . 2 1 1 A 79 79 ALA C C 168 179.770 179.555 0.215 1
1 969 . 2 1 1 A 79 79 ALA CA C 168 55.480 55.262 0.218 1
1 970 . 2 1 1 A 79 79 ALA CB C 168 17.630 18.336 -0.706 1
1 971 . 2 1 1 A 79 79 ALA N N 168 122.102 127.540 -5.438 1
1 972 . 2 1 1 A 80 80 SER H H 169 7.988 7.648 0.340 1
1 973 . 2 1 1 A 80 80 SER HA H 169 4.091 4.181 -0.090 1
1 976 . 2 1 1 A 80 80 SER C C 169 175.836 176.512 -0.676 1
1 977 . 2 1 1 A 80 80 SER CA C 169 60.750 61.444 -0.694 1
1 978 . 2 1 1 A 80 80 SER CB C 169 62.510 63.073 -0.563 1
1 979 . 2 1 1 A 80 80 SER N N 169 109.660 113.423 -3.763 1
1 980 . 2 1 1 A 81 81 ILE H H 170 7.052 7.686 -0.634 1
1 981 . 2 1 1 A 81 81 ILE HA H 170 4.344 4.125 0.219 1
1 991 . 2 1 1 A 81 81 ILE C C 170 174.236 176.455 -2.219 1
1 992 . 2 1 1 A 81 81 ILE CA C 170 61.760 63.709 -1.949 1
1 993 . 2 1 1 A 81 81 ILE CB C 170 37.950 37.702 0.248 1
1 997 . 2 1 1 A 81 81 ILE N N 170 112.623 114.292 -1.669 1
1 998 . 2 1 1 A 82 82 ILE H H 171 7.345 7.584 -0.239 1
1 999 . 2 1 1 A 82 82 ILE HA H 171 4.288 4.010 0.278 1
1 1009 . 2 1 1 A 82 82 ILE C C 171 174.931 175.315 -0.384 1
1 1010 . 2 1 1 A 82 82 ILE CA C 171 61.420 61.710 -0.290 1
1 1011 . 2 1 1 A 82 82 ILE CB C 171 37.230 37.818 -0.588 1
1 1015 . 2 1 1 A 82 82 ILE N N 171 124.260 125.330 -1.070 1
1 1016 . 2 1 1 A 83 83 VAL H H 172 7.843 8.681 -0.838 1
1 1017 . 2 1 1 A 83 83 VAL HA H 172 4.818 5.057 -0.239 1
1 1025 . 2 1 1 A 83 83 VAL C C 172 174.918 175.905 -0.987 1
1 1026 . 2 1 1 A 83 83 VAL CA C 172 58.910 59.308 -0.398 1
1 1027 . 2 1 1 A 83 83 VAL CB C 172 34.570 34.796 -0.226 1
1 1030 . 2 1 1 A 83 83 VAL N N 172 118.856 122.296 -3.440 1
1 1031 . 2 1 1 A 84 84 LYS H H 173 8.347 8.755 -0.408 1
1 1032 . 2 1 1 A 84 84 LYS HA H 173 4.356 4.555 -0.199 1
1 1041 . 2 1 1 A 84 84 LYS C C 173 178.653 178.442 0.211 1
1 1042 . 2 1 1 A 84 84 LYS CA C 173 56.360 55.606 0.754 1
1 1043 . 2 1 1 A 84 84 LYS CB C 173 33.366 33.426 -0.060 1
1 1047 . 2 1 1 A 84 84 LYS N N 173 119.602 121.823 -2.221 1
1 1048 . 2 1 1 A 85 85 HIS H H 174 9.143 8.948 0.195 1
1 1049 . 2 1 1 A 85 85 HIS HA H 174 4.013 4.351 -0.338 1
1 1053 . 2 1 1 A 85 85 HIS C C 174 176.606 177.170 -0.564 1
1 1054 . 2 1 1 A 85 85 HIS CA C 174 58.820 59.640 -0.820 1
1 1055 . 2 1 1 A 85 85 HIS CB C 174 28.186 29.901 -1.715 1
1 1057 . 2 1 1 A 85 85 HIS N N 174 120.022 122.642 -2.620 1
1 1058 . 2 1 1 A 86 86 GLU H H 175 8.403 7.971 0.432 1
1 1059 . 2 1 1 A 86 86 GLU HA H 175 3.863 4.007 -0.144 1
1 1064 . 2 1 1 A 86 86 GLU C C 175 177.040 179.073 -2.033 1
1 1065 . 2 1 1 A 86 86 GLU CA C 175 57.830 59.332 -1.502 1
1 1066 . 2 1 1 A 86 86 GLU CB C 175 28.690 29.546 -0.856 1
1 1068 . 2 1 1 A 86 86 GLU N N 175 116.124 118.837 -2.713 1
1 1069 . 2 1 1 A 87 87 GLU H H 176 7.669 8.110 -0.441 1
1 1070 . 2 1 1 A 87 87 GLU HA H 176 4.039 3.874 0.165 1
1 1075 . 2 1 1 A 87 87 GLU C C 176 175.688 177.182 -1.494 1
1 1076 . 2 1 1 A 87 87 GLU CA C 176 57.906 59.668 -1.762 1
1 1077 . 2 1 1 A 87 87 GLU CB C 176 30.430 29.512 0.918 1
1 1079 . 2 1 1 A 87 87 GLU N N 176 116.183 118.366 -2.183 1
1 1080 . 2 1 1 A 88 88 CYS H H 177 6.750 7.720 -0.970 1
1 1081 . 2 1 1 A 88 88 CYS HA H 177 4.991 4.550 0.441 1
1 1084 . 2 1 1 A 88 88 CYS C C 177 172.325 173.429 -1.104 1
1 1085 . 2 1 1 A 88 88 CYS CA C 177 55.030 54.236 0.794 1
1 1086 . 2 1 1 A 88 88 CYS CB C 177 45.610 41.936 3.674 1
1 1087 . 2 1 1 A 88 88 CYS N N 177 114.838 116.062 -1.224 1
1 1088 . 2 1 1 A 89 89 ILE H H 178 9.128 8.809 0.319 1
1 1089 . 2 1 1 A 89 89 ILE HA H 178 4.536 4.936 -0.400 1
1 1099 . 2 1 1 A 89 89 ILE C C 178 174.893 174.451 0.442 1
1 1100 . 2 1 1 A 89 89 ILE CA C 178 59.160 59.523 -0.363 1
1 1101 . 2 1 1 A 89 89 ILE CB C 178 41.840 40.533 1.307 1
1 1105 . 2 1 1 A 89 89 ILE N N 178 120.564 121.119 -0.555 1
1 1106 . 2 1 1 A 90 90 TYR H H 179 9.349 9.088 0.261 1
1 1107 . 2 1 1 A 90 90 TYR HA H 179 3.568 4.200 -0.632 1
1 1112 . 2 1 1 A 90 90 TYR C C 179 173.950 173.860 0.090 1
1 1113 . 2 1 1 A 90 90 TYR CA C 179 61.180 58.188 2.992 1
1 1114 . 2 1 1 A 90 90 TYR CB C 179 37.530 38.401 -0.871 1
1 1116 . 2 1 1 A 90 90 TYR N N 179 129.033 127.351 1.682 1
1 1117 . 2 1 1 A 91 91 ASP H H 180 7.367 8.253 -0.886 1
1 1118 . 2 1 1 A 91 91 ASP HA H 180 4.662 4.544 0.118 1
1 1121 . 2 1 1 A 91 91 ASP C C 180 175.291 175.358 -0.067 1
1 1122 . 2 1 1 A 91 91 ASP CA C 180 52.230 52.202 0.028 1
1 1123 . 2 1 1 A 91 91 ASP CB C 180 43.650 41.689 1.961 1
1 1124 . 2 1 1 A 91 91 ASP N N 180 129.305 128.543 0.762 1
1 1125 . 2 1 1 A 92 92 ASP H H 181 8.783 8.630 0.153 1
1 1126 . 2 1 1 A 92 92 ASP HA H 181 4.114 3.716 0.398 1
1 1129 . 2 1 1 A 92 92 ASP C C 181 177.573 177.536 0.037 1
1 1130 . 2 1 1 A 92 92 ASP CA C 181 56.390 56.565 -0.175 1
1 1131 . 2 1 1 A 92 92 ASP CB C 181 41.330 40.299 1.031 1
1 1132 . 2 1 1 A 92 92 ASP N N 181 125.665 127.788 -2.123 1
1 1133 . 2 1 1 A 93 93 THR H H 182 8.284 7.850 0.434 1
1 1134 . 2 1 1 A 93 93 THR HA H 182 4.037 3.819 0.218 1
1 1139 . 2 1 1 A 93 93 THR C C 182 176.333 176.223 0.110 1
1 1140 . 2 1 1 A 93 93 THR CA C 182 65.320 66.893 -1.573 1
1 1141 . 2 1 1 A 93 93 THR CB C 182 68.560 68.274 0.286 1
1 1143 . 2 1 1 A 93 93 THR N N 182 114.688 116.118 -1.430 1
1 1144 . 2 1 1 A 94 94 ARG H H 183 7.784 7.435 0.349 1
1 1145 . 2 1 1 A 94 94 ARG HA H 183 4.142 4.230 -0.088 1
1 1152 . 2 1 1 A 94 94 ARG C C 183 177.015 176.887 0.128 1
1 1153 . 2 1 1 A 94 94 ARG CA C 183 55.350 56.107 -0.757 1
1 1154 . 2 1 1 A 94 94 ARG CB C 183 30.930 30.866 0.064 1
1 1157 . 2 1 1 A 94 94 ARG N N 183 120.156 118.392 1.764 1
1 1158 . 2 1 1 A 95 95 GLY H H 184 8.144 9.000 -0.856 1
1 1159 . 2 1 1 A 95 95 GLY HA2 H 184 3.839 3.812 0.027 1
1 1160 . 2 1 1 A 95 95 GLY HA3 H 184 3.681 3.850 -0.169 1
1 1161 . 2 1 1 A 95 95 GLY C C 184 173.653 173.303 0.350 1
1 1162 . 2 1 1 A 95 95 GLY CA C 184 46.160 45.781 0.379 1
1 1163 . 2 1 1 A 95 95 GLY N N 184 107.879 109.229 -1.350 1
1 1164 . 2 1 1 A 96 96 ASN H H 185 6.855 7.228 -0.373 1
1 1165 . 2 1 1 A 96 96 ASN HA H 185 4.909 5.012 -0.103 1
1 1170 . 2 1 1 A 96 96 ASN C C 185 174.223 173.364 0.859 1
1 1171 . 2 1 1 A 96 96 ASN CA C 185 52.720 52.274 0.446 1
1 1172 . 2 1 1 A 96 96 ASN CB C 185 45.620 41.485 4.135 1
1 1173 . 2 1 1 A 96 96 ASN N N 185 113.382 116.773 -3.391 1
1 1175 . 2 1 1 A 97 97 PHE H H 186 9.228 8.575 0.653 1
1 1176 . 2 1 1 A 97 97 PHE HA H 186 4.579 4.744 -0.165 1
1 1183 . 2 1 1 A 97 97 PHE C C 186 174.794 175.769 -0.975 1
1 1184 . 2 1 1 A 97 97 PHE CA C 186 59.384 59.199 0.185 1
1 1185 . 2 1 1 A 97 97 PHE CB C 186 40.450 39.362 1.088 1
1 1188 . 2 1 1 A 97 97 PHE N N 186 118.661 119.326 -0.665 1
1 1189 . 2 1 1 A 98 98 ILE H H 187 8.908 9.053 -0.145 1
1 1190 . 2 1 1 A 98 98 ILE HA H 187 5.440 4.895 0.545 1
1 1200 . 2 1 1 A 98 98 ILE C C 187 176.171 174.655 1.516 1
1 1201 . 2 1 1 A 98 98 ILE CA C 187 57.610 59.667 -2.057 1
1 1202 . 2 1 1 A 98 98 ILE CB C 187 41.280 40.791 0.489 1
1 1206 . 2 1 1 A 98 98 ILE N N 187 120.585 123.406 -2.821 1
1 1207 . 2 1 1 A 99 99 ILE H H 188 8.602 8.434 0.168 1
1 1208 . 2 1 1 A 99 99 ILE HA H 188 4.546 4.633 -0.087 1
1 1218 . 2 1 1 A 99 99 ILE C C 188 176.668 175.037 1.631 1
1 1219 . 2 1 1 A 99 99 ILE CA C 188 58.920 60.576 -1.656 1
1 1220 . 2 1 1 A 99 99 ILE CB C 188 37.960 38.425 -0.465 1
1 1224 . 2 1 1 A 99 99 ILE N N 188 124.500 125.586 -1.086 1
1 1225 . 2 1 1 A 100 100 LYS H H 189 8.449 8.506 -0.057 1
1 1226 . 2 1 1 A 100 100 LYS HA H 189 4.108 4.687 -0.579 1
1 1235 . 2 1 1 A 100 100 LYS C C 189 176.866 176.501 0.365 1
1 1236 . 2 1 1 A 100 100 LYS CA C 189 56.800 55.123 1.677 1
1 1237 . 2 1 1 A 100 100 LYS CB C 189 33.400 33.448 -0.048 1
1 1241 . 2 1 1 A 100 100 LYS N N 189 128.581 126.816 1.765 1
1 1242 . 2 1 1 A 101 101 GLY H H 190 8.381 8.820 -0.439 1
1 1243 . 2 1 1 A 101 101 GLY HA2 H 190 3.946 3.924 0.022 1
1 1244 . 2 1 1 A 101 101 GLY HA3 H 190 3.828 3.925 -0.097 1
1 1245 . 2 1 1 A 101 101 GLY C C 190 172.902 173.879 -0.977 1
1 1246 . 2 1 1 A 101 101 GLY CA C 190 44.920 45.468 -0.548 1
1 1247 . 2 1 1 A 101 101 GLY N N 190 111.183 113.840 -2.657 1
1 7 . 3 1 1 A 2 2 GLN H H 91 8.786 8.792 -0.006 1
1 8 . 3 1 1 A 2 2 GLN HA H 91 4.005 3.954 0.051 1
1 15 . 3 1 1 A 2 2 GLN C C 91 177.270 177.349 -0.079 1
1 16 . 3 1 1 A 2 2 GLN CA C 91 58.220 59.292 -1.072 1
1 17 . 3 1 1 A 2 2 GLN CB C 91 28.650 28.478 0.172 1
1 19 . 3 1 1 A 2 2 GLN N N 91 121.993 124.273 -2.280 1
1 21 . 3 1 1 A 3 3 GLU H H 92 8.430 8.406 0.024 1
1 22 . 3 1 1 A 3 3 GLU HA H 92 4.007 4.081 -0.074 1
1 27 . 3 1 1 A 3 3 GLU C C 92 178.287 179.084 -0.797 1
1 28 . 3 1 1 A 3 3 GLU CA C 92 59.490 59.725 -0.235 1
1 29 . 3 1 1 A 3 3 GLU CB C 92 29.506 29.411 0.095 1
1 31 . 3 1 1 A 3 3 GLU N N 92 120.195 119.924 0.271 1
1 32 . 3 1 1 A 4 4 SER H H 93 8.209 8.042 0.167 1
1 33 . 3 1 1 A 4 4 SER HA H 93 4.272 4.241 0.031 1
1 36 . 3 1 1 A 4 4 SER C C 93 177.369 176.817 0.552 1
1 37 . 3 1 1 A 4 4 SER CA C 93 61.044 62.052 -1.008 1
1 38 . 3 1 1 A 4 4 SER CB C 93 62.950 62.858 0.092 1
1 39 . 3 1 1 A 4 4 SER N N 93 115.524 116.415 -0.891 1
1 40 . 3 1 1 A 5 5 ILE H H 94 8.080 7.769 0.311 1
1 41 . 3 1 1 A 5 5 ILE HA H 94 3.530 3.672 -0.142 1
1 51 . 3 1 1 A 5 5 ILE C C 94 177.778 177.514 0.264 1
1 52 . 3 1 1 A 5 5 ILE CA C 94 65.710 65.252 0.458 1
1 53 . 3 1 1 A 5 5 ILE CB C 94 37.800 37.126 0.674 1
1 57 . 3 1 1 A 5 5 ILE N N 94 124.148 121.796 2.352 1
1 58 . 3 1 1 A 6 6 GLN H H 95 8.374 8.332 0.042 1
1 59 . 3 1 1 A 6 6 GLN HA H 95 4.125 3.938 0.187 1
1 66 . 3 1 1 A 6 6 GLN C C 95 179.726 179.320 0.406 1
1 67 . 3 1 1 A 6 6 GLN CA C 95 59.190 58.993 0.197 1
1 68 . 3 1 1 A 6 6 GLN CB C 95 27.060 28.644 -1.584 1
1 70 . 3 1 1 A 6 6 GLN N N 95 118.257 119.074 -0.817 1
1 72 . 3 1 1 A 7 7 ASN H H 96 8.456 8.143 0.313 1
1 73 . 3 1 1 A 7 7 ASN HA H 96 4.446 4.531 -0.085 1
1 78 . 3 1 1 A 7 7 ASN C C 96 177.257 177.775 -0.518 1
1 79 . 3 1 1 A 7 7 ASN CA C 96 56.020 56.279 -0.259 1
1 80 . 3 1 1 A 7 7 ASN CB C 96 38.126 37.809 0.317 1
1 81 . 3 1 1 A 7 7 ASN N N 96 118.597 118.423 0.174 1
1 83 . 3 1 1 A 8 8 LYS H H 97 7.732 7.828 -0.096 1
1 84 . 3 1 1 A 8 8 LYS HA H 97 4.129 4.064 0.065 1
1 93 . 3 1 1 A 8 8 LYS C C 97 179.143 179.423 -0.280 1
1 94 . 3 1 1 A 8 8 LYS CA C 97 59.126 59.950 -0.824 1
1 95 . 3 1 1 A 8 8 LYS CB C 97 32.070 32.559 -0.489 1
1 99 . 3 1 1 A 8 8 LYS N N 97 122.381 120.416 1.965 1
1 100 . 3 1 1 A 9 9 ILE H H 98 8.452 8.049 0.403 1
1 101 . 3 1 1 A 9 9 ILE HA H 98 3.480 3.918 -0.438 1
1 111 . 3 1 1 A 9 9 ILE C C 98 177.406 178.825 -1.419 1
1 112 . 3 1 1 A 9 9 ILE CA C 98 66.430 64.646 1.784 1
1 113 . 3 1 1 A 9 9 ILE CB C 98 37.980 37.024 0.956 1
1 117 . 3 1 1 A 9 9 ILE N N 98 119.950 120.281 -0.331 1
1 118 . 3 1 1 A 10 10 SER H H 99 7.924 7.882 0.042 1
1 119 . 3 1 1 A 10 10 SER HA H 99 3.983 4.332 -0.349 1
1 122 . 3 1 1 A 10 10 SER C C 99 176.327 176.056 0.271 1
1 123 . 3 1 1 A 10 10 SER CA C 99 61.990 60.956 1.034 1
1 124 . 3 1 1 A 10 10 SER CB C 99 62.790 63.421 -0.631 1
1 125 . 3 1 1 A 10 10 SER N N 99 113.568 117.375 -3.807 1
1 126 . 3 1 1 A 11 11 GLN H H 100 7.832 7.968 -0.136 1
1 127 . 3 1 1 A 11 11 GLN HA H 100 4.238 4.220 0.018 1
1 134 . 3 1 1 A 11 11 GLN C C 100 178.088 177.837 0.251 1
1 135 . 3 1 1 A 11 11 GLN CA C 100 57.900 58.607 -0.707 1
1 136 . 3 1 1 A 11 11 GLN CB C 100 29.790 29.051 0.739 1
1 138 . 3 1 1 A 11 11 GLN N N 100 117.487 118.276 -0.789 1
1 140 . 3 1 1 A 12 12 CYS H H 101 7.920 8.275 -0.355 1
1 141 . 3 1 1 A 12 12 CYS HA H 101 4.657 4.535 0.122 1
1 144 . 3 1 1 A 12 12 CYS C C 101 175.439 174.837 0.602 1
1 145 . 3 1 1 A 12 12 CYS CA C 101 60.654 59.754 0.900 1
1 146 . 3 1 1 A 12 12 CYS CB C 101 29.310 27.265 2.045 1
1 147 . 3 1 1 A 12 12 CYS N N 101 114.221 116.981 -2.760 1
1 148 . 3 1 1 A 13 13 LYS H H 102 7.993 7.428 0.565 1
1 149 . 3 1 1 A 13 13 LYS HA H 102 5.038 4.669 0.369 1
1 158 . 3 1 1 A 13 13 LYS C C 102 174.757 176.256 -1.499 1
1 159 . 3 1 1 A 13 13 LYS CA C 102 56.660 56.042 0.618 1
1 160 . 3 1 1 A 13 13 LYS CB C 102 32.970 33.448 -0.478 1
1 164 . 3 1 1 A 13 13 LYS N N 102 123.841 119.860 3.981 1
1 165 . 3 1 1 A 14 14 PHE H H 103 8.822 8.568 0.254 1
1 166 . 3 1 1 A 14 14 PHE HA H 103 5.058 5.114 -0.056 1
1 174 . 3 1 1 A 14 14 PHE C C 103 173.560 173.473 0.087 1
1 175 . 3 1 1 A 14 14 PHE CA C 103 55.470 56.047 -0.577 1
1 176 . 3 1 1 A 14 14 PHE CB C 103 41.760 40.636 1.124 1
1 180 . 3 1 1 A 14 14 PHE N N 103 118.421 116.508 1.913 1
1 181 . 3 1 1 A 15 15 SER H H 104 8.826 8.496 0.330 1
1 182 . 3 1 1 A 15 15 SER HA H 104 4.602 4.860 -0.258 1
1 185 . 3 1 1 A 15 15 SER C C 104 173.851 173.683 0.168 1
1 186 . 3 1 1 A 15 15 SER CA C 104 58.610 57.783 0.827 1
1 187 . 3 1 1 A 15 15 SER CB C 104 62.690 62.600 0.090 1
1 188 . 3 1 1 A 15 15 SER N N 104 117.781 115.053 2.728 1
1 189 . 3 1 1 A 16 16 VAL H H 105 7.839 8.108 -0.269 1
1 190 . 3 1 1 A 16 16 VAL HA H 105 3.390 4.337 -0.947 1
1 198 . 3 1 1 A 16 16 VAL C C 105 174.987 175.428 -0.441 1
1 199 . 3 1 1 A 16 16 VAL CA C 105 63.650 62.398 1.252 1
1 200 . 3 1 1 A 16 16 VAL CB C 105 31.410 30.355 1.055 1
1 203 . 3 1 1 A 16 16 VAL N N 105 129.036 126.011 3.025 1
1 204 . 3 1 1 A 17 17 CYS H H 106 8.536 7.981 0.555 1
1 205 . 3 1 1 A 17 17 CYS HA H 106 5.011 4.933 0.078 1
1 208 . 3 1 1 A 17 17 CYS CA C 106 55.260 56.641 -1.381 1
1 209 . 3 1 1 A 17 17 CYS CB C 106 28.210 30.676 -2.466 1
1 210 . 3 1 1 A 17 17 CYS N N 106 130.045 126.964 3.081 1
1 211 . 3 1 1 A 18 18 PRO HA H 107 3.991 4.439 -0.448 1
1 218 . 3 1 1 A 18 18 PRO C C 107 178.188 178.407 -0.219 1
1 219 . 3 1 1 A 18 18 PRO CA C 107 65.940 65.052 0.888 1
1 220 . 3 1 1 A 18 18 PRO CB C 107 32.000 31.927 0.073 1
1 223 . 3 1 1 A 19 19 GLU H H 108 9.260 9.154 0.106 1
1 224 . 3 1 1 A 19 19 GLU HA H 108 4.119 4.146 -0.027 1
1 229 . 3 1 1 A 19 19 GLU C C 108 178.721 178.904 -0.183 1
1 230 . 3 1 1 A 19 19 GLU CA C 108 59.300 58.678 0.622 1
1 231 . 3 1 1 A 19 19 GLU CB C 108 28.920 28.074 0.846 1
1 233 . 3 1 1 A 19 19 GLU N N 108 118.270 116.479 1.791 1
1 234 . 3 1 1 A 20 20 ARG H H 109 7.672 7.704 -0.032 1
1 235 . 3 1 1 A 20 20 ARG HA H 109 4.331 4.180 0.151 1
1 242 . 3 1 1 A 20 20 ARG C C 109 177.977 178.184 -0.207 1
1 243 . 3 1 1 A 20 20 ARG CA C 109 57.350 58.651 -1.301 1
1 244 . 3 1 1 A 20 20 ARG CB C 109 30.820 30.950 -0.130 1
1 247 . 3 1 1 A 20 20 ARG N N 109 118.357 119.297 -0.940 1
1 248 . 3 1 1 A 21 21 LEU H H 110 7.601 7.889 -0.288 1
1 249 . 3 1 1 A 21 21 LEU HA H 110 4.380 4.402 -0.022 1
1 259 . 3 1 1 A 21 21 LEU C C 110 176.562 176.258 0.304 1
1 260 . 3 1 1 A 21 21 LEU CA C 110 56.096 55.290 0.806 1
1 261 . 3 1 1 A 21 21 LEU CB C 110 44.016 42.277 1.739 1
1 265 . 3 1 1 A 21 21 LEU N N 110 118.626 117.751 0.875 1
1 266 . 3 1 1 A 22 22 GLN H H 111 7.750 7.675 0.075 1
1 267 . 3 1 1 A 22 22 GLN HA H 111 3.870 3.976 -0.106 1
1 274 . 3 1 1 A 22 22 GLN C C 111 173.336 174.113 -0.777 1
1 275 . 3 1 1 A 22 22 GLN CA C 111 56.510 57.388 -0.878 1
1 276 . 3 1 1 A 22 22 GLN CB C 111 26.800 26.641 0.159 1
1 278 . 3 1 1 A 22 22 GLN N N 111 113.926 115.915 -1.989 1
1 280 . 3 1 1 A 23 23 CYS H H 112 7.407 7.448 -0.041 1
1 281 . 3 1 1 A 23 23 CYS HA H 112 4.469 5.030 -0.561 1
1 284 . 3 1 1 A 23 23 CYS CA C 112 52.650 56.587 -3.937 1
1 285 . 3 1 1 A 23 23 CYS CB C 112 29.750 29.723 0.027 1
1 286 . 3 1 1 A 23 23 CYS N N 112 112.681 117.416 -4.735 1
1 287 . 3 1 1 A 24 24 PRO HA H 113 4.408 4.475 -0.067 1
1 294 . 3 1 1 A 24 24 PRO C C 113 178.175 177.476 0.699 1
1 295 . 3 1 1 A 24 24 PRO CA C 113 62.040 62.484 -0.444 1
1 296 . 3 1 1 A 24 24 PRO CB C 113 31.920 32.840 -0.920 1
1 299 . 3 1 1 A 25 25 LEU H H 114 8.593 8.793 -0.200 1
1 300 . 3 1 1 A 25 25 LEU HA H 114 3.765 4.052 -0.287 1
1 310 . 3 1 1 A 25 25 LEU C C 114 179.950 178.559 1.391 1
1 311 . 3 1 1 A 25 25 LEU CA C 114 57.674 57.895 -0.221 1
1 312 . 3 1 1 A 25 25 LEU CB C 114 40.690 41.487 -0.797 1
1 316 . 3 1 1 A 25 25 LEU N N 114 123.729 123.793 -0.064 1
1 317 . 3 1 1 A 26 26 GLU H H 115 9.108 8.220 0.888 1
1 318 . 3 1 1 A 26 26 GLU HA H 115 3.876 3.976 -0.100 1
1 323 . 3 1 1 A 26 26 GLU C C 115 177.505 179.333 -1.828 1
1 324 . 3 1 1 A 26 26 GLU CA C 115 59.410 59.537 -0.127 1
1 325 . 3 1 1 A 26 26 GLU CB C 115 28.460 29.120 -0.660 1
1 327 . 3 1 1 A 26 26 GLU N N 115 116.817 117.828 -1.011 1
1 328 . 3 1 1 A 27 27 ALA H H 116 7.360 7.609 -0.249 1
1 329 . 3 1 1 A 27 27 ALA HA H 116 4.408 3.813 0.595 1
1 333 . 3 1 1 A 27 27 ALA C C 116 177.046 178.187 -1.141 1
1 334 . 3 1 1 A 27 27 ALA CA C 116 52.970 54.539 -1.569 1
1 335 . 3 1 1 A 27 27 ALA CB C 116 19.916 17.869 2.047 1
1 336 . 3 1 1 A 27 27 ALA N N 116 118.966 121.071 -2.105 1
1 337 . 3 1 1 A 28 28 ILE H H 117 7.168 7.218 -0.050 1
1 338 . 3 1 1 A 28 28 ILE HA H 117 4.432 4.802 -0.370 1
1 348 . 3 1 1 A 28 28 ILE C C 117 172.641 175.506 -2.865 1
1 349 . 3 1 1 A 28 28 ILE CA C 117 59.980 60.199 -0.219 1
1 350 . 3 1 1 A 28 28 ILE CB C 117 37.350 37.857 -0.507 1
1 354 . 3 1 1 A 28 28 ILE N N 117 108.913 109.027 -0.114 1
1 355 . 3 1 1 A 29 29 GLN H H 118 6.562 7.316 -0.754 1
1 356 . 3 1 1 A 29 29 GLN HA H 118 3.922 4.181 -0.259 1
1 363 . 3 1 1 A 29 29 GLN C C 118 175.049 175.613 -0.564 1
1 364 . 3 1 1 A 29 29 GLN CA C 118 54.596 55.936 -1.340 1
1 365 . 3 1 1 A 29 29 GLN CB C 118 29.570 29.156 0.414 1
1 367 . 3 1 1 A 29 29 GLN N N 118 116.455 123.254 -6.799 1
1 369 . 3 1 1 A 30 30 CYS H H 119 8.138 8.371 -0.233 1
1 370 . 3 1 1 A 30 30 CYS HA H 119 4.580 4.529 0.051 1
1 373 . 3 1 1 A 30 30 CYS CA C 119 57.810 57.577 0.233 1
1 374 . 3 1 1 A 30 30 CYS CB C 119 30.200 28.756 1.444 1
1 375 . 3 1 1 A 30 30 CYS N N 119 134.136 125.270 8.866 1
1 376 . 3 1 1 A 31 31 PRO HA H 120 4.424 4.294 0.130 1
1 383 . 3 1 1 A 31 31 PRO C C 120 177.431 179.135 -1.704 1
1 384 . 3 1 1 A 31 31 PRO CA C 120 64.060 65.159 -1.099 1
1 385 . 3 1 1 A 31 31 PRO CB C 120 32.776 32.117 0.659 1
1 388 . 3 1 1 A 32 32 ILE H H 121 11.318 7.659 3.659 1
1 389 . 3 1 1 A 32 32 ILE HA H 121 4.038 3.933 0.105 1
1 399 . 3 1 1 A 32 32 ILE C C 121 178.485 177.288 1.197 1
1 400 . 3 1 1 A 32 32 ILE CA C 121 64.060 64.189 -0.129 1
1 401 . 3 1 1 A 32 32 ILE CB C 121 39.340 38.152 1.188 1
1 405 . 3 1 1 A 32 32 ILE N N 121 124.500 116.742 7.758 1
1 406 . 3 1 1 A 33 33 THR H H 122 9.928 7.314 2.614 1
1 407 . 3 1 1 A 33 33 THR HA H 122 4.048 4.461 -0.413 1
1 412 . 3 1 1 A 33 33 THR C C 122 175.793 174.586 1.207 1
1 413 . 3 1 1 A 33 33 THR CA C 122 62.990 61.514 1.476 1
1 414 . 3 1 1 A 33 33 THR CB C 122 70.300 69.052 1.248 1
1 416 . 3 1 1 A 33 33 THR N N 122 115.136 108.633 6.503 1
1 417 . 3 1 1 A 34 34 LEU H H 123 8.439 7.772 0.667 1
1 418 . 3 1 1 A 34 34 LEU HA H 123 3.912 3.996 -0.084 1
1 428 . 3 1 1 A 34 34 LEU C C 123 175.495 175.540 -0.045 1
1 429 . 3 1 1 A 34 34 LEU CA C 123 56.290 55.723 0.567 1
1 430 . 3 1 1 A 34 34 LEU CB C 123 38.500 39.726 -1.226 1
1 434 . 3 1 1 A 34 34 LEU N N 123 117.230 121.217 -3.987 1
1 435 . 3 1 1 A 35 35 GLU H H 124 7.816 6.985 0.831 1
1 436 . 3 1 1 A 35 35 GLU HA H 124 4.634 4.598 0.036 1
1 441 . 3 1 1 A 35 35 GLU C C 124 174.838 174.009 0.829 1
1 442 . 3 1 1 A 35 35 GLU CA C 124 53.780 54.790 -1.010 1
1 443 . 3 1 1 A 35 35 GLU CB C 124 33.710 31.317 2.393 1
1 445 . 3 1 1 A 35 35 GLU N N 124 116.577 116.388 0.189 1
1 446 . 3 1 1 A 36 36 GLN H H 125 8.532 8.634 -0.102 1
1 447 . 3 1 1 A 36 36 GLN HA H 125 4.958 4.376 0.582 1
1 454 . 3 1 1 A 36 36 GLN CA C 125 53.350 53.901 -0.551 1
1 455 . 3 1 1 A 36 36 GLN CB C 125 29.950 29.918 0.032 1
1 457 . 3 1 1 A 36 36 GLN N N 125 123.034 121.447 1.587 1
1 459 . 3 1 1 A 37 37 PRO HA H 126 4.458 4.269 0.189 1
1 466 . 3 1 1 A 37 37 PRO C C 126 176.314 177.333 -1.019 1
1 467 . 3 1 1 A 37 37 PRO CA C 126 62.816 65.747 -2.931 1
1 468 . 3 1 1 A 37 37 PRO CB C 126 33.070 31.554 1.516 1
1 471 . 3 1 1 A 38 38 GLU H H 127 8.626 7.680 0.946 1
1 472 . 3 1 1 A 38 38 GLU HA H 127 4.274 4.486 -0.212 1
1 477 . 3 1 1 A 38 38 GLU C C 127 177.809 174.818 2.991 1
1 478 . 3 1 1 A 38 38 GLU CA C 127 58.730 58.289 0.441 1
1 479 . 3 1 1 A 38 38 GLU CB C 127 30.340 29.439 0.901 1
1 481 . 3 1 1 A 38 38 GLU N N 127 120.691 119.280 1.411 1
1 482 . 3 1 1 A 39 39 LYS H H 128 7.891 7.678 0.213 1
1 483 . 3 1 1 A 39 39 LYS HA H 128 4.870 4.901 -0.031 1
1 492 . 3 1 1 A 39 39 LYS C C 128 175.452 175.907 -0.455 1
1 493 . 3 1 1 A 39 39 LYS CA C 128 53.540 54.777 -1.237 1
1 494 . 3 1 1 A 39 39 LYS CB C 128 33.630 34.741 -1.111 1
1 498 . 3 1 1 A 39 39 LYS N N 128 118.149 118.209 -0.060 1
1 499 . 3 1 1 A 40 40 GLY H H 129 8.524 7.880 0.644 1
1 500 . 3 1 1 A 40 40 GLY HA2 H 129 4.973 4.083 0.890 1
1 501 . 3 1 1 A 40 40 GLY HA3 H 129 2.459 4.213 -1.754 1
1 502 . 3 1 1 A 40 40 GLY C C 129 169.943 171.901 -1.958 1
1 503 . 3 1 1 A 40 40 GLY CA C 129 42.910 45.185 -2.275 1
1 504 . 3 1 1 A 40 40 GLY N N 129 112.845 110.524 2.321 1
1 505 . 3 1 1 A 41 41 ILE H H 130 8.659 8.185 0.474 1
1 506 . 3 1 1 A 41 41 ILE HA H 130 4.591 4.838 -0.247 1
1 516 . 3 1 1 A 41 41 ILE C C 130 172.586 174.008 -1.422 1
1 517 . 3 1 1 A 41 41 ILE CA C 130 58.090 59.103 -1.013 1
1 518 . 3 1 1 A 41 41 ILE CB C 130 43.320 42.045 1.275 1
1 522 . 3 1 1 A 41 41 ILE N N 130 114.060 119.491 -5.431 1
1 523 . 3 1 1 A 42 42 PHE H H 131 9.206 8.769 0.437 1
1 524 . 3 1 1 A 42 42 PHE HA H 131 5.159 4.711 0.448 1
1 532 . 3 1 1 A 42 42 PHE C C 131 174.931 175.770 -0.839 1
1 533 . 3 1 1 A 42 42 PHE CA C 131 57.790 58.185 -0.395 1
1 534 . 3 1 1 A 42 42 PHE CB C 131 42.220 39.186 3.034 1
1 538 . 3 1 1 A 42 42 PHE N N 131 126.002 128.403 -2.401 1
1 539 . 3 1 1 A 43 43 VAL H H 132 8.502 8.876 -0.374 1
1 540 . 3 1 1 A 43 43 VAL HA H 132 4.921 4.653 0.268 1
1 548 . 3 1 1 A 43 43 VAL C C 132 178.219 175.463 2.756 1
1 549 . 3 1 1 A 43 43 VAL CA C 132 59.600 60.373 -0.773 1
1 550 . 3 1 1 A 43 43 VAL CB C 132 35.920 35.660 0.260 1
1 553 . 3 1 1 A 43 43 VAL N N 132 119.068 122.496 -3.428 1
1 554 . 3 1 1 A 44 44 LYS H H 133 10.036 8.818 1.218 1
1 555 . 3 1 1 A 44 44 LYS HA H 133 5.070 4.312 0.758 1
1 564 . 3 1 1 A 44 44 LYS C C 133 177.276 177.631 -0.355 1
1 565 . 3 1 1 A 44 44 LYS CA C 133 56.720 57.185 -0.465 1
1 566 . 3 1 1 A 44 44 LYS CB C 133 34.410 32.770 1.640 1
1 570 . 3 1 1 A 44 44 LYS N N 133 130.934 126.076 4.858 1
1 571 . 3 1 1 A 45 45 ASN H H 134 8.093 8.886 -0.793 1
1 572 . 3 1 1 A 45 45 ASN HA H 134 4.152 4.571 -0.419 1
1 577 . 3 1 1 A 45 45 ASN C C 134 174.087 174.635 -0.548 1
1 578 . 3 1 1 A 45 45 ASN CA C 134 55.360 55.651 -0.291 1
1 579 . 3 1 1 A 45 45 ASN CB C 134 37.530 39.157 -1.627 1
1 580 . 3 1 1 A 45 45 ASN N N 134 117.963 123.322 -5.359 1
1 582 . 3 1 1 A 46 46 SER H H 135 7.524 7.337 0.187 1
1 583 . 3 1 1 A 46 46 SER HA H 135 4.219 4.774 -0.555 1
1 586 . 3 1 1 A 46 46 SER C C 135 174.490 173.881 0.609 1
1 587 . 3 1 1 A 46 46 SER CA C 135 57.090 57.843 -0.753 1
1 588 . 3 1 1 A 46 46 SER CB C 135 63.860 65.162 -1.302 1
1 589 . 3 1 1 A 46 46 SER N N 135 105.939 111.209 -5.270 1
1 590 . 3 1 1 A 47 47 ASP H H 136 9.113 9.076 0.037 1
1 591 . 3 1 1 A 47 47 ASP HA H 136 4.220 4.274 -0.054 1
1 594 . 3 1 1 A 47 47 ASP CA C 136 57.610 57.261 0.349 1
1 595 . 3 1 1 A 47 47 ASP CB C 136 40.810 40.868 -0.058 1
1 596 . 3 1 1 A 47 47 ASP N N 136 120.995 126.517 -5.522 1
1 597 . 3 1 1 A 48 48 GLY H H 137 8.181 8.208 -0.027 1
1 598 . 3 1 1 A 48 48 GLY HA2 H 137 4.120 3.886 0.234 1
1 599 . 3 1 1 A 48 48 GLY HA3 H 137 3.659 3.887 -0.228 1
1 600 . 3 1 1 A 48 48 GLY C C 137 174.062 173.526 0.536 1
1 601 . 3 1 1 A 48 48 GLY CA C 137 45.130 45.668 -0.538 1
1 602 . 3 1 1 A 48 48 GLY N N 137 106.197 106.878 -0.681 1
1 603 . 3 1 1 A 49 49 SER H H 138 7.179 7.323 -0.144 1
1 604 . 3 1 1 A 49 49 SER HA H 138 4.383 4.895 -0.512 1
1 607 . 3 1 1 A 49 49 SER C C 138 173.864 173.384 0.480 1
1 608 . 3 1 1 A 49 49 SER CA C 138 57.614 57.140 0.474 1
1 609 . 3 1 1 A 49 49 SER CB C 138 65.100 67.156 -2.056 1
1 610 . 3 1 1 A 49 49 SER N N 138 115.015 114.514 0.501 1
1 611 . 3 1 1 A 50 50 ASP H H 139 8.078 8.479 -0.401 1
1 612 . 3 1 1 A 50 50 ASP HA H 139 4.642 4.915 -0.273 1
1 615 . 3 1 1 A 50 50 ASP C C 139 174.261 175.785 -1.524 1
1 616 . 3 1 1 A 50 50 ASP CA C 139 52.406 54.088 -1.682 1
1 617 . 3 1 1 A 50 50 ASP CB C 139 40.254 41.612 -1.358 1
1 618 . 3 1 1 A 50 50 ASP N N 139 122.400 120.575 1.825 1
1 619 . 3 1 1 A 51 51 VAL H H 140 8.111 7.460 0.651 1
1 620 . 3 1 1 A 51 51 VAL HA H 140 4.360 4.276 0.084 1
1 628 . 3 1 1 A 51 51 VAL C C 140 176.147 174.401 1.746 1
1 629 . 3 1 1 A 51 51 VAL CA C 140 62.670 61.723 0.947 1
1 630 . 3 1 1 A 51 51 VAL CB C 140 33.930 32.260 1.670 1
1 632 . 3 1 1 A 51 51 VAL N N 140 120.374 120.444 -0.070 1
1 633 . 3 1 1 A 52 52 CYS H H 141 8.358 9.169 -0.811 1
1 634 . 3 1 1 A 52 52 CYS HA H 141 4.957 5.445 -0.488 1
1 637 . 3 1 1 A 52 52 CYS C C 141 173.070 173.142 -0.072 1
1 638 . 3 1 1 A 52 52 CYS CA C 141 53.380 54.606 -1.226 1
1 639 . 3 1 1 A 52 52 CYS CB C 141 46.110 45.169 0.941 1
1 640 . 3 1 1 A 52 52 CYS N N 141 121.305 129.222 -7.917 1
1 641 . 3 1 1 A 53 53 THR H H 142 8.929 8.826 0.103 1
1 642 . 3 1 1 A 53 53 THR HA H 142 4.498 5.011 -0.513 1
1 648 . 3 1 1 A 53 53 THR C C 142 172.151 172.431 -0.280 1
1 649 . 3 1 1 A 53 53 THR CA C 142 62.960 61.332 1.628 1
1 650 . 3 1 1 A 53 53 THR CB C 142 70.540 72.911 -2.371 1
1 652 . 3 1 1 A 53 53 THR N N 142 120.105 119.510 0.595 1
1 653 . 3 1 1 A 54 54 LEU H H 143 8.448 8.850 -0.402 1
1 654 . 3 1 1 A 54 54 LEU HA H 143 4.322 4.803 -0.481 1
1 664 . 3 1 1 A 54 54 LEU C C 143 174.484 174.449 0.035 1
1 665 . 3 1 1 A 54 54 LEU CA C 143 54.596 53.513 1.083 1
1 666 . 3 1 1 A 54 54 LEU CB C 143 42.396 43.879 -1.483 1
1 670 . 3 1 1 A 54 54 LEU N N 143 128.819 128.973 -0.154 1
1 671 . 3 1 1 A 55 55 PHE H H 144 8.661 8.686 -0.025 1
1 672 . 3 1 1 A 55 55 PHE HA H 144 5.459 5.014 0.445 1
1 680 . 3 1 1 A 55 55 PHE C C 144 176.035 174.859 1.176 1
1 681 . 3 1 1 A 55 55 PHE CA C 144 55.020 56.640 -1.620 1
1 682 . 3 1 1 A 55 55 PHE CB C 144 44.100 42.413 1.687 1
1 686 . 3 1 1 A 55 55 PHE N N 144 121.897 126.281 -4.384 1
1 687 . 3 1 1 A 56 56 ASP H H 145 11.616 8.511 3.105 1
1 688 . 3 1 1 A 56 56 ASP HA H 145 4.417 4.647 -0.230 1
1 691 . 3 1 1 A 56 56 ASP C C 145 176.748 177.387 -0.639 1
1 692 . 3 1 1 A 56 56 ASP CA C 145 55.844 54.261 1.583 1
1 693 . 3 1 1 A 56 56 ASP CB C 145 44.390 43.183 1.207 1
1 694 . 3 1 1 A 56 56 ASP N N 145 122.131 122.068 0.063 1
1 695 . 3 1 1 A 57 57 ALA H H 146 8.508 9.088 -0.580 1
1 696 . 3 1 1 A 57 57 ALA HA H 146 3.797 4.046 -0.249 1
1 700 . 3 1 1 A 57 57 ALA C C 146 178.696 180.093 -1.397 1
1 701 . 3 1 1 A 57 57 ALA CA C 146 55.990 55.280 0.710 1
1 702 . 3 1 1 A 57 57 ALA CB C 146 18.840 18.122 0.718 1
1 703 . 3 1 1 A 57 57 ALA N N 146 130.243 128.527 1.716 1
1 704 . 3 1 1 A 58 58 ALA H H 147 8.378 8.021 0.357 1
1 705 . 3 1 1 A 58 58 ALA HA H 147 4.078 4.198 -0.120 1
1 709 . 3 1 1 A 58 58 ALA C C 147 181.091 179.150 1.941 1
1 710 . 3 1 1 A 58 58 ALA CA C 147 54.770 55.103 -0.333 1
1 711 . 3 1 1 A 58 58 ALA CB C 147 17.700 18.415 -0.715 1
1 712 . 3 1 1 A 58 58 ALA N N 147 121.997 119.805 2.192 1
1 713 . 3 1 1 A 59 59 ALA H H 148 9.138 8.008 1.130 1
1 714 . 3 1 1 A 59 59 ALA HA H 148 3.975 4.035 -0.060 1
1 718 . 3 1 1 A 59 59 ALA C C 148 180.508 179.757 0.751 1
1 719 . 3 1 1 A 59 59 ALA CA C 148 54.840 55.015 -0.175 1
1 720 . 3 1 1 A 59 59 ALA CB C 148 18.600 18.376 0.224 1
1 721 . 3 1 1 A 59 59 ALA N N 148 123.595 120.586 3.009 1
1 722 . 3 1 1 A 60 60 PHE H H 149 8.814 8.157 0.657 1
1 723 . 3 1 1 A 60 60 PHE HA H 149 3.722 4.061 -0.339 1
1 731 . 3 1 1 A 60 60 PHE C C 149 176.773 177.621 -0.848 1
1 732 . 3 1 1 A 60 60 PHE CA C 149 62.030 61.492 0.538 1
1 733 . 3 1 1 A 60 60 PHE CB C 149 39.960 38.816 1.144 1
1 737 . 3 1 1 A 60 60 PHE N N 149 120.354 119.819 0.535 1
1 738 . 3 1 1 A 61 61 SER H H 150 8.276 8.065 0.211 1
1 739 . 3 1 1 A 61 61 SER HA H 150 3.880 4.050 -0.170 1
1 742 . 3 1 1 A 61 61 SER C C 150 177.691 176.488 1.203 1
1 743 . 3 1 1 A 61 61 SER CA C 150 62.190 61.491 0.699 1
1 744 . 3 1 1 A 61 61 SER CB C 150 63.016 62.890 0.126 1
1 745 . 3 1 1 A 61 61 SER N N 150 112.086 114.239 -2.153 1
1 746 . 3 1 1 A 62 62 ARG H H 151 7.829 7.757 0.072 1
1 747 . 3 1 1 A 62 62 ARG HA H 151 3.971 4.038 -0.067 1
1 754 . 3 1 1 A 62 62 ARG C C 151 178.287 178.322 -0.035 1
1 755 . 3 1 1 A 62 62 ARG CA C 151 59.340 58.769 0.571 1
1 756 . 3 1 1 A 62 62 ARG CB C 151 29.760 30.146 -0.386 1
1 759 . 3 1 1 A 62 62 ARG N N 151 121.090 119.295 1.795 1
1 760 . 3 1 1 A 63 63 LEU H H 152 7.390 7.570 -0.180 1
1 761 . 3 1 1 A 63 63 LEU HA H 152 3.791 3.940 -0.149 1
1 771 . 3 1 1 A 63 63 LEU C C 152 179.106 178.169 0.937 1
1 772 . 3 1 1 A 63 63 LEU CA C 152 58.900 58.197 0.703 1
1 773 . 3 1 1 A 63 63 LEU CB C 152 41.140 41.276 -0.136 1
1 777 . 3 1 1 A 63 63 LEU N N 152 121.129 122.103 -0.974 1
1 778 . 3 1 1 A 64 64 VAL H H 153 7.552 7.992 -0.440 1
1 779 . 3 1 1 A 64 64 VAL HA H 153 3.411 3.457 -0.046 1
1 787 . 3 1 1 A 64 64 VAL C C 153 180.595 178.522 2.073 1
1 788 . 3 1 1 A 64 64 VAL CA C 153 65.644 66.083 -0.439 1
1 789 . 3 1 1 A 64 64 VAL CB C 153 31.410 31.352 0.058 1
1 792 . 3 1 1 A 64 64 VAL N N 153 118.280 118.918 -0.638 1
1 793 . 3 1 1 A 65 65 GLY H H 154 8.061 8.169 -0.108 1
1 794 . 3 1 1 A 65 65 GLY HA2 H 154 3.846 3.766 0.080 1
1 795 . 3 1 1 A 65 65 GLY HA3 H 154 3.809 3.767 0.042 1
1 796 . 3 1 1 A 65 65 GLY C C 154 175.235 176.639 -1.404 1
1 797 . 3 1 1 A 65 65 GLY CA C 154 46.630 46.908 -0.278 1
1 798 . 3 1 1 A 65 65 GLY N N 154 108.622 107.675 0.947 1
1 799 . 3 1 1 A 66 66 GLU H H 155 7.528 7.584 -0.056 1
1 800 . 3 1 1 A 66 66 GLU HA H 155 4.228 4.265 -0.037 1
1 805 . 3 1 1 A 66 66 GLU C C 155 176.761 177.107 -0.346 1
1 806 . 3 1 1 A 66 66 GLU CA C 155 56.590 56.559 0.031 1
1 807 . 3 1 1 A 66 66 GLU CB C 155 30.490 30.000 0.490 1
1 809 . 3 1 1 A 66 66 GLU N N 155 118.361 119.529 -1.168 1
1 810 . 3 1 1 A 67 67 GLY H H 156 7.884 7.696 0.188 1
1 811 . 3 1 1 A 67 67 GLY HA2 H 156 3.918 3.845 0.073 1
1 812 . 3 1 1 A 67 67 GLY HA3 H 156 3.747 3.860 -0.113 1
1 813 . 3 1 1 A 67 67 GLY C C 156 174.788 174.810 -0.022 1
1 814 . 3 1 1 A 67 67 GLY CA C 156 45.890 45.932 -0.042 1
1 815 . 3 1 1 A 67 67 GLY N N 156 108.465 108.553 -0.088 1
1 816 . 3 1 1 A 68 68 LEU H H 157 7.332 7.784 -0.452 1
1 817 . 3 1 1 A 68 68 LEU HA H 157 4.361 4.530 -0.169 1
1 827 . 3 1 1 A 68 68 LEU CA C 157 53.060 52.486 0.574 1
1 828 . 3 1 1 A 68 68 LEU CB C 157 41.100 41.384 -0.284 1
1 832 . 3 1 1 A 68 68 LEU N N 157 121.920 121.700 0.220 1
1 833 . 3 1 1 A 69 69 PRO HA H 158 4.485 4.607 -0.122 1
1 840 . 3 1 1 A 69 69 PRO C C 158 174.602 176.369 -1.767 1
1 841 . 3 1 1 A 69 69 PRO CA C 158 61.556 62.219 -0.663 1
1 842 . 3 1 1 A 69 69 PRO CB C 158 32.370 32.677 -0.307 1
1 845 . 3 1 1 A 70 70 HIS H H 159 8.734 8.617 0.117 1
1 846 . 3 1 1 A 70 70 HIS HA H 159 3.947 4.507 -0.560 1
1 852 . 3 1 1 A 70 70 HIS CA C 159 56.250 55.265 0.985 1
1 853 . 3 1 1 A 70 70 HIS CB C 159 32.280 31.087 1.193 1
1 856 . 3 1 1 A 70 70 HIS N N 159 119.423 121.736 -2.313 1
1 857 . 3 1 1 A 71 71 PRO HA H 160 4.424 4.160 0.264 1
1 864 . 3 1 1 A 71 71 PRO C C 160 177.567 178.696 -1.129 1
1 865 . 3 1 1 A 71 71 PRO CA C 160 64.574 65.573 -0.999 1
1 866 . 3 1 1 A 71 71 PRO CB C 160 32.340 31.770 0.570 1
1 869 . 3 1 1 A 72 72 LEU H H 161 10.123 7.431 2.692 1
1 870 . 3 1 1 A 72 72 LEU HA H 161 4.778 4.272 0.506 1
1 880 . 3 1 1 A 72 72 LEU C C 161 178.721 177.806 0.915 1
1 881 . 3 1 1 A 72 72 LEU CA C 161 55.800 57.319 -1.519 1
1 882 . 3 1 1 A 72 72 LEU CB C 161 42.440 42.216 0.224 1
1 886 . 3 1 1 A 72 72 LEU N N 161 117.374 117.757 -0.383 1
1 887 . 3 1 1 A 73 73 THR H H 162 7.523 7.848 -0.325 1
1 888 . 3 1 1 A 73 73 THR HA H 162 4.291 4.532 -0.241 1
1 893 . 3 1 1 A 73 73 THR C C 162 175.557 174.332 1.225 1
1 894 . 3 1 1 A 73 73 THR CA C 162 61.440 62.196 -0.756 1
1 895 . 3 1 1 A 73 73 THR CB C 162 70.500 69.547 0.953 1
1 897 . 3 1 1 A 73 73 THR N N 162 107.787 111.298 -3.511 1
1 898 . 3 1 1 A 74 74 ARG H H 163 8.361 7.838 0.523 1
1 899 . 3 1 1 A 74 74 ARG HA H 163 3.836 4.319 -0.483 1
1 906 . 3 1 1 A 74 74 ARG C C 163 174.701 175.169 -0.468 1
1 907 . 3 1 1 A 74 74 ARG CA C 163 57.980 57.462 0.518 1
1 908 . 3 1 1 A 74 74 ARG CB C 163 26.770 26.940 -0.170 1
1 911 . 3 1 1 A 74 74 ARG N N 163 115.130 118.401 -3.271 1
1 912 . 3 1 1 A 75 75 GLU H H 164 7.430 8.095 -0.665 1
1 913 . 3 1 1 A 75 75 GLU HA H 164 4.636 4.458 0.178 1
1 918 . 3 1 1 A 75 75 GLU CA C 164 53.699 55.180 -1.481 1
1 919 . 3 1 1 A 75 75 GLU CB C 164 29.550 28.415 1.135 1
1 921 . 3 1 1 A 75 75 GLU N N 164 120.076 118.897 1.179 1
1 922 . 3 1 1 A 76 76 PRO HA H 165 4.272 4.614 -0.342 1
1 929 . 3 1 1 A 76 76 PRO C C 165 176.649 176.902 -0.253 1
1 930 . 3 1 1 A 76 76 PRO CA C 165 63.204 62.982 0.222 1
1 931 . 3 1 1 A 76 76 PRO CB C 165 31.680 31.580 0.100 1
1 934 . 3 1 1 A 77 77 ILE H H 166 8.812 8.171 0.641 1
1 935 . 3 1 1 A 77 77 ILE HA H 166 3.838 4.307 -0.469 1
1 945 . 3 1 1 A 77 77 ILE C C 166 175.235 175.931 -0.696 1
1 946 . 3 1 1 A 77 77 ILE CA C 166 62.816 61.044 1.772 1
1 947 . 3 1 1 A 77 77 ILE CB C 166 37.750 37.412 0.338 1
1 951 . 3 1 1 A 77 77 ILE N N 166 123.831 124.120 -0.289 1
1 952 . 3 1 1 A 78 78 THR H H 167 6.625 8.567 -1.942 1
1 953 . 3 1 1 A 78 78 THR HA H 167 4.632 4.991 -0.359 1
1 958 . 3 1 1 A 78 78 THR C C 167 174.143 173.902 0.241 1
1 959 . 3 1 1 A 78 78 THR CA C 167 58.750 60.203 -1.453 1
1 960 . 3 1 1 A 78 78 THR CB C 167 71.320 70.651 0.669 1
1 962 . 3 1 1 A 78 78 THR N N 167 115.293 118.710 -3.417 1
1 963 . 3 1 1 A 79 79 ALA H H 168 9.088 8.986 0.102 1
1 964 . 3 1 1 A 79 79 ALA HA H 168 3.916 4.165 -0.249 1
1 968 . 3 1 1 A 79 79 ALA C C 168 179.770 179.497 0.273 1
1 969 . 3 1 1 A 79 79 ALA CA C 168 55.480 54.960 0.520 1
1 970 . 3 1 1 A 79 79 ALA CB C 168 17.630 18.449 -0.819 1
1 971 . 3 1 1 A 79 79 ALA N N 168 122.102 127.456 -5.354 1
1 972 . 3 1 1 A 80 80 SER H H 169 7.988 7.535 0.453 1
1 973 . 3 1 1 A 80 80 SER HA H 169 4.091 4.237 -0.146 1
1 976 . 3 1 1 A 80 80 SER C C 169 175.836 176.558 -0.722 1
1 977 . 3 1 1 A 80 80 SER CA C 169 60.750 61.468 -0.718 1
1 978 . 3 1 1 A 80 80 SER CB C 169 62.510 62.979 -0.469 1
1 979 . 3 1 1 A 80 80 SER N N 169 109.660 113.252 -3.592 1
1 980 . 3 1 1 A 81 81 ILE H H 170 7.052 7.596 -0.544 1
1 981 . 3 1 1 A 81 81 ILE HA H 170 4.344 4.019 0.325 1
1 991 . 3 1 1 A 81 81 ILE C C 170 174.236 176.546 -2.310 1
1 992 . 3 1 1 A 81 81 ILE CA C 170 61.760 64.119 -2.359 1
1 993 . 3 1 1 A 81 81 ILE CB C 170 37.950 37.553 0.397 1
1 997 . 3 1 1 A 81 81 ILE N N 170 112.623 114.349 -1.726 1
1 998 . 3 1 1 A 82 82 ILE H H 171 7.345 7.151 0.194 1
1 999 . 3 1 1 A 82 82 ILE HA H 171 4.288 4.008 0.280 1
1 1009 . 3 1 1 A 82 82 ILE C C 171 174.931 175.298 -0.367 1
1 1010 . 3 1 1 A 82 82 ILE CA C 171 61.420 62.169 -0.749 1
1 1011 . 3 1 1 A 82 82 ILE CB C 171 37.230 37.878 -0.648 1
1 1015 . 3 1 1 A 82 82 ILE N N 171 124.260 124.602 -0.342 1
1 1016 . 3 1 1 A 83 83 VAL H H 172 7.843 8.707 -0.864 1
1 1017 . 3 1 1 A 83 83 VAL HA H 172 4.818 5.046 -0.228 1
1 1025 . 3 1 1 A 83 83 VAL C C 172 174.918 175.505 -0.587 1
1 1026 . 3 1 1 A 83 83 VAL CA C 172 58.910 59.061 -0.151 1
1 1027 . 3 1 1 A 83 83 VAL CB C 172 34.570 35.172 -0.602 1
1 1030 . 3 1 1 A 83 83 VAL N N 172 118.856 121.835 -2.979 1
1 1031 . 3 1 1 A 84 84 LYS H H 173 8.347 8.743 -0.396 1
1 1032 . 3 1 1 A 84 84 LYS HA H 173 4.356 4.624 -0.268 1
1 1041 . 3 1 1 A 84 84 LYS C C 173 178.653 178.548 0.105 1
1 1042 . 3 1 1 A 84 84 LYS CA C 173 56.360 55.072 1.288 1
1 1043 . 3 1 1 A 84 84 LYS CB C 173 33.366 33.634 -0.268 1
1 1047 . 3 1 1 A 84 84 LYS N N 173 119.602 120.952 -1.350 1
1 1048 . 3 1 1 A 85 85 HIS H H 174 9.143 9.025 0.118 1
1 1049 . 3 1 1 A 85 85 HIS HA H 174 4.013 3.914 0.099 1
1 1053 . 3 1 1 A 85 85 HIS C C 174 176.606 176.777 -0.171 1
1 1054 . 3 1 1 A 85 85 HIS CA C 174 58.820 60.410 -1.590 1
1 1055 . 3 1 1 A 85 85 HIS CB C 174 28.186 29.926 -1.740 1
1 1057 . 3 1 1 A 85 85 HIS N N 174 120.022 122.539 -2.517 1
1 1058 . 3 1 1 A 86 86 GLU H H 175 8.403 8.160 0.243 1
1 1059 . 3 1 1 A 86 86 GLU HA H 175 3.863 3.665 0.198 1
1 1064 . 3 1 1 A 86 86 GLU C C 175 177.040 178.793 -1.753 1
1 1065 . 3 1 1 A 86 86 GLU CA C 175 57.830 59.969 -2.139 1
1 1066 . 3 1 1 A 86 86 GLU CB C 175 28.690 29.411 -0.721 1
1 1068 . 3 1 1 A 86 86 GLU N N 175 116.124 118.550 -2.426 1
1 1069 . 3 1 1 A 87 87 GLU H H 176 7.669 7.939 -0.270 1
1 1070 . 3 1 1 A 87 87 GLU HA H 176 4.039 4.350 -0.311 1
1 1075 . 3 1 1 A 87 87 GLU C C 176 175.688 177.330 -1.642 1
1 1076 . 3 1 1 A 87 87 GLU CA C 176 57.906 58.978 -1.072 1
1 1077 . 3 1 1 A 87 87 GLU CB C 176 30.430 28.940 1.490 1
1 1079 . 3 1 1 A 87 87 GLU N N 176 116.183 119.447 -3.264 1
1 1080 . 3 1 1 A 88 88 CYS H H 177 6.750 7.273 -0.523 1
1 1081 . 3 1 1 A 88 88 CYS HA H 177 4.991 4.520 0.471 1
1 1084 . 3 1 1 A 88 88 CYS C C 177 172.325 173.660 -1.335 1
1 1085 . 3 1 1 A 88 88 CYS CA C 177 55.030 54.318 0.712 1
1 1086 . 3 1 1 A 88 88 CYS CB C 177 45.610 42.202 3.408 1
1 1087 . 3 1 1 A 88 88 CYS N N 177 114.838 117.107 -2.269 1
1 1088 . 3 1 1 A 89 89 ILE H H 178 9.128 8.759 0.369 1
1 1089 . 3 1 1 A 89 89 ILE HA H 178 4.536 4.916 -0.380 1
1 1099 . 3 1 1 A 89 89 ILE C C 178 174.893 174.489 0.404 1
1 1100 . 3 1 1 A 89 89 ILE CA C 178 59.160 59.225 -0.065 1
1 1101 . 3 1 1 A 89 89 ILE CB C 178 41.840 40.893 0.947 1
1 1105 . 3 1 1 A 89 89 ILE N N 178 120.564 121.109 -0.545 1
1 1106 . 3 1 1 A 90 90 TYR H H 179 9.349 9.117 0.232 1
1 1107 . 3 1 1 A 90 90 TYR HA H 179 3.568 4.328 -0.760 1
1 1112 . 3 1 1 A 90 90 TYR C C 179 173.950 174.041 -0.091 1
1 1113 . 3 1 1 A 90 90 TYR CA C 179 61.180 57.442 3.738 1
1 1114 . 3 1 1 A 90 90 TYR CB C 179 37.530 38.371 -0.841 1
1 1116 . 3 1 1 A 90 90 TYR N N 179 129.033 126.522 2.511 1
1 1117 . 3 1 1 A 91 91 ASP H H 180 7.367 8.442 -1.075 1
1 1118 . 3 1 1 A 91 91 ASP HA H 180 4.662 4.554 0.108 1
1 1121 . 3 1 1 A 91 91 ASP C C 180 175.291 176.040 -0.749 1
1 1122 . 3 1 1 A 91 91 ASP CA C 180 52.230 52.785 -0.555 1
1 1123 . 3 1 1 A 91 91 ASP CB C 180 43.650 41.106 2.544 1
1 1124 . 3 1 1 A 91 91 ASP N N 180 129.305 128.969 0.336 1
1 1125 . 3 1 1 A 92 92 ASP H H 181 8.783 8.614 0.169 1
1 1126 . 3 1 1 A 92 92 ASP HA H 181 4.114 3.775 0.339 1
1 1129 . 3 1 1 A 92 92 ASP C C 181 177.573 177.998 -0.425 1
1 1130 . 3 1 1 A 92 92 ASP CA C 181 56.390 57.246 -0.856 1
1 1131 . 3 1 1 A 92 92 ASP CB C 181 41.330 40.310 1.020 1
1 1132 . 3 1 1 A 92 92 ASP N N 181 125.665 125.891 -0.226 1
1 1133 . 3 1 1 A 93 93 THR H H 182 8.284 7.451 0.833 1
1 1134 . 3 1 1 A 93 93 THR HA H 182 4.037 3.981 0.056 1
1 1139 . 3 1 1 A 93 93 THR C C 182 176.333 176.560 -0.227 1
1 1140 . 3 1 1 A 93 93 THR CA C 182 65.320 65.988 -0.668 1
1 1141 . 3 1 1 A 93 93 THR CB C 182 68.560 68.388 0.172 1
1 1143 . 3 1 1 A 93 93 THR N N 182 114.688 116.342 -1.654 1
1 1144 . 3 1 1 A 94 94 ARG H H 183 7.784 7.411 0.373 1
1 1145 . 3 1 1 A 94 94 ARG HA H 183 4.142 4.283 -0.141 1
1 1152 . 3 1 1 A 94 94 ARG C C 183 177.015 177.159 -0.144 1
1 1153 . 3 1 1 A 94 94 ARG CA C 183 55.350 56.140 -0.790 1
1 1154 . 3 1 1 A 94 94 ARG CB C 183 30.930 31.078 -0.148 1
1 1157 . 3 1 1 A 94 94 ARG N N 183 120.156 118.707 1.449 1
1 1158 . 3 1 1 A 95 95 GLY H H 184 8.144 8.954 -0.810 1
1 1159 . 3 1 1 A 95 95 GLY HA2 H 184 3.839 3.920 -0.081 1
1 1160 . 3 1 1 A 95 95 GLY HA3 H 184 3.681 3.996 -0.315 1
1 1161 . 3 1 1 A 95 95 GLY C C 184 173.653 173.358 0.295 1
1 1162 . 3 1 1 A 95 95 GLY CA C 184 46.160 46.092 0.068 1
1 1163 . 3 1 1 A 95 95 GLY N N 184 107.879 108.664 -0.785 1
1 1164 . 3 1 1 A 96 96 ASN H H 185 6.855 7.370 -0.515 1
1 1165 . 3 1 1 A 96 96 ASN HA H 185 4.909 5.053 -0.144 1
1 1170 . 3 1 1 A 96 96 ASN C C 185 174.223 173.324 0.899 1
1 1171 . 3 1 1 A 96 96 ASN CA C 185 52.720 52.323 0.397 1
1 1172 . 3 1 1 A 96 96 ASN CB C 185 45.620 41.796 3.824 1
1 1173 . 3 1 1 A 96 96 ASN N N 185 113.382 116.540 -3.158 1
1 1175 . 3 1 1 A 97 97 PHE H H 186 9.228 8.551 0.677 1
1 1176 . 3 1 1 A 97 97 PHE HA H 186 4.579 4.981 -0.402 1
1 1183 . 3 1 1 A 97 97 PHE C C 186 174.794 175.751 -0.957 1
1 1184 . 3 1 1 A 97 97 PHE CA C 186 59.384 59.077 0.307 1
1 1185 . 3 1 1 A 97 97 PHE CB C 186 40.450 39.424 1.026 1
1 1188 . 3 1 1 A 97 97 PHE N N 186 118.661 119.701 -1.040 1
1 1189 . 3 1 1 A 98 98 ILE H H 187 8.908 9.200 -0.292 1
1 1190 . 3 1 1 A 98 98 ILE HA H 187 5.440 5.091 0.349 1
1 1200 . 3 1 1 A 98 98 ILE C C 187 176.171 174.884 1.287 1
1 1201 . 3 1 1 A 98 98 ILE CA C 187 57.610 59.770 -2.160 1
1 1202 . 3 1 1 A 98 98 ILE CB C 187 41.280 41.558 -0.278 1
1 1206 . 3 1 1 A 98 98 ILE N N 187 120.585 123.619 -3.034 1
1 1207 . 3 1 1 A 99 99 ILE H H 188 8.602 8.203 0.399 1
1 1208 . 3 1 1 A 99 99 ILE HA H 188 4.546 4.567 -0.021 1
1 1218 . 3 1 1 A 99 99 ILE C C 188 176.668 175.267 1.401 1
1 1219 . 3 1 1 A 99 99 ILE CA C 188 58.920 60.971 -2.051 1
1 1220 . 3 1 1 A 99 99 ILE CB C 188 37.960 37.841 0.119 1
1 1224 . 3 1 1 A 99 99 ILE N N 188 124.500 128.250 -3.750 1
1 1225 . 3 1 1 A 100 100 LYS H H 189 8.449 8.819 -0.370 1
1 1226 . 3 1 1 A 100 100 LYS HA H 189 4.108 4.859 -0.751 1
1 1235 . 3 1 1 A 100 100 LYS C C 189 176.866 176.288 0.578 1
1 1236 . 3 1 1 A 100 100 LYS CA C 189 56.800 54.753 2.047 1
1 1237 . 3 1 1 A 100 100 LYS CB C 189 33.400 33.987 -0.587 1
1 1241 . 3 1 1 A 100 100 LYS N N 189 128.581 126.981 1.600 1
1 1242 . 3 1 1 A 101 101 GLY H H 190 8.381 8.872 -0.491 1
1 1243 . 3 1 1 A 101 101 GLY HA2 H 190 3.946 3.973 -0.027 1
1 1244 . 3 1 1 A 101 101 GLY HA3 H 190 3.828 3.978 -0.150 1
1 1245 . 3 1 1 A 101 101 GLY C C 190 172.902 174.136 -1.234 1
1 1246 . 3 1 1 A 101 101 GLY CA C 190 44.920 45.323 -0.403 1
1 1247 . 3 1 1 A 101 101 GLY N N 190 111.183 113.132 -1.949 1
1 7 . 4 1 1 A 2 2 GLN H H 91 8.786 8.782 0.004 1
1 8 . 4 1 1 A 2 2 GLN HA H 91 4.005 3.857 0.148 1
1 15 . 4 1 1 A 2 2 GLN C C 91 177.270 177.194 0.076 1
1 16 . 4 1 1 A 2 2 GLN CA C 91 58.220 59.324 -1.104 1
1 17 . 4 1 1 A 2 2 GLN CB C 91 28.650 28.443 0.207 1
1 19 . 4 1 1 A 2 2 GLN N N 91 121.993 126.089 -4.096 1
1 21 . 4 1 1 A 3 3 GLU H H 92 8.430 8.374 0.056 1
1 22 . 4 1 1 A 3 3 GLU HA H 92 4.007 4.056 -0.049 1
1 27 . 4 1 1 A 3 3 GLU C C 92 178.287 179.077 -0.790 1
1 28 . 4 1 1 A 3 3 GLU CA C 92 59.490 59.340 0.150 1
1 29 . 4 1 1 A 3 3 GLU CB C 92 29.506 29.264 0.242 1
1 31 . 4 1 1 A 3 3 GLU N N 92 120.195 119.750 0.445 1
1 32 . 4 1 1 A 4 4 SER H H 93 8.209 8.137 0.072 1
1 33 . 4 1 1 A 4 4 SER HA H 93 4.272 4.199 0.073 1
1 36 . 4 1 1 A 4 4 SER C C 93 177.369 176.599 0.770 1
1 37 . 4 1 1 A 4 4 SER CA C 93 61.044 62.253 -1.209 1
1 38 . 4 1 1 A 4 4 SER CB C 93 62.950 63.055 -0.105 1
1 39 . 4 1 1 A 4 4 SER N N 93 115.524 116.847 -1.323 1
1 40 . 4 1 1 A 5 5 ILE H H 94 8.080 7.471 0.609 1
1 41 . 4 1 1 A 5 5 ILE HA H 94 3.530 3.631 -0.101 1
1 51 . 4 1 1 A 5 5 ILE C C 94 177.778 177.665 0.113 1
1 52 . 4 1 1 A 5 5 ILE CA C 94 65.710 65.296 0.414 1
1 53 . 4 1 1 A 5 5 ILE CB C 94 37.800 37.584 0.216 1
1 57 . 4 1 1 A 5 5 ILE N N 94 124.148 121.565 2.583 1
1 58 . 4 1 1 A 6 6 GLN H H 95 8.374 8.092 0.282 1
1 59 . 4 1 1 A 6 6 GLN HA H 95 4.125 3.922 0.203 1
1 66 . 4 1 1 A 6 6 GLN C C 95 179.726 179.155 0.571 1
1 67 . 4 1 1 A 6 6 GLN CA C 95 59.190 58.971 0.219 1
1 68 . 4 1 1 A 6 6 GLN CB C 95 27.060 28.310 -1.250 1
1 70 . 4 1 1 A 6 6 GLN N N 95 118.257 118.275 -0.018 1
1 72 . 4 1 1 A 7 7 ASN H H 96 8.456 8.272 0.184 1
1 73 . 4 1 1 A 7 7 ASN HA H 96 4.446 4.568 -0.122 1
1 78 . 4 1 1 A 7 7 ASN C C 96 177.257 177.541 -0.284 1
1 79 . 4 1 1 A 7 7 ASN CA C 96 56.020 55.981 0.039 1
1 80 . 4 1 1 A 7 7 ASN CB C 96 38.126 37.908 0.218 1
1 81 . 4 1 1 A 7 7 ASN N N 96 118.597 118.409 0.188 1
1 83 . 4 1 1 A 8 8 LYS H H 97 7.732 7.863 -0.131 1
1 84 . 4 1 1 A 8 8 LYS HA H 97 4.129 4.122 0.007 1
1 93 . 4 1 1 A 8 8 LYS C C 97 179.143 179.285 -0.142 1
1 94 . 4 1 1 A 8 8 LYS CA C 97 59.126 59.710 -0.584 1
1 95 . 4 1 1 A 8 8 LYS CB C 97 32.070 32.253 -0.183 1
1 99 . 4 1 1 A 8 8 LYS N N 97 122.381 120.669 1.712 1
1 100 . 4 1 1 A 9 9 ILE H H 98 8.452 7.979 0.473 1
1 101 . 4 1 1 A 9 9 ILE HA H 98 3.480 3.960 -0.480 1
1 111 . 4 1 1 A 9 9 ILE C C 98 177.406 178.431 -1.025 1
1 112 . 4 1 1 A 9 9 ILE CA C 98 66.430 63.744 2.686 1
1 113 . 4 1 1 A 9 9 ILE CB C 98 37.980 37.330 0.650 1
1 117 . 4 1 1 A 9 9 ILE N N 98 119.950 120.255 -0.305 1
1 118 . 4 1 1 A 10 10 SER H H 99 7.924 7.729 0.195 1
1 119 . 4 1 1 A 10 10 SER HA H 99 3.983 4.377 -0.394 1
1 122 . 4 1 1 A 10 10 SER C C 99 176.327 176.109 0.218 1
1 123 . 4 1 1 A 10 10 SER CA C 99 61.990 61.336 0.654 1
1 124 . 4 1 1 A 10 10 SER CB C 99 62.790 63.742 -0.952 1
1 125 . 4 1 1 A 10 10 SER N N 99 113.568 118.662 -5.094 1
1 126 . 4 1 1 A 11 11 GLN H H 100 7.832 8.058 -0.226 1
1 127 . 4 1 1 A 11 11 GLN HA H 100 4.238 4.494 -0.256 1
1 134 . 4 1 1 A 11 11 GLN C C 100 178.088 178.160 -0.072 1
1 135 . 4 1 1 A 11 11 GLN CA C 100 57.900 56.776 1.124 1
1 136 . 4 1 1 A 11 11 GLN CB C 100 29.790 29.823 -0.033 1
1 138 . 4 1 1 A 11 11 GLN N N 100 117.487 117.251 0.236 1
1 140 . 4 1 1 A 12 12 CYS H H 101 7.920 7.764 0.156 1
1 141 . 4 1 1 A 12 12 CYS HA H 101 4.657 4.532 0.125 1
1 144 . 4 1 1 A 12 12 CYS C C 101 175.439 174.497 0.942 1
1 145 . 4 1 1 A 12 12 CYS CA C 101 60.654 59.096 1.558 1
1 146 . 4 1 1 A 12 12 CYS CB C 101 29.310 28.221 1.089 1
1 147 . 4 1 1 A 12 12 CYS N N 101 114.221 118.584 -4.363 1
1 148 . 4 1 1 A 13 13 LYS H H 102 7.993 7.423 0.570 1
1 149 . 4 1 1 A 13 13 LYS HA H 102 5.038 4.499 0.539 1
1 158 . 4 1 1 A 13 13 LYS C C 102 174.757 176.251 -1.494 1
1 159 . 4 1 1 A 13 13 LYS CA C 102 56.660 56.029 0.631 1
1 160 . 4 1 1 A 13 13 LYS CB C 102 32.970 33.409 -0.439 1
1 164 . 4 1 1 A 13 13 LYS N N 102 123.841 118.918 4.923 1
1 165 . 4 1 1 A 14 14 PHE H H 103 8.822 8.804 0.018 1
1 166 . 4 1 1 A 14 14 PHE HA H 103 5.058 5.091 -0.033 1
1 174 . 4 1 1 A 14 14 PHE C C 103 173.560 172.783 0.777 1
1 175 . 4 1 1 A 14 14 PHE CA C 103 55.470 55.990 -0.520 1
1 176 . 4 1 1 A 14 14 PHE CB C 103 41.760 40.935 0.825 1
1 180 . 4 1 1 A 14 14 PHE N N 103 118.421 116.196 2.225 1
1 181 . 4 1 1 A 15 15 SER H H 104 8.826 8.805 0.021 1
1 182 . 4 1 1 A 15 15 SER HA H 104 4.602 4.695 -0.093 1
1 185 . 4 1 1 A 15 15 SER C C 104 173.851 173.452 0.399 1
1 186 . 4 1 1 A 15 15 SER CA C 104 58.610 58.565 0.045 1
1 187 . 4 1 1 A 15 15 SER CB C 104 62.690 62.772 -0.082 1
1 188 . 4 1 1 A 15 15 SER N N 104 117.781 116.784 0.997 1
1 189 . 4 1 1 A 16 16 VAL H H 105 7.839 8.187 -0.348 1
1 190 . 4 1 1 A 16 16 VAL HA H 105 3.390 4.239 -0.849 1
1 198 . 4 1 1 A 16 16 VAL C C 105 174.987 174.964 0.023 1
1 199 . 4 1 1 A 16 16 VAL CA C 105 63.650 62.299 1.351 1
1 200 . 4 1 1 A 16 16 VAL CB C 105 31.410 30.182 1.228 1
1 203 . 4 1 1 A 16 16 VAL N N 105 129.036 126.646 2.390 1
1 204 . 4 1 1 A 17 17 CYS H H 106 8.536 8.164 0.372 1
1 205 . 4 1 1 A 17 17 CYS HA H 106 5.011 4.929 0.082 1
1 208 . 4 1 1 A 17 17 CYS CA C 106 55.260 56.550 -1.290 1
1 209 . 4 1 1 A 17 17 CYS CB C 106 28.210 29.873 -1.663 1
1 210 . 4 1 1 A 17 17 CYS N N 106 130.045 126.918 3.127 1
1 211 . 4 1 1 A 18 18 PRO HA H 107 3.991 4.395 -0.404 1
1 218 . 4 1 1 A 18 18 PRO C C 107 178.188 177.736 0.452 1
1 219 . 4 1 1 A 18 18 PRO CA C 107 65.940 64.709 1.231 1
1 220 . 4 1 1 A 18 18 PRO CB C 107 32.000 32.153 -0.153 1
1 223 . 4 1 1 A 19 19 GLU H H 108 9.260 8.953 0.307 1
1 224 . 4 1 1 A 19 19 GLU HA H 108 4.119 4.171 -0.052 1
1 229 . 4 1 1 A 19 19 GLU C C 108 178.721 179.253 -0.532 1
1 230 . 4 1 1 A 19 19 GLU CA C 108 59.300 58.296 1.004 1
1 231 . 4 1 1 A 19 19 GLU CB C 108 28.920 29.279 -0.359 1
1 233 . 4 1 1 A 19 19 GLU N N 108 118.270 116.121 2.149 1
1 234 . 4 1 1 A 20 20 ARG H H 109 7.672 8.037 -0.365 1
1 235 . 4 1 1 A 20 20 ARG HA H 109 4.331 4.129 0.202 1
1 242 . 4 1 1 A 20 20 ARG C C 109 177.977 178.532 -0.555 1
1 243 . 4 1 1 A 20 20 ARG CA C 109 57.350 59.194 -1.844 1
1 244 . 4 1 1 A 20 20 ARG CB C 109 30.820 30.328 0.492 1
1 247 . 4 1 1 A 20 20 ARG N N 109 118.357 119.397 -1.040 1
1 248 . 4 1 1 A 21 21 LEU H H 110 7.601 7.657 -0.056 1
1 249 . 4 1 1 A 21 21 LEU HA H 110 4.380 4.361 0.019 1
1 259 . 4 1 1 A 21 21 LEU C C 110 176.562 176.407 0.155 1
1 260 . 4 1 1 A 21 21 LEU CA C 110 56.096 55.543 0.553 1
1 261 . 4 1 1 A 21 21 LEU CB C 110 44.016 42.124 1.892 1
1 265 . 4 1 1 A 21 21 LEU N N 110 118.626 119.039 -0.413 1
1 266 . 4 1 1 A 22 22 GLN H H 111 7.750 7.589 0.161 1
1 267 . 4 1 1 A 22 22 GLN HA H 111 3.870 3.929 -0.059 1
1 274 . 4 1 1 A 22 22 GLN C C 111 173.336 174.071 -0.735 1
1 275 . 4 1 1 A 22 22 GLN CA C 111 56.510 57.246 -0.736 1
1 276 . 4 1 1 A 22 22 GLN CB C 111 26.800 26.600 0.200 1
1 278 . 4 1 1 A 22 22 GLN N N 111 113.926 115.597 -1.671 1
1 280 . 4 1 1 A 23 23 CYS H H 112 7.407 7.461 -0.054 1
1 281 . 4 1 1 A 23 23 CYS HA H 112 4.469 4.884 -0.415 1
1 284 . 4 1 1 A 23 23 CYS CA C 112 52.650 56.773 -4.123 1
1 285 . 4 1 1 A 23 23 CYS CB C 112 29.750 28.357 1.393 1
1 286 . 4 1 1 A 23 23 CYS N N 112 112.681 117.828 -5.147 1
1 287 . 4 1 1 A 24 24 PRO HA H 113 4.408 4.544 -0.136 1
1 294 . 4 1 1 A 24 24 PRO C C 113 178.175 177.802 0.373 1
1 295 . 4 1 1 A 24 24 PRO CA C 113 62.040 62.770 -0.730 1
1 296 . 4 1 1 A 24 24 PRO CB C 113 31.920 32.600 -0.680 1
1 299 . 4 1 1 A 25 25 LEU H H 114 8.593 8.862 -0.269 1
1 300 . 4 1 1 A 25 25 LEU HA H 114 3.765 4.042 -0.277 1
1 310 . 4 1 1 A 25 25 LEU C C 114 179.950 178.620 1.330 1
1 311 . 4 1 1 A 25 25 LEU CA C 114 57.674 58.265 -0.591 1
1 312 . 4 1 1 A 25 25 LEU CB C 114 40.690 41.461 -0.771 1
1 316 . 4 1 1 A 25 25 LEU N N 114 123.729 124.653 -0.924 1
1 317 . 4 1 1 A 26 26 GLU H H 115 9.108 8.368 0.740 1
1 318 . 4 1 1 A 26 26 GLU HA H 115 3.876 3.979 -0.103 1
1 323 . 4 1 1 A 26 26 GLU C C 115 177.505 179.190 -1.685 1
1 324 . 4 1 1 A 26 26 GLU CA C 115 59.410 59.580 -0.170 1
1 325 . 4 1 1 A 26 26 GLU CB C 115 28.460 29.293 -0.833 1
1 327 . 4 1 1 A 26 26 GLU N N 115 116.817 118.303 -1.486 1
1 328 . 4 1 1 A 27 27 ALA H H 116 7.360 7.598 -0.238 1
1 329 . 4 1 1 A 27 27 ALA HA H 116 4.408 3.962 0.446 1
1 333 . 4 1 1 A 27 27 ALA C C 116 177.046 178.156 -1.110 1
1 334 . 4 1 1 A 27 27 ALA CA C 116 52.970 54.648 -1.678 1
1 335 . 4 1 1 A 27 27 ALA CB C 116 19.916 17.849 2.067 1
1 336 . 4 1 1 A 27 27 ALA N N 116 118.966 121.606 -2.640 1
1 337 . 4 1 1 A 28 28 ILE H H 117 7.168 7.152 0.016 1
1 338 . 4 1 1 A 28 28 ILE HA H 117 4.432 4.804 -0.372 1
1 348 . 4 1 1 A 28 28 ILE C C 117 172.641 175.512 -2.871 1
1 349 . 4 1 1 A 28 28 ILE CA C 117 59.980 60.223 -0.243 1
1 350 . 4 1 1 A 28 28 ILE CB C 117 37.350 37.984 -0.634 1
1 354 . 4 1 1 A 28 28 ILE N N 117 108.913 108.724 0.189 1
1 355 . 4 1 1 A 29 29 GLN H H 118 6.562 7.458 -0.896 1
1 356 . 4 1 1 A 29 29 GLN HA H 118 3.922 4.209 -0.287 1
1 363 . 4 1 1 A 29 29 GLN C C 118 175.049 175.660 -0.611 1
1 364 . 4 1 1 A 29 29 GLN CA C 118 54.596 56.034 -1.438 1
1 365 . 4 1 1 A 29 29 GLN CB C 118 29.570 29.262 0.308 1
1 367 . 4 1 1 A 29 29 GLN N N 118 116.455 123.300 -6.845 1
1 369 . 4 1 1 A 30 30 CYS H H 119 8.138 8.381 -0.243 1
1 370 . 4 1 1 A 30 30 CYS HA H 119 4.580 4.464 0.116 1
1 373 . 4 1 1 A 30 30 CYS CA C 119 57.810 57.695 0.115 1
1 374 . 4 1 1 A 30 30 CYS CB C 119 30.200 28.749 1.451 1
1 375 . 4 1 1 A 30 30 CYS N N 119 134.136 125.221 8.915 1
1 376 . 4 1 1 A 31 31 PRO HA H 120 4.424 4.532 -0.108 1
1 383 . 4 1 1 A 31 31 PRO C C 120 177.431 177.133 0.298 1
1 384 . 4 1 1 A 31 31 PRO CA C 120 64.060 63.913 0.147 1
1 385 . 4 1 1 A 31 31 PRO CB C 120 32.776 31.924 0.852 1
1 388 . 4 1 1 A 32 32 ILE H H 121 11.318 7.475 3.843 1
1 389 . 4 1 1 A 32 32 ILE HA H 121 4.038 4.089 -0.051 1
1 399 . 4 1 1 A 32 32 ILE C C 121 178.485 177.800 0.685 1
1 400 . 4 1 1 A 32 32 ILE CA C 121 64.060 63.160 0.900 1
1 401 . 4 1 1 A 32 32 ILE CB C 121 39.340 38.986 0.354 1
1 405 . 4 1 1 A 32 32 ILE N N 121 124.500 116.697 7.803 1
1 406 . 4 1 1 A 33 33 THR H H 122 9.928 7.505 2.423 1
1 407 . 4 1 1 A 33 33 THR HA H 122 4.048 4.495 -0.447 1
1 412 . 4 1 1 A 33 33 THR C C 122 175.793 174.434 1.359 1
1 413 . 4 1 1 A 33 33 THR CA C 122 62.990 61.196 1.794 1
1 414 . 4 1 1 A 33 33 THR CB C 122 70.300 68.867 1.433 1
1 416 . 4 1 1 A 33 33 THR N N 122 115.136 108.942 6.194 1
1 417 . 4 1 1 A 34 34 LEU H H 123 8.439 7.791 0.648 1
1 418 . 4 1 1 A 34 34 LEU HA H 123 3.912 3.999 -0.087 1
1 428 . 4 1 1 A 34 34 LEU C C 123 175.495 175.503 -0.008 1
1 429 . 4 1 1 A 34 34 LEU CA C 123 56.290 55.956 0.334 1
1 430 . 4 1 1 A 34 34 LEU CB C 123 38.500 39.723 -1.223 1
1 434 . 4 1 1 A 34 34 LEU N N 123 117.230 120.944 -3.714 1
1 435 . 4 1 1 A 35 35 GLU H H 124 7.816 7.467 0.349 1
1 436 . 4 1 1 A 35 35 GLU HA H 124 4.634 4.706 -0.072 1
1 441 . 4 1 1 A 35 35 GLU C C 124 174.838 174.131 0.707 1
1 442 . 4 1 1 A 35 35 GLU CA C 124 53.780 54.759 -0.979 1
1 443 . 4 1 1 A 35 35 GLU CB C 124 33.710 32.124 1.586 1
1 445 . 4 1 1 A 35 35 GLU N N 124 116.577 116.449 0.128 1
1 446 . 4 1 1 A 36 36 GLN H H 125 8.532 8.561 -0.029 1
1 447 . 4 1 1 A 36 36 GLN HA H 125 4.958 4.394 0.564 1
1 454 . 4 1 1 A 36 36 GLN CA C 125 53.350 53.758 -0.408 1
1 455 . 4 1 1 A 36 36 GLN CB C 125 29.950 29.843 0.107 1
1 457 . 4 1 1 A 36 36 GLN N N 125 123.034 121.469 1.565 1
1 459 . 4 1 1 A 37 37 PRO HA H 126 4.458 4.384 0.074 1
1 466 . 4 1 1 A 37 37 PRO C C 126 176.314 177.276 -0.962 1
1 467 . 4 1 1 A 37 37 PRO CA C 126 62.816 65.651 -2.835 1
1 468 . 4 1 1 A 37 37 PRO CB C 126 33.070 31.570 1.500 1
1 471 . 4 1 1 A 38 38 GLU H H 127 8.626 7.652 0.974 1
1 472 . 4 1 1 A 38 38 GLU HA H 127 4.274 4.459 -0.185 1
1 477 . 4 1 1 A 38 38 GLU C C 127 177.809 174.941 2.868 1
1 478 . 4 1 1 A 38 38 GLU CA C 127 58.730 58.305 0.425 1
1 479 . 4 1 1 A 38 38 GLU CB C 127 30.340 29.445 0.895 1
1 481 . 4 1 1 A 38 38 GLU N N 127 120.691 119.295 1.396 1
1 482 . 4 1 1 A 39 39 LYS H H 128 7.891 7.834 0.057 1
1 483 . 4 1 1 A 39 39 LYS HA H 128 4.870 4.662 0.208 1
1 492 . 4 1 1 A 39 39 LYS C C 128 175.452 175.785 -0.333 1
1 493 . 4 1 1 A 39 39 LYS CA C 128 53.540 54.703 -1.163 1
1 494 . 4 1 1 A 39 39 LYS CB C 128 33.630 34.779 -1.149 1
1 498 . 4 1 1 A 39 39 LYS N N 128 118.149 118.229 -0.080 1
1 499 . 4 1 1 A 40 40 GLY H H 129 8.524 8.085 0.439 1
1 500 . 4 1 1 A 40 40 GLY HA2 H 129 4.973 4.058 0.915 1
1 501 . 4 1 1 A 40 40 GLY HA3 H 129 2.459 4.202 -1.743 1
1 502 . 4 1 1 A 40 40 GLY C C 129 169.943 172.011 -2.068 1
1 503 . 4 1 1 A 40 40 GLY CA C 129 42.910 44.952 -2.042 1
1 504 . 4 1 1 A 40 40 GLY N N 129 112.845 110.360 2.485 1
1 505 . 4 1 1 A 41 41 ILE H H 130 8.659 8.057 0.602 1
1 506 . 4 1 1 A 41 41 ILE HA H 130 4.591 4.797 -0.206 1
1 516 . 4 1 1 A 41 41 ILE C C 130 172.586 173.967 -1.381 1
1 517 . 4 1 1 A 41 41 ILE CA C 130 58.090 59.203 -1.113 1
1 518 . 4 1 1 A 41 41 ILE CB C 130 43.320 42.026 1.294 1
1 522 . 4 1 1 A 41 41 ILE N N 130 114.060 119.384 -5.324 1
1 523 . 4 1 1 A 42 42 PHE H H 131 9.206 8.736 0.470 1
1 524 . 4 1 1 A 42 42 PHE HA H 131 5.159 4.699 0.460 1
1 532 . 4 1 1 A 42 42 PHE C C 131 174.931 175.723 -0.792 1
1 533 . 4 1 1 A 42 42 PHE CA C 131 57.790 57.974 -0.184 1
1 534 . 4 1 1 A 42 42 PHE CB C 131 42.220 39.044 3.176 1
1 538 . 4 1 1 A 42 42 PHE N N 131 126.002 128.375 -2.373 1
1 539 . 4 1 1 A 43 43 VAL H H 132 8.502 8.843 -0.341 1
1 540 . 4 1 1 A 43 43 VAL HA H 132 4.921 4.683 0.238 1
1 548 . 4 1 1 A 43 43 VAL C C 132 178.219 175.465 2.754 1
1 549 . 4 1 1 A 43 43 VAL CA C 132 59.600 60.046 -0.446 1
1 550 . 4 1 1 A 43 43 VAL CB C 132 35.920 35.689 0.231 1
1 553 . 4 1 1 A 43 43 VAL N N 132 119.068 123.303 -4.235 1
1 554 . 4 1 1 A 44 44 LYS H H 133 10.036 8.727 1.309 1
1 555 . 4 1 1 A 44 44 LYS HA H 133 5.070 4.319 0.751 1
1 564 . 4 1 1 A 44 44 LYS C C 133 177.276 177.882 -0.606 1
1 565 . 4 1 1 A 44 44 LYS CA C 133 56.720 57.349 -0.629 1
1 566 . 4 1 1 A 44 44 LYS CB C 133 34.410 32.814 1.596 1
1 570 . 4 1 1 A 44 44 LYS N N 133 130.934 124.762 6.172 1
1 571 . 4 1 1 A 45 45 ASN H H 134 8.093 8.805 -0.712 1
1 572 . 4 1 1 A 45 45 ASN HA H 134 4.152 4.767 -0.615 1
1 577 . 4 1 1 A 45 45 ASN C C 134 174.087 175.143 -1.056 1
1 578 . 4 1 1 A 45 45 ASN CA C 134 55.360 55.921 -0.561 1
1 579 . 4 1 1 A 45 45 ASN CB C 134 37.530 39.139 -1.609 1
1 580 . 4 1 1 A 45 45 ASN N N 134 117.963 122.140 -4.177 1
1 582 . 4 1 1 A 46 46 SER H H 135 7.524 7.748 -0.224 1
1 583 . 4 1 1 A 46 46 SER HA H 135 4.219 4.575 -0.356 1
1 586 . 4 1 1 A 46 46 SER C C 135 174.490 174.187 0.303 1
1 587 . 4 1 1 A 46 46 SER CA C 135 57.090 55.844 1.246 1
1 588 . 4 1 1 A 46 46 SER CB C 135 63.860 66.346 -2.486 1
1 589 . 4 1 1 A 46 46 SER N N 135 105.939 108.717 -2.778 1
1 590 . 4 1 1 A 47 47 ASP H H 136 9.113 9.086 0.027 1
1 591 . 4 1 1 A 47 47 ASP HA H 136 4.220 4.227 -0.007 1
1 594 . 4 1 1 A 47 47 ASP CA C 136 57.610 57.197 0.413 1
1 595 . 4 1 1 A 47 47 ASP CB C 136 40.810 40.819 -0.009 1
1 596 . 4 1 1 A 47 47 ASP N N 136 120.995 122.795 -1.800 1
1 597 . 4 1 1 A 48 48 GLY H H 137 8.181 8.060 0.121 1
1 598 . 4 1 1 A 48 48 GLY HA2 H 137 4.120 3.883 0.237 1
1 599 . 4 1 1 A 48 48 GLY HA3 H 137 3.659 3.884 -0.225 1
1 600 . 4 1 1 A 48 48 GLY C C 137 174.062 173.030 1.032 1
1 601 . 4 1 1 A 48 48 GLY CA C 137 45.130 45.726 -0.596 1
1 602 . 4 1 1 A 48 48 GLY N N 137 106.197 106.622 -0.425 1
1 603 . 4 1 1 A 49 49 SER H H 138 7.179 7.490 -0.311 1
1 604 . 4 1 1 A 49 49 SER HA H 138 4.383 4.969 -0.586 1
1 607 . 4 1 1 A 49 49 SER C C 138 173.864 173.565 0.299 1
1 608 . 4 1 1 A 49 49 SER CA C 138 57.614 57.512 0.102 1
1 609 . 4 1 1 A 49 49 SER CB C 138 65.100 66.744 -1.644 1
1 610 . 4 1 1 A 49 49 SER N N 138 115.015 114.256 0.759 1
1 611 . 4 1 1 A 50 50 ASP H H 139 8.078 8.442 -0.364 1
1 612 . 4 1 1 A 50 50 ASP HA H 139 4.642 4.832 -0.190 1
1 615 . 4 1 1 A 50 50 ASP C C 139 174.261 175.497 -1.236 1
1 616 . 4 1 1 A 50 50 ASP CA C 139 52.406 54.882 -2.476 1
1 617 . 4 1 1 A 50 50 ASP CB C 139 40.254 41.163 -0.909 1
1 618 . 4 1 1 A 50 50 ASP N N 139 122.400 123.289 -0.889 1
1 619 . 4 1 1 A 51 51 VAL H H 140 8.111 7.516 0.595 1
1 620 . 4 1 1 A 51 51 VAL HA H 140 4.360 4.331 0.029 1
1 628 . 4 1 1 A 51 51 VAL C C 140 176.147 174.375 1.772 1
1 629 . 4 1 1 A 51 51 VAL CA C 140 62.670 61.584 1.086 1
1 630 . 4 1 1 A 51 51 VAL CB C 140 33.930 32.457 1.473 1
1 632 . 4 1 1 A 51 51 VAL N N 140 120.374 120.173 0.201 1
1 633 . 4 1 1 A 52 52 CYS H H 141 8.358 9.105 -0.747 1
1 634 . 4 1 1 A 52 52 CYS HA H 141 4.957 5.391 -0.434 1
1 637 . 4 1 1 A 52 52 CYS C C 141 173.070 172.884 0.186 1
1 638 . 4 1 1 A 52 52 CYS CA C 141 53.380 54.538 -1.158 1
1 639 . 4 1 1 A 52 52 CYS CB C 141 46.110 45.721 0.389 1
1 640 . 4 1 1 A 52 52 CYS N N 141 121.305 129.166 -7.861 1
1 641 . 4 1 1 A 53 53 THR H H 142 8.929 8.750 0.179 1
1 642 . 4 1 1 A 53 53 THR HA H 142 4.498 4.862 -0.364 1
1 648 . 4 1 1 A 53 53 THR C C 142 172.151 172.410 -0.259 1
1 649 . 4 1 1 A 53 53 THR CA C 142 62.960 61.133 1.827 1
1 650 . 4 1 1 A 53 53 THR CB C 142 70.540 72.675 -2.135 1
1 652 . 4 1 1 A 53 53 THR N N 142 120.105 118.091 2.014 1
1 653 . 4 1 1 A 54 54 LEU H H 143 8.448 8.642 -0.194 1
1 654 . 4 1 1 A 54 54 LEU HA H 143 4.322 4.756 -0.434 1
1 664 . 4 1 1 A 54 54 LEU C C 143 174.484 174.498 -0.014 1
1 665 . 4 1 1 A 54 54 LEU CA C 143 54.596 53.325 1.271 1
1 666 . 4 1 1 A 54 54 LEU CB C 143 42.396 43.295 -0.899 1
1 670 . 4 1 1 A 54 54 LEU N N 143 128.819 128.596 0.223 1
1 671 . 4 1 1 A 55 55 PHE H H 144 8.661 8.576 0.085 1
1 672 . 4 1 1 A 55 55 PHE HA H 144 5.459 4.920 0.539 1
1 680 . 4 1 1 A 55 55 PHE C C 144 176.035 174.781 1.254 1
1 681 . 4 1 1 A 55 55 PHE CA C 144 55.020 56.903 -1.883 1
1 682 . 4 1 1 A 55 55 PHE CB C 144 44.100 42.391 1.709 1
1 686 . 4 1 1 A 55 55 PHE N N 144 121.897 126.480 -4.583 1
1 687 . 4 1 1 A 56 56 ASP H H 145 11.616 8.533 3.083 1
1 688 . 4 1 1 A 56 56 ASP HA H 145 4.417 4.707 -0.290 1
1 691 . 4 1 1 A 56 56 ASP C C 145 176.748 177.062 -0.314 1
1 692 . 4 1 1 A 56 56 ASP CA C 145 55.844 54.199 1.645 1
1 693 . 4 1 1 A 56 56 ASP CB C 145 44.390 43.096 1.294 1
1 694 . 4 1 1 A 56 56 ASP N N 145 122.131 121.211 0.920 1
1 695 . 4 1 1 A 57 57 ALA H H 146 8.508 9.123 -0.615 1
1 696 . 4 1 1 A 57 57 ALA HA H 146 3.797 4.060 -0.263 1
1 700 . 4 1 1 A 57 57 ALA C C 146 178.696 180.033 -1.337 1
1 701 . 4 1 1 A 57 57 ALA CA C 146 55.990 55.267 0.723 1
1 702 . 4 1 1 A 57 57 ALA CB C 146 18.840 18.176 0.664 1
1 703 . 4 1 1 A 57 57 ALA N N 146 130.243 128.542 1.701 1
1 704 . 4 1 1 A 58 58 ALA H H 147 8.378 7.802 0.576 1
1 705 . 4 1 1 A 58 58 ALA HA H 147 4.078 4.181 -0.103 1
1 709 . 4 1 1 A 58 58 ALA C C 147 181.091 179.849 1.242 1
1 710 . 4 1 1 A 58 58 ALA CA C 147 54.770 54.908 -0.138 1
1 711 . 4 1 1 A 58 58 ALA CB C 147 17.700 18.323 -0.623 1
1 712 . 4 1 1 A 58 58 ALA N N 147 121.997 119.977 2.020 1
1 713 . 4 1 1 A 59 59 ALA H H 148 9.138 7.965 1.173 1
1 714 . 4 1 1 A 59 59 ALA HA H 148 3.975 4.113 -0.138 1
1 718 . 4 1 1 A 59 59 ALA C C 148 180.508 179.781 0.727 1
1 719 . 4 1 1 A 59 59 ALA CA C 148 54.840 54.996 -0.156 1
1 720 . 4 1 1 A 59 59 ALA CB C 148 18.600 18.627 -0.027 1
1 721 . 4 1 1 A 59 59 ALA N N 148 123.595 120.062 3.533 1
1 722 . 4 1 1 A 60 60 PHE H H 149 8.814 8.046 0.768 1
1 723 . 4 1 1 A 60 60 PHE HA H 149 3.722 3.954 -0.232 1
1 731 . 4 1 1 A 60 60 PHE C C 149 176.773 177.479 -0.706 1
1 732 . 4 1 1 A 60 60 PHE CA C 149 62.030 61.450 0.580 1
1 733 . 4 1 1 A 60 60 PHE CB C 149 39.960 38.952 1.008 1
1 737 . 4 1 1 A 60 60 PHE N N 149 120.354 119.961 0.393 1
1 738 . 4 1 1 A 61 61 SER H H 150 8.276 8.215 0.061 1
1 739 . 4 1 1 A 61 61 SER HA H 150 3.880 4.045 -0.165 1
1 742 . 4 1 1 A 61 61 SER C C 150 177.691 176.496 1.195 1
1 743 . 4 1 1 A 61 61 SER CA C 150 62.190 61.496 0.694 1
1 744 . 4 1 1 A 61 61 SER CB C 150 63.016 62.911 0.105 1
1 745 . 4 1 1 A 61 61 SER N N 150 112.086 114.240 -2.154 1
1 746 . 4 1 1 A 62 62 ARG H H 151 7.829 7.740 0.089 1
1 747 . 4 1 1 A 62 62 ARG HA H 151 3.971 4.030 -0.059 1
1 754 . 4 1 1 A 62 62 ARG C C 151 178.287 178.332 -0.045 1
1 755 . 4 1 1 A 62 62 ARG CA C 151 59.340 58.762 0.578 1
1 756 . 4 1 1 A 62 62 ARG CB C 151 29.760 30.118 -0.358 1
1 759 . 4 1 1 A 62 62 ARG N N 151 121.090 119.282 1.808 1
1 760 . 4 1 1 A 63 63 LEU H H 152 7.390 7.691 -0.301 1
1 761 . 4 1 1 A 63 63 LEU HA H 152 3.791 3.931 -0.140 1
1 771 . 4 1 1 A 63 63 LEU C C 152 179.106 178.312 0.794 1
1 772 . 4 1 1 A 63 63 LEU CA C 152 58.900 58.196 0.704 1
1 773 . 4 1 1 A 63 63 LEU CB C 152 41.140 41.368 -0.228 1
1 777 . 4 1 1 A 63 63 LEU N N 152 121.129 122.220 -1.091 1
1 778 . 4 1 1 A 64 64 VAL H H 153 7.552 7.822 -0.270 1
1 779 . 4 1 1 A 64 64 VAL HA H 153 3.411 3.434 -0.023 1
1 787 . 4 1 1 A 64 64 VAL C C 153 180.595 178.634 1.961 1
1 788 . 4 1 1 A 64 64 VAL CA C 153 65.644 66.152 -0.508 1
1 789 . 4 1 1 A 64 64 VAL CB C 153 31.410 31.427 -0.017 1
1 792 . 4 1 1 A 64 64 VAL N N 153 118.280 119.148 -0.868 1
1 793 . 4 1 1 A 65 65 GLY H H 154 8.061 8.026 0.035 1
1 794 . 4 1 1 A 65 65 GLY HA2 H 154 3.846 3.817 0.029 1
1 795 . 4 1 1 A 65 65 GLY HA3 H 154 3.809 3.818 -0.009 1
1 796 . 4 1 1 A 65 65 GLY C C 154 175.235 176.240 -1.005 1
1 797 . 4 1 1 A 65 65 GLY CA C 154 46.630 46.689 -0.059 1
1 798 . 4 1 1 A 65 65 GLY N N 154 108.622 107.576 1.046 1
1 799 . 4 1 1 A 66 66 GLU H H 155 7.528 7.626 -0.098 1
1 800 . 4 1 1 A 66 66 GLU HA H 155 4.228 4.275 -0.047 1
1 805 . 4 1 1 A 66 66 GLU C C 155 176.761 176.846 -0.085 1
1 806 . 4 1 1 A 66 66 GLU CA C 155 56.590 56.531 0.059 1
1 807 . 4 1 1 A 66 66 GLU CB C 155 30.490 29.967 0.523 1
1 809 . 4 1 1 A 66 66 GLU N N 155 118.361 118.876 -0.515 1
1 810 . 4 1 1 A 67 67 GLY H H 156 7.884 7.806 0.078 1
1 811 . 4 1 1 A 67 67 GLY HA2 H 156 3.918 3.865 0.053 1
1 812 . 4 1 1 A 67 67 GLY HA3 H 156 3.747 3.875 -0.128 1
1 813 . 4 1 1 A 67 67 GLY C C 156 174.788 174.455 0.333 1
1 814 . 4 1 1 A 67 67 GLY CA C 156 45.890 45.597 0.293 1
1 815 . 4 1 1 A 67 67 GLY N N 156 108.465 108.533 -0.068 1
1 816 . 4 1 1 A 68 68 LEU H H 157 7.332 7.521 -0.189 1
1 817 . 4 1 1 A 68 68 LEU HA H 157 4.361 4.540 -0.179 1
1 827 . 4 1 1 A 68 68 LEU CA C 157 53.060 52.296 0.764 1
1 828 . 4 1 1 A 68 68 LEU CB C 157 41.100 41.557 -0.457 1
1 832 . 4 1 1 A 68 68 LEU N N 157 121.920 121.684 0.236 1
1 833 . 4 1 1 A 69 69 PRO HA H 158 4.485 4.612 -0.127 1
1 840 . 4 1 1 A 69 69 PRO C C 158 174.602 176.192 -1.590 1
1 841 . 4 1 1 A 69 69 PRO CA C 158 61.556 62.225 -0.669 1
1 842 . 4 1 1 A 69 69 PRO CB C 158 32.370 32.874 -0.504 1
1 845 . 4 1 1 A 70 70 HIS H H 159 8.734 8.692 0.042 1
1 846 . 4 1 1 A 70 70 HIS HA H 159 3.947 4.629 -0.682 1
1 852 . 4 1 1 A 70 70 HIS CA C 159 56.250 55.245 1.005 1
1 853 . 4 1 1 A 70 70 HIS CB C 159 32.280 31.102 1.178 1
1 856 . 4 1 1 A 70 70 HIS N N 159 119.423 120.691 -1.268 1
1 857 . 4 1 1 A 71 71 PRO HA H 160 4.424 4.174 0.250 1
1 864 . 4 1 1 A 71 71 PRO C C 160 177.567 178.435 -0.868 1
1 865 . 4 1 1 A 71 71 PRO CA C 160 64.574 65.636 -1.062 1
1 866 . 4 1 1 A 71 71 PRO CB C 160 32.340 31.706 0.634 1
1 869 . 4 1 1 A 72 72 LEU H H 161 10.123 7.593 2.530 1
1 870 . 4 1 1 A 72 72 LEU HA H 161 4.778 4.330 0.448 1
1 880 . 4 1 1 A 72 72 LEU C C 161 178.721 178.100 0.621 1
1 881 . 4 1 1 A 72 72 LEU CA C 161 55.800 57.243 -1.443 1
1 882 . 4 1 1 A 72 72 LEU CB C 161 42.440 42.993 -0.553 1
1 886 . 4 1 1 A 72 72 LEU N N 161 117.374 117.561 -0.187 1
1 887 . 4 1 1 A 73 73 THR H H 162 7.523 7.860 -0.337 1
1 888 . 4 1 1 A 73 73 THR HA H 162 4.291 4.530 -0.239 1
1 893 . 4 1 1 A 73 73 THR C C 162 175.557 174.391 1.166 1
1 894 . 4 1 1 A 73 73 THR CA C 162 61.440 62.917 -1.477 1
1 895 . 4 1 1 A 73 73 THR CB C 162 70.500 69.823 0.677 1
1 897 . 4 1 1 A 73 73 THR N N 162 107.787 112.463 -4.676 1
1 898 . 4 1 1 A 74 74 ARG H H 163 8.361 7.789 0.572 1
1 899 . 4 1 1 A 74 74 ARG HA H 163 3.836 4.251 -0.415 1
1 906 . 4 1 1 A 74 74 ARG C C 163 174.701 175.047 -0.346 1
1 907 . 4 1 1 A 74 74 ARG CA C 163 57.980 57.285 0.695 1
1 908 . 4 1 1 A 74 74 ARG CB C 163 26.770 26.991 -0.221 1
1 911 . 4 1 1 A 74 74 ARG N N 163 115.130 119.033 -3.903 1
1 912 . 4 1 1 A 75 75 GLU H H 164 7.430 8.047 -0.617 1
1 913 . 4 1 1 A 75 75 GLU HA H 164 4.636 4.544 0.092 1
1 918 . 4 1 1 A 75 75 GLU CA C 164 53.699 54.962 -1.263 1
1 919 . 4 1 1 A 75 75 GLU CB C 164 29.550 28.315 1.235 1
1 921 . 4 1 1 A 75 75 GLU N N 164 120.076 118.889 1.187 1
1 922 . 4 1 1 A 76 76 PRO HA H 165 4.272 4.516 -0.244 1
1 929 . 4 1 1 A 76 76 PRO C C 165 176.649 176.897 -0.248 1
1 930 . 4 1 1 A 76 76 PRO CA C 165 63.204 63.041 0.163 1
1 931 . 4 1 1 A 76 76 PRO CB C 165 31.680 31.607 0.073 1
1 934 . 4 1 1 A 77 77 ILE H H 166 8.812 8.212 0.600 1
1 935 . 4 1 1 A 77 77 ILE HA H 166 3.838 4.278 -0.440 1
1 945 . 4 1 1 A 77 77 ILE C C 166 175.235 175.442 -0.207 1
1 946 . 4 1 1 A 77 77 ILE CA C 166 62.816 61.003 1.813 1
1 947 . 4 1 1 A 77 77 ILE CB C 166 37.750 36.852 0.898 1
1 951 . 4 1 1 A 77 77 ILE N N 166 123.831 124.049 -0.218 1
1 952 . 4 1 1 A 78 78 THR H H 167 6.625 8.532 -1.907 1
1 953 . 4 1 1 A 78 78 THR HA H 167 4.632 4.938 -0.306 1
1 958 . 4 1 1 A 78 78 THR C C 167 174.143 175.283 -1.140 1
1 959 . 4 1 1 A 78 78 THR CA C 167 58.750 59.514 -0.764 1
1 960 . 4 1 1 A 78 78 THR CB C 167 71.320 71.368 -0.048 1
1 962 . 4 1 1 A 78 78 THR N N 167 115.293 120.119 -4.826 1
1 963 . 4 1 1 A 79 79 ALA H H 168 9.088 9.101 -0.013 1
1 964 . 4 1 1 A 79 79 ALA HA H 168 3.916 4.104 -0.188 1
1 968 . 4 1 1 A 79 79 ALA C C 168 179.770 179.462 0.308 1
1 969 . 4 1 1 A 79 79 ALA CA C 168 55.480 55.002 0.478 1
1 970 . 4 1 1 A 79 79 ALA CB C 168 17.630 18.386 -0.756 1
1 971 . 4 1 1 A 79 79 ALA N N 168 122.102 127.649 -5.547 1
1 972 . 4 1 1 A 80 80 SER H H 169 7.988 7.674 0.314 1
1 973 . 4 1 1 A 80 80 SER HA H 169 4.091 4.239 -0.148 1
1 976 . 4 1 1 A 80 80 SER C C 169 175.836 176.459 -0.623 1
1 977 . 4 1 1 A 80 80 SER CA C 169 60.750 61.582 -0.832 1
1 978 . 4 1 1 A 80 80 SER CB C 169 62.510 63.048 -0.538 1
1 979 . 4 1 1 A 80 80 SER N N 169 109.660 113.281 -3.621 1
1 980 . 4 1 1 A 81 81 ILE H H 170 7.052 7.704 -0.652 1
1 981 . 4 1 1 A 81 81 ILE HA H 170 4.344 4.018 0.326 1
1 991 . 4 1 1 A 81 81 ILE C C 170 174.236 176.568 -2.332 1
1 992 . 4 1 1 A 81 81 ILE CA C 170 61.760 64.078 -2.318 1
1 993 . 4 1 1 A 81 81 ILE CB C 170 37.950 37.287 0.663 1
1 997 . 4 1 1 A 81 81 ILE N N 170 112.623 115.559 -2.936 1
1 998 . 4 1 1 A 82 82 ILE H H 171 7.345 7.569 -0.224 1
1 999 . 4 1 1 A 82 82 ILE HA H 171 4.288 4.032 0.256 1
1 1009 . 4 1 1 A 82 82 ILE C C 171 174.931 175.215 -0.284 1
1 1010 . 4 1 1 A 82 82 ILE CA C 171 61.420 61.623 -0.203 1
1 1011 . 4 1 1 A 82 82 ILE CB C 171 37.230 37.779 -0.549 1
1 1015 . 4 1 1 A 82 82 ILE N N 171 124.260 124.653 -0.393 1
1 1016 . 4 1 1 A 83 83 VAL H H 172 7.843 8.705 -0.862 1
1 1017 . 4 1 1 A 83 83 VAL HA H 172 4.818 4.995 -0.177 1
1 1025 . 4 1 1 A 83 83 VAL C C 172 174.918 175.836 -0.918 1
1 1026 . 4 1 1 A 83 83 VAL CA C 172 58.910 59.751 -0.841 1
1 1027 . 4 1 1 A 83 83 VAL CB C 172 34.570 34.551 0.019 1
1 1030 . 4 1 1 A 83 83 VAL N N 172 118.856 121.901 -3.045 1
1 1031 . 4 1 1 A 84 84 LYS H H 173 8.347 8.611 -0.264 1
1 1032 . 4 1 1 A 84 84 LYS HA H 173 4.356 4.529 -0.173 1
1 1041 . 4 1 1 A 84 84 LYS C C 173 178.653 178.609 0.044 1
1 1042 . 4 1 1 A 84 84 LYS CA C 173 56.360 55.681 0.679 1
1 1043 . 4 1 1 A 84 84 LYS CB C 173 33.366 33.169 0.197 1
1 1047 . 4 1 1 A 84 84 LYS N N 173 119.602 121.049 -1.447 1
1 1048 . 4 1 1 A 85 85 HIS H H 174 9.143 9.118 0.025 1
1 1049 . 4 1 1 A 85 85 HIS HA H 174 4.013 4.245 -0.232 1
1 1053 . 4 1 1 A 85 85 HIS C C 174 176.606 176.783 -0.177 1
1 1054 . 4 1 1 A 85 85 HIS CA C 174 58.820 60.386 -1.566 1
1 1055 . 4 1 1 A 85 85 HIS CB C 174 28.186 29.842 -1.656 1
1 1057 . 4 1 1 A 85 85 HIS N N 174 120.022 122.567 -2.545 1
1 1058 . 4 1 1 A 86 86 GLU H H 175 8.403 8.283 0.120 1
1 1059 . 4 1 1 A 86 86 GLU HA H 175 3.863 3.804 0.059 1
1 1064 . 4 1 1 A 86 86 GLU C C 175 177.040 178.933 -1.893 1
1 1065 . 4 1 1 A 86 86 GLU CA C 175 57.830 60.038 -2.208 1
1 1066 . 4 1 1 A 86 86 GLU CB C 175 28.690 29.201 -0.511 1
1 1068 . 4 1 1 A 86 86 GLU N N 175 116.124 118.001 -1.877 1
1 1069 . 4 1 1 A 87 87 GLU H H 176 7.669 7.967 -0.298 1
1 1070 . 4 1 1 A 87 87 GLU HA H 176 4.039 4.398 -0.359 1
1 1075 . 4 1 1 A 87 87 GLU C C 176 175.688 177.420 -1.732 1
1 1076 . 4 1 1 A 87 87 GLU CA C 176 57.906 58.904 -0.998 1
1 1077 . 4 1 1 A 87 87 GLU CB C 176 30.430 28.980 1.450 1
1 1079 . 4 1 1 A 87 87 GLU N N 176 116.183 119.106 -2.923 1
1 1080 . 4 1 1 A 88 88 CYS H H 177 6.750 7.275 -0.525 1
1 1081 . 4 1 1 A 88 88 CYS HA H 177 4.991 4.591 0.400 1
1 1084 . 4 1 1 A 88 88 CYS C C 177 172.325 173.652 -1.327 1
1 1085 . 4 1 1 A 88 88 CYS CA C 177 55.030 54.356 0.674 1
1 1086 . 4 1 1 A 88 88 CYS CB C 177 45.610 42.160 3.450 1
1 1087 . 4 1 1 A 88 88 CYS N N 177 114.838 117.336 -2.498 1
1 1088 . 4 1 1 A 89 89 ILE H H 178 9.128 8.885 0.243 1
1 1089 . 4 1 1 A 89 89 ILE HA H 178 4.536 4.890 -0.354 1
1 1099 . 4 1 1 A 89 89 ILE C C 178 174.893 174.420 0.473 1
1 1100 . 4 1 1 A 89 89 ILE CA C 178 59.160 59.318 -0.158 1
1 1101 . 4 1 1 A 89 89 ILE CB C 178 41.840 40.754 1.086 1
1 1105 . 4 1 1 A 89 89 ILE N N 178 120.564 121.256 -0.692 1
1 1106 . 4 1 1 A 90 90 TYR H H 179 9.349 9.013 0.336 1
1 1107 . 4 1 1 A 90 90 TYR HA H 179 3.568 4.185 -0.617 1
1 1112 . 4 1 1 A 90 90 TYR C C 179 173.950 173.854 0.096 1
1 1113 . 4 1 1 A 90 90 TYR CA C 179 61.180 58.064 3.116 1
1 1114 . 4 1 1 A 90 90 TYR CB C 179 37.530 38.316 -0.786 1
1 1116 . 4 1 1 A 90 90 TYR N N 179 129.033 126.552 2.481 1
1 1117 . 4 1 1 A 91 91 ASP H H 180 7.367 8.287 -0.920 1
1 1118 . 4 1 1 A 91 91 ASP HA H 180 4.662 4.545 0.117 1
1 1121 . 4 1 1 A 91 91 ASP C C 180 175.291 175.537 -0.246 1
1 1122 . 4 1 1 A 91 91 ASP CA C 180 52.230 52.391 -0.161 1
1 1123 . 4 1 1 A 91 91 ASP CB C 180 43.650 42.056 1.594 1
1 1124 . 4 1 1 A 91 91 ASP N N 180 129.305 128.605 0.700 1
1 1125 . 4 1 1 A 92 92 ASP H H 181 8.783 8.696 0.087 1
1 1126 . 4 1 1 A 92 92 ASP HA H 181 4.114 3.915 0.199 1
1 1129 . 4 1 1 A 92 92 ASP C C 181 177.573 178.124 -0.551 1
1 1130 . 4 1 1 A 92 92 ASP CA C 181 56.390 57.241 -0.851 1
1 1131 . 4 1 1 A 92 92 ASP CB C 181 41.330 40.280 1.050 1
1 1132 . 4 1 1 A 92 92 ASP N N 181 125.665 125.451 0.214 1
1 1133 . 4 1 1 A 93 93 THR H H 182 8.284 7.858 0.426 1
1 1134 . 4 1 1 A 93 93 THR HA H 182 4.037 3.902 0.135 1
1 1139 . 4 1 1 A 93 93 THR C C 182 176.333 176.158 0.175 1
1 1140 . 4 1 1 A 93 93 THR CA C 182 65.320 66.606 -1.286 1
1 1141 . 4 1 1 A 93 93 THR CB C 182 68.560 68.246 0.314 1
1 1143 . 4 1 1 A 93 93 THR N N 182 114.688 116.789 -2.101 1
1 1144 . 4 1 1 A 94 94 ARG H H 183 7.784 7.451 0.333 1
1 1145 . 4 1 1 A 94 94 ARG HA H 183 4.142 4.275 -0.133 1
1 1152 . 4 1 1 A 94 94 ARG C C 183 177.015 177.075 -0.060 1
1 1153 . 4 1 1 A 94 94 ARG CA C 183 55.350 56.120 -0.770 1
1 1154 . 4 1 1 A 94 94 ARG CB C 183 30.930 31.106 -0.176 1
1 1157 . 4 1 1 A 94 94 ARG N N 183 120.156 118.640 1.516 1
1 1158 . 4 1 1 A 95 95 GLY H H 184 8.144 8.926 -0.782 1
1 1159 . 4 1 1 A 95 95 GLY HA2 H 184 3.839 3.878 -0.039 1
1 1160 . 4 1 1 A 95 95 GLY HA3 H 184 3.681 3.888 -0.207 1
1 1161 . 4 1 1 A 95 95 GLY C C 184 173.653 173.360 0.293 1
1 1162 . 4 1 1 A 95 95 GLY CA C 184 46.160 45.820 0.340 1
1 1163 . 4 1 1 A 95 95 GLY N N 184 107.879 108.710 -0.831 1
1 1164 . 4 1 1 A 96 96 ASN H H 185 6.855 7.348 -0.493 1
1 1165 . 4 1 1 A 96 96 ASN HA H 185 4.909 5.090 -0.181 1
1 1170 . 4 1 1 A 96 96 ASN C C 185 174.223 173.287 0.936 1
1 1171 . 4 1 1 A 96 96 ASN CA C 185 52.720 52.345 0.375 1
1 1172 . 4 1 1 A 96 96 ASN CB C 185 45.620 41.795 3.825 1
1 1173 . 4 1 1 A 96 96 ASN N N 185 113.382 116.847 -3.465 1
1 1175 . 4 1 1 A 97 97 PHE H H 186 9.228 8.600 0.628 1
1 1176 . 4 1 1 A 97 97 PHE HA H 186 4.579 4.847 -0.268 1
1 1183 . 4 1 1 A 97 97 PHE C C 186 174.794 175.801 -1.007 1
1 1184 . 4 1 1 A 97 97 PHE CA C 186 59.384 59.084 0.300 1
1 1185 . 4 1 1 A 97 97 PHE CB C 186 40.450 39.428 1.022 1
1 1188 . 4 1 1 A 97 97 PHE N N 186 118.661 119.692 -1.031 1
1 1189 . 4 1 1 A 98 98 ILE H H 187 8.908 8.983 -0.075 1
1 1190 . 4 1 1 A 98 98 ILE HA H 187 5.440 4.961 0.479 1
1 1200 . 4 1 1 A 98 98 ILE C C 187 176.171 174.626 1.545 1
1 1201 . 4 1 1 A 98 98 ILE CA C 187 57.610 59.515 -1.905 1
1 1202 . 4 1 1 A 98 98 ILE CB C 187 41.280 41.307 -0.027 1
1 1206 . 4 1 1 A 98 98 ILE N N 187 120.585 123.315 -2.730 1
1 1207 . 4 1 1 A 99 99 ILE H H 188 8.602 8.530 0.072 1
1 1208 . 4 1 1 A 99 99 ILE HA H 188 4.546 4.376 0.170 1
1 1218 . 4 1 1 A 99 99 ILE C C 188 176.668 175.164 1.504 1
1 1219 . 4 1 1 A 99 99 ILE CA C 188 58.920 60.765 -1.845 1
1 1220 . 4 1 1 A 99 99 ILE CB C 188 37.960 38.182 -0.222 1
1 1224 . 4 1 1 A 99 99 ILE N N 188 124.500 126.117 -1.617 1
1 1225 . 4 1 1 A 100 100 LYS H H 189 8.449 8.360 0.089 1
1 1226 . 4 1 1 A 100 100 LYS HA H 189 4.108 4.657 -0.549 1
1 1235 . 4 1 1 A 100 100 LYS C C 189 176.866 176.572 0.294 1
1 1236 . 4 1 1 A 100 100 LYS CA C 189 56.800 55.458 1.342 1
1 1237 . 4 1 1 A 100 100 LYS CB C 189 33.400 32.747 0.653 1
1 1241 . 4 1 1 A 100 100 LYS N N 189 128.581 127.234 1.347 1
1 1242 . 4 1 1 A 101 101 GLY H H 190 8.381 8.569 -0.188 1
1 1243 . 4 1 1 A 101 101 GLY HA2 H 190 3.946 3.758 0.188 1
1 1244 . 4 1 1 A 101 101 GLY HA3 H 190 3.828 3.760 0.068 1
1 1245 . 4 1 1 A 101 101 GLY C C 190 172.902 174.385 -1.483 1
1 1246 . 4 1 1 A 101 101 GLY CA C 190 44.920 46.637 -1.717 1
1 1247 . 4 1 1 A 101 101 GLY N N 190 111.183 113.193 -2.010 1
1 7 . 5 1 1 A 2 2 GLN H H 91 8.786 8.895 -0.109 1
1 8 . 5 1 1 A 2 2 GLN HA H 91 4.005 3.931 0.074 1
1 15 . 5 1 1 A 2 2 GLN C C 91 177.270 177.235 0.035 1
1 16 . 5 1 1 A 2 2 GLN CA C 91 58.220 59.309 -1.089 1
1 17 . 5 1 1 A 2 2 GLN CB C 91 28.650 28.308 0.342 1
1 19 . 5 1 1 A 2 2 GLN N N 91 121.993 121.882 0.111 1
1 21 . 5 1 1 A 3 3 GLU H H 92 8.430 8.508 -0.078 1
1 22 . 5 1 1 A 3 3 GLU HA H 92 4.007 4.071 -0.064 1
1 27 . 5 1 1 A 3 3 GLU C C 92 178.287 178.530 -0.243 1
1 28 . 5 1 1 A 3 3 GLU CA C 92 59.490 59.512 -0.022 1
1 29 . 5 1 1 A 3 3 GLU CB C 92 29.506 29.175 0.331 1
1 31 . 5 1 1 A 3 3 GLU N N 92 120.195 120.031 0.164 1
1 32 . 5 1 1 A 4 4 SER H H 93 8.209 7.362 0.847 1
1 33 . 5 1 1 A 4 4 SER HA H 93 4.272 4.272 0.000 1
1 36 . 5 1 1 A 4 4 SER C C 93 177.369 177.414 -0.045 1
1 37 . 5 1 1 A 4 4 SER CA C 93 61.044 61.349 -0.305 1
1 38 . 5 1 1 A 4 4 SER CB C 93 62.950 62.779 0.171 1
1 39 . 5 1 1 A 4 4 SER N N 93 115.524 114.256 1.268 1
1 40 . 5 1 1 A 5 5 ILE H H 94 8.080 7.566 0.514 1
1 41 . 5 1 1 A 5 5 ILE HA H 94 3.530 3.627 -0.097 1
1 51 . 5 1 1 A 5 5 ILE C C 94 177.778 177.507 0.271 1
1 52 . 5 1 1 A 5 5 ILE CA C 94 65.710 65.247 0.463 1
1 53 . 5 1 1 A 5 5 ILE CB C 94 37.800 37.383 0.417 1
1 57 . 5 1 1 A 5 5 ILE N N 94 124.148 122.092 2.056 1
1 58 . 5 1 1 A 6 6 GLN H H 95 8.374 8.194 0.180 1
1 59 . 5 1 1 A 6 6 GLN HA H 95 4.125 3.950 0.175 1
1 66 . 5 1 1 A 6 6 GLN C C 95 179.726 179.344 0.382 1
1 67 . 5 1 1 A 6 6 GLN CA C 95 59.190 58.960 0.230 1
1 68 . 5 1 1 A 6 6 GLN CB C 95 27.060 28.356 -1.296 1
1 70 . 5 1 1 A 6 6 GLN N N 95 118.257 118.529 -0.272 1
1 72 . 5 1 1 A 7 7 ASN H H 96 8.456 8.236 0.220 1
1 73 . 5 1 1 A 7 7 ASN HA H 96 4.446 4.545 -0.099 1
1 78 . 5 1 1 A 7 7 ASN C C 96 177.257 177.677 -0.420 1
1 79 . 5 1 1 A 7 7 ASN CA C 96 56.020 56.216 -0.196 1
1 80 . 5 1 1 A 7 7 ASN CB C 96 38.126 37.673 0.453 1
1 81 . 5 1 1 A 7 7 ASN N N 96 118.597 118.443 0.154 1
1 83 . 5 1 1 A 8 8 LYS H H 97 7.732 7.952 -0.220 1
1 84 . 5 1 1 A 8 8 LYS HA H 97 4.129 4.078 0.051 1
1 93 . 5 1 1 A 8 8 LYS C C 97 179.143 179.209 -0.066 1
1 94 . 5 1 1 A 8 8 LYS CA C 97 59.126 59.950 -0.824 1
1 95 . 5 1 1 A 8 8 LYS CB C 97 32.070 32.458 -0.388 1
1 99 . 5 1 1 A 8 8 LYS N N 97 122.381 120.475 1.906 1
1 100 . 5 1 1 A 9 9 ILE H H 98 8.452 7.918 0.534 1
1 101 . 5 1 1 A 9 9 ILE HA H 98 3.480 3.941 -0.461 1
1 111 . 5 1 1 A 9 9 ILE C C 98 177.406 178.775 -1.369 1
1 112 . 5 1 1 A 9 9 ILE CA C 98 66.430 64.096 2.334 1
1 113 . 5 1 1 A 9 9 ILE CB C 98 37.980 37.042 0.938 1
1 117 . 5 1 1 A 9 9 ILE N N 98 119.950 120.478 -0.528 1
1 118 . 5 1 1 A 10 10 SER H H 99 7.924 7.934 -0.010 1
1 119 . 5 1 1 A 10 10 SER HA H 99 3.983 4.295 -0.312 1
1 122 . 5 1 1 A 10 10 SER C C 99 176.327 176.229 0.098 1
1 123 . 5 1 1 A 10 10 SER CA C 99 61.990 61.222 0.768 1
1 124 . 5 1 1 A 10 10 SER CB C 99 62.790 63.421 -0.631 1
1 125 . 5 1 1 A 10 10 SER N N 99 113.568 118.296 -4.728 1
1 126 . 5 1 1 A 11 11 GLN H H 100 7.832 7.851 -0.019 1
1 127 . 5 1 1 A 11 11 GLN HA H 100 4.238 4.493 -0.255 1
1 134 . 5 1 1 A 11 11 GLN C C 100 178.088 177.776 0.312 1
1 135 . 5 1 1 A 11 11 GLN CA C 100 57.900 57.094 0.806 1
1 136 . 5 1 1 A 11 11 GLN CB C 100 29.790 30.043 -0.253 1
1 138 . 5 1 1 A 11 11 GLN N N 100 117.487 117.421 0.066 1
1 140 . 5 1 1 A 12 12 CYS H H 101 7.920 8.309 -0.389 1
1 141 . 5 1 1 A 12 12 CYS HA H 101 4.657 4.510 0.147 1
1 144 . 5 1 1 A 12 12 CYS C C 101 175.439 174.857 0.582 1
1 145 . 5 1 1 A 12 12 CYS CA C 101 60.654 61.709 -1.055 1
1 146 . 5 1 1 A 12 12 CYS CB C 101 29.310 26.649 2.661 1
1 147 . 5 1 1 A 12 12 CYS N N 101 114.221 118.022 -3.801 1
1 148 . 5 1 1 A 13 13 LYS H H 102 7.993 7.476 0.517 1
1 149 . 5 1 1 A 13 13 LYS HA H 102 5.038 4.499 0.539 1
1 158 . 5 1 1 A 13 13 LYS C C 102 174.757 176.321 -1.564 1
1 159 . 5 1 1 A 13 13 LYS CA C 102 56.660 56.075 0.585 1
1 160 . 5 1 1 A 13 13 LYS CB C 102 32.970 33.327 -0.357 1
1 164 . 5 1 1 A 13 13 LYS N N 102 123.841 119.586 4.255 1
1 165 . 5 1 1 A 14 14 PHE H H 103 8.822 8.776 0.046 1
1 166 . 5 1 1 A 14 14 PHE HA H 103 5.058 5.052 0.006 1
1 174 . 5 1 1 A 14 14 PHE C C 103 173.560 173.471 0.089 1
1 175 . 5 1 1 A 14 14 PHE CA C 103 55.470 55.926 -0.456 1
1 176 . 5 1 1 A 14 14 PHE CB C 103 41.760 41.095 0.665 1
1 180 . 5 1 1 A 14 14 PHE N N 103 118.421 116.423 1.998 1
1 181 . 5 1 1 A 15 15 SER H H 104 8.826 8.477 0.349 1
1 182 . 5 1 1 A 15 15 SER HA H 104 4.602 4.819 -0.217 1
1 185 . 5 1 1 A 15 15 SER C C 104 173.851 173.633 0.218 1
1 186 . 5 1 1 A 15 15 SER CA C 104 58.610 57.778 0.832 1
1 187 . 5 1 1 A 15 15 SER CB C 104 62.690 62.479 0.211 1
1 188 . 5 1 1 A 15 15 SER N N 104 117.781 115.126 2.655 1
1 189 . 5 1 1 A 16 16 VAL H H 105 7.839 8.072 -0.233 1
1 190 . 5 1 1 A 16 16 VAL HA H 105 3.390 4.279 -0.889 1
1 198 . 5 1 1 A 16 16 VAL C C 105 174.987 175.196 -0.209 1
1 199 . 5 1 1 A 16 16 VAL CA C 105 63.650 62.415 1.235 1
1 200 . 5 1 1 A 16 16 VAL CB C 105 31.410 30.158 1.252 1
1 203 . 5 1 1 A 16 16 VAL N N 105 129.036 126.076 2.960 1
1 204 . 5 1 1 A 17 17 CYS H H 106 8.536 8.027 0.509 1
1 205 . 5 1 1 A 17 17 CYS HA H 106 5.011 4.939 0.072 1
1 208 . 5 1 1 A 17 17 CYS CA C 106 55.260 56.456 -1.196 1
1 209 . 5 1 1 A 17 17 CYS CB C 106 28.210 30.076 -1.866 1
1 210 . 5 1 1 A 17 17 CYS N N 106 130.045 127.514 2.531 1
1 211 . 5 1 1 A 18 18 PRO HA H 107 3.991 4.418 -0.427 1
1 218 . 5 1 1 A 18 18 PRO C C 107 178.188 178.015 0.173 1
1 219 . 5 1 1 A 18 18 PRO CA C 107 65.940 64.487 1.453 1
1 220 . 5 1 1 A 18 18 PRO CB C 107 32.000 32.000 0.000 1
1 223 . 5 1 1 A 19 19 GLU H H 108 9.260 8.950 0.310 1
1 224 . 5 1 1 A 19 19 GLU HA H 108 4.119 4.101 0.018 1
1 229 . 5 1 1 A 19 19 GLU C C 108 178.721 179.296 -0.575 1
1 230 . 5 1 1 A 19 19 GLU CA C 108 59.300 59.537 -0.237 1
1 231 . 5 1 1 A 19 19 GLU CB C 108 28.920 28.923 -0.003 1
1 233 . 5 1 1 A 19 19 GLU N N 108 118.270 116.241 2.029 1
1 234 . 5 1 1 A 20 20 ARG H H 109 7.672 7.602 0.070 1
1 235 . 5 1 1 A 20 20 ARG HA H 109 4.331 4.130 0.201 1
1 242 . 5 1 1 A 20 20 ARG C C 109 177.977 178.710 -0.733 1
1 243 . 5 1 1 A 20 20 ARG CA C 109 57.350 59.235 -1.885 1
1 244 . 5 1 1 A 20 20 ARG CB C 109 30.820 30.728 0.092 1
1 247 . 5 1 1 A 20 20 ARG N N 109 118.357 119.417 -1.060 1
1 248 . 5 1 1 A 21 21 LEU H H 110 7.601 7.862 -0.261 1
1 249 . 5 1 1 A 21 21 LEU HA H 110 4.380 4.360 0.020 1
1 259 . 5 1 1 A 21 21 LEU C C 110 176.562 176.437 0.125 1
1 260 . 5 1 1 A 21 21 LEU CA C 110 56.096 55.641 0.455 1
1 261 . 5 1 1 A 21 21 LEU CB C 110 44.016 42.246 1.770 1
1 265 . 5 1 1 A 21 21 LEU N N 110 118.626 119.176 -0.550 1
1 266 . 5 1 1 A 22 22 GLN H H 111 7.750 7.861 -0.111 1
1 267 . 5 1 1 A 22 22 GLN HA H 111 3.870 4.044 -0.174 1
1 274 . 5 1 1 A 22 22 GLN C C 111 173.336 174.159 -0.823 1
1 275 . 5 1 1 A 22 22 GLN CA C 111 56.510 57.268 -0.758 1
1 276 . 5 1 1 A 22 22 GLN CB C 111 26.800 26.520 0.280 1
1 278 . 5 1 1 A 22 22 GLN N N 111 113.926 115.584 -1.658 1
1 280 . 5 1 1 A 23 23 CYS H H 112 7.407 7.919 -0.512 1
1 281 . 5 1 1 A 23 23 CYS HA H 112 4.469 4.992 -0.523 1
1 284 . 5 1 1 A 23 23 CYS CA C 112 52.650 56.559 -3.909 1
1 285 . 5 1 1 A 23 23 CYS CB C 112 29.750 28.547 1.203 1
1 286 . 5 1 1 A 23 23 CYS N N 112 112.681 117.576 -4.895 1
1 287 . 5 1 1 A 24 24 PRO HA H 113 4.408 4.510 -0.102 1
1 294 . 5 1 1 A 24 24 PRO C C 113 178.175 177.722 0.453 1
1 295 . 5 1 1 A 24 24 PRO CA C 113 62.040 62.650 -0.610 1
1 296 . 5 1 1 A 24 24 PRO CB C 113 31.920 32.503 -0.583 1
1 299 . 5 1 1 A 25 25 LEU H H 114 8.593 8.850 -0.257 1
1 300 . 5 1 1 A 25 25 LEU HA H 114 3.765 4.066 -0.301 1
1 310 . 5 1 1 A 25 25 LEU C C 114 179.950 178.590 1.360 1
1 311 . 5 1 1 A 25 25 LEU CA C 114 57.674 58.082 -0.408 1
1 312 . 5 1 1 A 25 25 LEU CB C 114 40.690 41.525 -0.835 1
1 316 . 5 1 1 A 25 25 LEU N N 114 123.729 124.293 -0.564 1
1 317 . 5 1 1 A 26 26 GLU H H 115 9.108 8.151 0.957 1
1 318 . 5 1 1 A 26 26 GLU HA H 115 3.876 3.990 -0.114 1
1 323 . 5 1 1 A 26 26 GLU C C 115 177.505 179.258 -1.753 1
1 324 . 5 1 1 A 26 26 GLU CA C 115 59.410 59.566 -0.156 1
1 325 . 5 1 1 A 26 26 GLU CB C 115 28.460 29.170 -0.710 1
1 327 . 5 1 1 A 26 26 GLU N N 115 116.817 118.093 -1.276 1
1 328 . 5 1 1 A 27 27 ALA H H 116 7.360 7.851 -0.491 1
1 329 . 5 1 1 A 27 27 ALA HA H 116 4.408 3.912 0.496 1
1 333 . 5 1 1 A 27 27 ALA C C 116 177.046 178.218 -1.172 1
1 334 . 5 1 1 A 27 27 ALA CA C 116 52.970 54.628 -1.658 1
1 335 . 5 1 1 A 27 27 ALA CB C 116 19.916 17.903 2.013 1
1 336 . 5 1 1 A 27 27 ALA N N 116 118.966 121.378 -2.412 1
1 337 . 5 1 1 A 28 28 ILE H H 117 7.168 7.221 -0.053 1
1 338 . 5 1 1 A 28 28 ILE HA H 117 4.432 4.745 -0.313 1
1 348 . 5 1 1 A 28 28 ILE C C 117 172.641 175.597 -2.956 1
1 349 . 5 1 1 A 28 28 ILE CA C 117 59.980 60.114 -0.134 1
1 350 . 5 1 1 A 28 28 ILE CB C 117 37.350 37.723 -0.373 1
1 354 . 5 1 1 A 28 28 ILE N N 117 108.913 109.081 -0.168 1
1 355 . 5 1 1 A 29 29 GLN H H 118 6.562 7.673 -1.111 1
1 356 . 5 1 1 A 29 29 GLN HA H 118 3.922 4.169 -0.247 1
1 363 . 5 1 1 A 29 29 GLN C C 118 175.049 175.605 -0.556 1
1 364 . 5 1 1 A 29 29 GLN CA C 118 54.596 55.980 -1.384 1
1 365 . 5 1 1 A 29 29 GLN CB C 118 29.570 28.971 0.599 1
1 367 . 5 1 1 A 29 29 GLN N N 118 116.455 123.458 -7.003 1
1 369 . 5 1 1 A 30 30 CYS H H 119 8.138 8.373 -0.235 1
1 370 . 5 1 1 A 30 30 CYS HA H 119 4.580 4.488 0.092 1
1 373 . 5 1 1 A 30 30 CYS CA C 119 57.810 57.147 0.663 1
1 374 . 5 1 1 A 30 30 CYS CB C 119 30.200 28.725 1.475 1
1 375 . 5 1 1 A 30 30 CYS N N 119 134.136 125.392 8.744 1
1 376 . 5 1 1 A 31 31 PRO HA H 120 4.424 4.406 0.018 1
1 383 . 5 1 1 A 31 31 PRO C C 120 177.431 178.526 -1.095 1
1 384 . 5 1 1 A 31 31 PRO CA C 120 64.060 64.352 -0.292 1
1 385 . 5 1 1 A 31 31 PRO CB C 120 32.776 32.118 0.658 1
1 388 . 5 1 1 A 32 32 ILE H H 121 11.318 7.118 4.200 1
1 389 . 5 1 1 A 32 32 ILE HA H 121 4.038 3.938 0.100 1
1 399 . 5 1 1 A 32 32 ILE C C 121 178.485 177.635 0.850 1
1 400 . 5 1 1 A 32 32 ILE CA C 121 64.060 64.215 -0.155 1
1 401 . 5 1 1 A 32 32 ILE CB C 121 39.340 38.380 0.960 1
1 405 . 5 1 1 A 32 32 ILE N N 121 124.500 116.687 7.813 1
1 406 . 5 1 1 A 33 33 THR H H 122 9.928 7.403 2.525 1
1 407 . 5 1 1 A 33 33 THR HA H 122 4.048 4.462 -0.414 1
1 412 . 5 1 1 A 33 33 THR C C 122 175.793 174.440 1.353 1
1 413 . 5 1 1 A 33 33 THR CA C 122 62.990 61.487 1.503 1
1 414 . 5 1 1 A 33 33 THR CB C 122 70.300 69.085 1.215 1
1 416 . 5 1 1 A 33 33 THR N N 122 115.136 108.565 6.571 1
1 417 . 5 1 1 A 34 34 LEU H H 123 8.439 7.670 0.769 1
1 418 . 5 1 1 A 34 34 LEU HA H 123 3.912 4.094 -0.182 1
1 428 . 5 1 1 A 34 34 LEU C C 123 175.495 175.498 -0.003 1
1 429 . 5 1 1 A 34 34 LEU CA C 123 56.290 55.953 0.337 1
1 430 . 5 1 1 A 34 34 LEU CB C 123 38.500 39.726 -1.226 1
1 434 . 5 1 1 A 34 34 LEU N N 123 117.230 121.130 -3.900 1
1 435 . 5 1 1 A 35 35 GLU H H 124 7.816 7.529 0.287 1
1 436 . 5 1 1 A 35 35 GLU HA H 124 4.634 4.702 -0.068 1
1 441 . 5 1 1 A 35 35 GLU C C 124 174.838 174.141 0.697 1
1 442 . 5 1 1 A 35 35 GLU CA C 124 53.780 54.684 -0.904 1
1 443 . 5 1 1 A 35 35 GLU CB C 124 33.710 32.321 1.389 1
1 445 . 5 1 1 A 35 35 GLU N N 124 116.577 116.436 0.141 1
1 446 . 5 1 1 A 36 36 GLN H H 125 8.532 8.568 -0.036 1
1 447 . 5 1 1 A 36 36 GLN HA H 125 4.958 4.371 0.587 1
1 454 . 5 1 1 A 36 36 GLN CA C 125 53.350 53.851 -0.501 1
1 455 . 5 1 1 A 36 36 GLN CB C 125 29.950 29.927 0.023 1
1 457 . 5 1 1 A 36 36 GLN N N 125 123.034 121.484 1.550 1
1 459 . 5 1 1 A 37 37 PRO HA H 126 4.458 4.420 0.038 1
1 466 . 5 1 1 A 37 37 PRO C C 126 176.314 177.267 -0.953 1
1 467 . 5 1 1 A 37 37 PRO CA C 126 62.816 65.753 -2.937 1
1 468 . 5 1 1 A 37 37 PRO CB C 126 33.070 31.543 1.527 1
1 471 . 5 1 1 A 38 38 GLU H H 127 8.626 7.618 1.008 1
1 472 . 5 1 1 A 38 38 GLU HA H 127 4.274 4.481 -0.207 1
1 477 . 5 1 1 A 38 38 GLU C C 127 177.809 174.992 2.817 1
1 478 . 5 1 1 A 38 38 GLU CA C 127 58.730 58.332 0.398 1
1 479 . 5 1 1 A 38 38 GLU CB C 127 30.340 29.443 0.897 1
1 481 . 5 1 1 A 38 38 GLU N N 127 120.691 119.288 1.403 1
1 482 . 5 1 1 A 39 39 LYS H H 128 7.891 7.972 -0.081 1
1 483 . 5 1 1 A 39 39 LYS HA H 128 4.870 4.718 0.152 1
1 492 . 5 1 1 A 39 39 LYS C C 128 175.452 175.749 -0.297 1
1 493 . 5 1 1 A 39 39 LYS CA C 128 53.540 54.689 -1.149 1
1 494 . 5 1 1 A 39 39 LYS CB C 128 33.630 34.615 -0.985 1
1 498 . 5 1 1 A 39 39 LYS N N 128 118.149 118.012 0.137 1
1 499 . 5 1 1 A 40 40 GLY H H 129 8.524 8.021 0.503 1
1 500 . 5 1 1 A 40 40 GLY HA2 H 129 4.973 4.018 0.955 1
1 501 . 5 1 1 A 40 40 GLY HA3 H 129 2.459 4.174 -1.715 1
1 502 . 5 1 1 A 40 40 GLY C C 129 169.943 171.976 -2.033 1
1 503 . 5 1 1 A 40 40 GLY CA C 129 42.910 44.963 -2.053 1
1 504 . 5 1 1 A 40 40 GLY N N 129 112.845 110.332 2.513 1
1 505 . 5 1 1 A 41 41 ILE H H 130 8.659 8.166 0.493 1
1 506 . 5 1 1 A 41 41 ILE HA H 130 4.591 4.875 -0.284 1
1 516 . 5 1 1 A 41 41 ILE C C 130 172.586 173.914 -1.328 1
1 517 . 5 1 1 A 41 41 ILE CA C 130 58.090 59.176 -1.086 1
1 518 . 5 1 1 A 41 41 ILE CB C 130 43.320 41.899 1.421 1
1 522 . 5 1 1 A 41 41 ILE N N 130 114.060 119.234 -5.174 1
1 523 . 5 1 1 A 42 42 PHE H H 131 9.206 8.835 0.371 1
1 524 . 5 1 1 A 42 42 PHE HA H 131 5.159 4.916 0.243 1
1 532 . 5 1 1 A 42 42 PHE C C 131 174.931 176.092 -1.161 1
1 533 . 5 1 1 A 42 42 PHE CA C 131 57.790 57.711 0.079 1
1 534 . 5 1 1 A 42 42 PHE CB C 131 42.220 39.915 2.305 1
1 538 . 5 1 1 A 42 42 PHE N N 131 126.002 128.019 -2.017 1
1 539 . 5 1 1 A 43 43 VAL H H 132 8.502 8.987 -0.485 1
1 540 . 5 1 1 A 43 43 VAL HA H 132 4.921 4.662 0.259 1
1 548 . 5 1 1 A 43 43 VAL C C 132 178.219 175.489 2.730 1
1 549 . 5 1 1 A 43 43 VAL CA C 132 59.600 60.055 -0.455 1
1 550 . 5 1 1 A 43 43 VAL CB C 132 35.920 35.693 0.227 1
1 553 . 5 1 1 A 43 43 VAL N N 132 119.068 122.308 -3.240 1
1 554 . 5 1 1 A 44 44 LYS H H 133 10.036 8.669 1.367 1
1 555 . 5 1 1 A 44 44 LYS HA H 133 5.070 4.305 0.765 1
1 564 . 5 1 1 A 44 44 LYS C C 133 177.276 177.694 -0.418 1
1 565 . 5 1 1 A 44 44 LYS CA C 133 56.720 57.295 -0.575 1
1 566 . 5 1 1 A 44 44 LYS CB C 133 34.410 32.788 1.622 1
1 570 . 5 1 1 A 44 44 LYS N N 133 130.934 125.115 5.819 1
1 571 . 5 1 1 A 45 45 ASN H H 134 8.093 8.910 -0.817 1
1 572 . 5 1 1 A 45 45 ASN HA H 134 4.152 4.739 -0.587 1
1 577 . 5 1 1 A 45 45 ASN C C 134 174.087 175.204 -1.117 1
1 578 . 5 1 1 A 45 45 ASN CA C 134 55.360 55.960 -0.600 1
1 579 . 5 1 1 A 45 45 ASN CB C 134 37.530 39.189 -1.659 1
1 580 . 5 1 1 A 45 45 ASN N N 134 117.963 122.783 -4.820 1
1 582 . 5 1 1 A 46 46 SER H H 135 7.524 7.852 -0.328 1
1 583 . 5 1 1 A 46 46 SER HA H 135 4.219 4.724 -0.505 1
1 586 . 5 1 1 A 46 46 SER C C 135 174.490 174.316 0.174 1
1 587 . 5 1 1 A 46 46 SER CA C 135 57.090 55.665 1.425 1
1 588 . 5 1 1 A 46 46 SER CB C 135 63.860 66.587 -2.727 1
1 589 . 5 1 1 A 46 46 SER N N 135 105.939 108.814 -2.875 1
1 590 . 5 1 1 A 47 47 ASP H H 136 9.113 9.023 0.090 1
1 591 . 5 1 1 A 47 47 ASP HA H 136 4.220 4.234 -0.014 1
1 594 . 5 1 1 A 47 47 ASP CA C 136 57.610 57.152 0.458 1
1 595 . 5 1 1 A 47 47 ASP CB C 136 40.810 40.583 0.227 1
1 596 . 5 1 1 A 47 47 ASP N N 136 120.995 123.140 -2.145 1
1 597 . 5 1 1 A 48 48 GLY H H 137 8.181 8.198 -0.017 1
1 598 . 5 1 1 A 48 48 GLY HA2 H 137 4.120 3.950 0.170 1
1 599 . 5 1 1 A 48 48 GLY HA3 H 137 3.659 3.950 -0.291 1
1 600 . 5 1 1 A 48 48 GLY C C 137 174.062 173.600 0.462 1
1 601 . 5 1 1 A 48 48 GLY CA C 137 45.130 45.339 -0.209 1
1 602 . 5 1 1 A 48 48 GLY N N 137 106.197 106.238 -0.041 1
1 603 . 5 1 1 A 49 49 SER H H 138 7.179 7.349 -0.170 1
1 604 . 5 1 1 A 49 49 SER HA H 138 4.383 4.907 -0.524 1
1 607 . 5 1 1 A 49 49 SER C C 138 173.864 173.600 0.264 1
1 608 . 5 1 1 A 49 49 SER CA C 138 57.614 57.376 0.238 1
1 609 . 5 1 1 A 49 49 SER CB C 138 65.100 66.263 -1.163 1
1 610 . 5 1 1 A 49 49 SER N N 138 115.015 114.231 0.784 1
1 611 . 5 1 1 A 50 50 ASP H H 139 8.078 8.552 -0.474 1
1 612 . 5 1 1 A 50 50 ASP HA H 139 4.642 4.660 -0.018 1
1 615 . 5 1 1 A 50 50 ASP C C 139 174.261 175.865 -1.604 1
1 616 . 5 1 1 A 50 50 ASP CA C 139 52.406 55.604 -3.198 1
1 617 . 5 1 1 A 50 50 ASP CB C 139 40.254 41.084 -0.830 1
1 618 . 5 1 1 A 50 50 ASP N N 139 122.400 123.085 -0.685 1
1 619 . 5 1 1 A 51 51 VAL H H 140 8.111 7.457 0.654 1
1 620 . 5 1 1 A 51 51 VAL HA H 140 4.360 4.000 0.360 1
1 628 . 5 1 1 A 51 51 VAL C C 140 176.147 174.486 1.661 1
1 629 . 5 1 1 A 51 51 VAL CA C 140 62.670 62.610 0.060 1
1 630 . 5 1 1 A 51 51 VAL CB C 140 33.930 31.597 2.333 1
1 632 . 5 1 1 A 51 51 VAL N N 140 120.374 121.022 -0.648 1
1 633 . 5 1 1 A 52 52 CYS H H 141 8.358 8.675 -0.317 1
1 634 . 5 1 1 A 52 52 CYS HA H 141 4.957 5.439 -0.482 1
1 637 . 5 1 1 A 52 52 CYS C C 141 173.070 173.020 0.050 1
1 638 . 5 1 1 A 52 52 CYS CA C 141 53.380 54.496 -1.116 1
1 639 . 5 1 1 A 52 52 CYS CB C 141 46.110 45.772 0.338 1
1 640 . 5 1 1 A 52 52 CYS N N 141 121.305 129.138 -7.833 1
1 641 . 5 1 1 A 53 53 THR H H 142 8.929 8.894 0.035 1
1 642 . 5 1 1 A 53 53 THR HA H 142 4.498 5.040 -0.542 1
1 648 . 5 1 1 A 53 53 THR C C 142 172.151 172.497 -0.346 1
1 649 . 5 1 1 A 53 53 THR CA C 142 62.960 61.495 1.465 1
1 650 . 5 1 1 A 53 53 THR CB C 142 70.540 72.255 -1.715 1
1 652 . 5 1 1 A 53 53 THR N N 142 120.105 120.014 0.091 1
1 653 . 5 1 1 A 54 54 LEU H H 143 8.448 8.713 -0.265 1
1 654 . 5 1 1 A 54 54 LEU HA H 143 4.322 4.545 -0.223 1
1 664 . 5 1 1 A 54 54 LEU C C 143 174.484 174.349 0.135 1
1 665 . 5 1 1 A 54 54 LEU CA C 143 54.596 53.288 1.308 1
1 666 . 5 1 1 A 54 54 LEU CB C 143 42.396 43.247 -0.851 1
1 670 . 5 1 1 A 54 54 LEU N N 143 128.819 129.026 -0.207 1
1 671 . 5 1 1 A 55 55 PHE H H 144 8.661 8.694 -0.033 1
1 672 . 5 1 1 A 55 55 PHE HA H 144 5.459 4.971 0.488 1
1 680 . 5 1 1 A 55 55 PHE C C 144 176.035 174.794 1.241 1
1 681 . 5 1 1 A 55 55 PHE CA C 144 55.020 56.574 -1.554 1
1 682 . 5 1 1 A 55 55 PHE CB C 144 44.100 42.485 1.615 1
1 686 . 5 1 1 A 55 55 PHE N N 144 121.897 126.235 -4.338 1
1 687 . 5 1 1 A 56 56 ASP H H 145 11.616 8.481 3.135 1
1 688 . 5 1 1 A 56 56 ASP HA H 145 4.417 4.545 -0.128 1
1 691 . 5 1 1 A 56 56 ASP C C 145 176.748 177.542 -0.794 1
1 692 . 5 1 1 A 56 56 ASP CA C 145 55.844 54.525 1.319 1
1 693 . 5 1 1 A 56 56 ASP CB C 145 44.390 42.496 1.894 1
1 694 . 5 1 1 A 56 56 ASP N N 145 122.131 122.251 -0.120 1
1 695 . 5 1 1 A 57 57 ALA H H 146 8.508 8.969 -0.461 1
1 696 . 5 1 1 A 57 57 ALA HA H 146 3.797 4.032 -0.235 1
1 700 . 5 1 1 A 57 57 ALA C C 146 178.696 180.118 -1.422 1
1 701 . 5 1 1 A 57 57 ALA CA C 146 55.990 55.411 0.579 1
1 702 . 5 1 1 A 57 57 ALA CB C 146 18.840 18.120 0.720 1
1 703 . 5 1 1 A 57 57 ALA N N 146 130.243 128.967 1.276 1
1 704 . 5 1 1 A 58 58 ALA H H 147 8.378 7.550 0.828 1
1 705 . 5 1 1 A 58 58 ALA HA H 147 4.078 4.156 -0.078 1
1 709 . 5 1 1 A 58 58 ALA C C 147 181.091 179.526 1.565 1
1 710 . 5 1 1 A 58 58 ALA CA C 147 54.770 54.991 -0.221 1
1 711 . 5 1 1 A 58 58 ALA CB C 147 17.700 18.544 -0.844 1
1 712 . 5 1 1 A 58 58 ALA N N 147 121.997 119.551 2.446 1
1 713 . 5 1 1 A 59 59 ALA H H 148 9.138 8.074 1.064 1
1 714 . 5 1 1 A 59 59 ALA HA H 148 3.975 4.070 -0.095 1
1 718 . 5 1 1 A 59 59 ALA C C 148 180.508 180.003 0.505 1
1 719 . 5 1 1 A 59 59 ALA CA C 148 54.840 55.060 -0.220 1
1 720 . 5 1 1 A 59 59 ALA CB C 148 18.600 18.401 0.199 1
1 721 . 5 1 1 A 59 59 ALA N N 148 123.595 120.818 2.777 1
1 722 . 5 1 1 A 60 60 PHE H H 149 8.814 8.085 0.729 1
1 723 . 5 1 1 A 60 60 PHE HA H 149 3.722 3.979 -0.257 1
1 731 . 5 1 1 A 60 60 PHE C C 149 176.773 177.403 -0.630 1
1 732 . 5 1 1 A 60 60 PHE CA C 149 62.030 61.404 0.626 1
1 733 . 5 1 1 A 60 60 PHE CB C 149 39.960 38.946 1.014 1
1 737 . 5 1 1 A 60 60 PHE N N 149 120.354 120.044 0.310 1
1 738 . 5 1 1 A 61 61 SER H H 150 8.276 8.152 0.124 1
1 739 . 5 1 1 A 61 61 SER HA H 150 3.880 4.003 -0.123 1
1 742 . 5 1 1 A 61 61 SER C C 150 177.691 176.445 1.246 1
1 743 . 5 1 1 A 61 61 SER CA C 150 62.190 61.539 0.651 1
1 744 . 5 1 1 A 61 61 SER CB C 150 63.016 62.884 0.132 1
1 745 . 5 1 1 A 61 61 SER N N 150 112.086 114.201 -2.115 1
1 746 . 5 1 1 A 62 62 ARG H H 151 7.829 7.865 -0.036 1
1 747 . 5 1 1 A 62 62 ARG HA H 151 3.971 4.027 -0.056 1
1 754 . 5 1 1 A 62 62 ARG C C 151 178.287 178.348 -0.061 1
1 755 . 5 1 1 A 62 62 ARG CA C 151 59.340 58.900 0.440 1
1 756 . 5 1 1 A 62 62 ARG CB C 151 29.760 29.842 -0.082 1
1 759 . 5 1 1 A 62 62 ARG N N 151 121.090 119.196 1.894 1
1 760 . 5 1 1 A 63 63 LEU H H 152 7.390 7.478 -0.088 1
1 761 . 5 1 1 A 63 63 LEU HA H 152 3.791 3.921 -0.130 1
1 771 . 5 1 1 A 63 63 LEU C C 152 179.106 178.227 0.879 1
1 772 . 5 1 1 A 63 63 LEU CA C 152 58.900 58.171 0.729 1
1 773 . 5 1 1 A 63 63 LEU CB C 152 41.140 41.249 -0.109 1
1 777 . 5 1 1 A 63 63 LEU N N 152 121.129 122.149 -1.020 1
1 778 . 5 1 1 A 64 64 VAL H H 153 7.552 7.998 -0.446 1
1 779 . 5 1 1 A 64 64 VAL HA H 153 3.411 3.496 -0.085 1
1 787 . 5 1 1 A 64 64 VAL C C 153 180.595 178.586 2.009 1
1 788 . 5 1 1 A 64 64 VAL CA C 153 65.644 66.036 -0.392 1
1 789 . 5 1 1 A 64 64 VAL CB C 153 31.410 31.329 0.081 1
1 792 . 5 1 1 A 64 64 VAL N N 153 118.280 118.909 -0.629 1
1 793 . 5 1 1 A 65 65 GLY H H 154 8.061 8.263 -0.202 1
1 794 . 5 1 1 A 65 65 GLY HA2 H 154 3.846 3.766 0.080 1
1 795 . 5 1 1 A 65 65 GLY HA3 H 154 3.809 3.769 0.040 1
1 796 . 5 1 1 A 65 65 GLY C C 154 175.235 175.387 -0.152 1
1 797 . 5 1 1 A 65 65 GLY CA C 154 46.630 46.812 -0.182 1
1 798 . 5 1 1 A 65 65 GLY N N 154 108.622 108.051 0.571 1
1 799 . 5 1 1 A 66 66 GLU H H 155 7.528 7.581 -0.053 1
1 800 . 5 1 1 A 66 66 GLU HA H 155 4.228 4.344 -0.116 1
1 805 . 5 1 1 A 66 66 GLU C C 155 176.761 176.879 -0.118 1
1 806 . 5 1 1 A 66 66 GLU CA C 155 56.590 56.235 0.355 1
1 807 . 5 1 1 A 66 66 GLU CB C 155 30.490 30.153 0.337 1
1 809 . 5 1 1 A 66 66 GLU N N 155 118.361 118.892 -0.531 1
1 810 . 5 1 1 A 67 67 GLY H H 156 7.884 7.892 -0.008 1
1 811 . 5 1 1 A 67 67 GLY HA2 H 156 3.918 3.864 0.054 1
1 812 . 5 1 1 A 67 67 GLY HA3 H 156 3.747 3.877 -0.130 1
1 813 . 5 1 1 A 67 67 GLY C C 156 174.788 174.472 0.316 1
1 814 . 5 1 1 A 67 67 GLY CA C 156 45.890 45.790 0.100 1
1 815 . 5 1 1 A 67 67 GLY N N 156 108.465 109.665 -1.200 1
1 816 . 5 1 1 A 68 68 LEU H H 157 7.332 7.621 -0.289 1
1 817 . 5 1 1 A 68 68 LEU HA H 157 4.361 4.507 -0.146 1
1 827 . 5 1 1 A 68 68 LEU CA C 157 53.060 52.431 0.629 1
1 828 . 5 1 1 A 68 68 LEU CB C 157 41.100 41.494 -0.394 1
1 832 . 5 1 1 A 68 68 LEU N N 157 121.920 121.773 0.147 1
1 833 . 5 1 1 A 69 69 PRO HA H 158 4.485 4.608 -0.123 1
1 840 . 5 1 1 A 69 69 PRO C C 158 174.602 176.187 -1.585 1
1 841 . 5 1 1 A 69 69 PRO CA C 158 61.556 62.215 -0.659 1
1 842 . 5 1 1 A 69 69 PRO CB C 158 32.370 32.861 -0.491 1
1 845 . 5 1 1 A 70 70 HIS H H 159 8.734 8.626 0.108 1
1 846 . 5 1 1 A 70 70 HIS HA H 159 3.947 4.578 -0.631 1
1 852 . 5 1 1 A 70 70 HIS CA C 159 56.250 55.243 1.007 1
1 853 . 5 1 1 A 70 70 HIS CB C 159 32.280 31.116 1.164 1
1 856 . 5 1 1 A 70 70 HIS N N 159 119.423 121.655 -2.232 1
1 857 . 5 1 1 A 71 71 PRO HA H 160 4.424 4.192 0.232 1
1 864 . 5 1 1 A 71 71 PRO C C 160 177.567 178.640 -1.073 1
1 865 . 5 1 1 A 71 71 PRO CA C 160 64.574 65.496 -0.922 1
1 866 . 5 1 1 A 71 71 PRO CB C 160 32.340 31.784 0.556 1
1 869 . 5 1 1 A 72 72 LEU H H 161 10.123 7.386 2.737 1
1 870 . 5 1 1 A 72 72 LEU HA H 161 4.778 4.259 0.519 1
1 880 . 5 1 1 A 72 72 LEU C C 161 178.721 177.657 1.064 1
1 881 . 5 1 1 A 72 72 LEU CA C 161 55.800 57.577 -1.777 1
1 882 . 5 1 1 A 72 72 LEU CB C 161 42.440 43.205 -0.765 1
1 886 . 5 1 1 A 72 72 LEU N N 161 117.374 117.187 0.187 1
1 887 . 5 1 1 A 73 73 THR H H 162 7.523 8.209 -0.686 1
1 888 . 5 1 1 A 73 73 THR HA H 162 4.291 4.622 -0.331 1
1 893 . 5 1 1 A 73 73 THR C C 162 175.557 174.505 1.052 1
1 894 . 5 1 1 A 73 73 THR CA C 162 61.440 61.636 -0.196 1
1 895 . 5 1 1 A 73 73 THR CB C 162 70.500 69.866 0.634 1
1 897 . 5 1 1 A 73 73 THR N N 162 107.787 110.934 -3.147 1
1 898 . 5 1 1 A 74 74 ARG H H 163 8.361 8.083 0.278 1
1 899 . 5 1 1 A 74 74 ARG HA H 163 3.836 4.191 -0.355 1
1 906 . 5 1 1 A 74 74 ARG C C 163 174.701 175.136 -0.435 1
1 907 . 5 1 1 A 74 74 ARG CA C 163 57.980 57.536 0.444 1
1 908 . 5 1 1 A 74 74 ARG CB C 163 26.770 26.948 -0.178 1
1 911 . 5 1 1 A 74 74 ARG N N 163 115.130 118.599 -3.469 1
1 912 . 5 1 1 A 75 75 GLU H H 164 7.430 8.123 -0.693 1
1 913 . 5 1 1 A 75 75 GLU HA H 164 4.636 4.489 0.147 1
1 918 . 5 1 1 A 75 75 GLU CA C 164 53.699 54.660 -0.961 1
1 919 . 5 1 1 A 75 75 GLU CB C 164 29.550 29.054 0.496 1
1 921 . 5 1 1 A 75 75 GLU N N 164 120.076 119.050 1.026 1
1 922 . 5 1 1 A 76 76 PRO HA H 165 4.272 4.527 -0.255 1
1 929 . 5 1 1 A 76 76 PRO C C 165 176.649 177.056 -0.407 1
1 930 . 5 1 1 A 76 76 PRO CA C 165 63.204 63.133 0.071 1
1 931 . 5 1 1 A 76 76 PRO CB C 165 31.680 31.581 0.099 1
1 934 . 5 1 1 A 77 77 ILE H H 166 8.812 8.238 0.574 1
1 935 . 5 1 1 A 77 77 ILE HA H 166 3.838 4.278 -0.440 1
1 945 . 5 1 1 A 77 77 ILE C C 166 175.235 175.942 -0.707 1
1 946 . 5 1 1 A 77 77 ILE CA C 166 62.816 61.302 1.514 1
1 947 . 5 1 1 A 77 77 ILE CB C 166 37.750 37.759 -0.009 1
1 951 . 5 1 1 A 77 77 ILE N N 166 123.831 124.115 -0.284 1
1 952 . 5 1 1 A 78 78 THR H H 167 6.625 8.572 -1.947 1
1 953 . 5 1 1 A 78 78 THR HA H 167 4.632 5.051 -0.419 1
1 958 . 5 1 1 A 78 78 THR C C 167 174.143 174.616 -0.473 1
1 959 . 5 1 1 A 78 78 THR CA C 167 58.750 59.867 -1.117 1
1 960 . 5 1 1 A 78 78 THR CB C 167 71.320 71.357 -0.037 1
1 962 . 5 1 1 A 78 78 THR N N 167 115.293 118.091 -2.798 1
1 963 . 5 1 1 A 79 79 ALA H H 168 9.088 8.985 0.103 1
1 964 . 5 1 1 A 79 79 ALA HA H 168 3.916 4.123 -0.207 1
1 968 . 5 1 1 A 79 79 ALA C C 168 179.770 179.463 0.307 1
1 969 . 5 1 1 A 79 79 ALA CA C 168 55.480 54.977 0.503 1
1 970 . 5 1 1 A 79 79 ALA CB C 168 17.630 18.353 -0.723 1
1 971 . 5 1 1 A 79 79 ALA N N 168 122.102 127.392 -5.290 1
1 972 . 5 1 1 A 80 80 SER H H 169 7.988 7.673 0.315 1
1 973 . 5 1 1 A 80 80 SER HA H 169 4.091 4.215 -0.124 1
1 976 . 5 1 1 A 80 80 SER C C 169 175.836 176.409 -0.573 1
1 977 . 5 1 1 A 80 80 SER CA C 169 60.750 61.326 -0.576 1
1 978 . 5 1 1 A 80 80 SER CB C 169 62.510 63.259 -0.749 1
1 979 . 5 1 1 A 80 80 SER N N 169 109.660 113.386 -3.726 1
1 980 . 5 1 1 A 81 81 ILE H H 170 7.052 7.613 -0.561 1
1 981 . 5 1 1 A 81 81 ILE HA H 170 4.344 4.178 0.166 1
1 991 . 5 1 1 A 81 81 ILE C C 170 174.236 176.482 -2.246 1
1 992 . 5 1 1 A 81 81 ILE CA C 170 61.760 63.789 -2.029 1
1 993 . 5 1 1 A 81 81 ILE CB C 170 37.950 37.971 -0.021 1
1 997 . 5 1 1 A 81 81 ILE N N 170 112.623 113.403 -0.780 1
1 998 . 5 1 1 A 82 82 ILE H H 171 7.345 7.612 -0.267 1
1 999 . 5 1 1 A 82 82 ILE HA H 171 4.288 4.013 0.275 1
1 1009 . 5 1 1 A 82 82 ILE C C 171 174.931 175.219 -0.288 1
1 1010 . 5 1 1 A 82 82 ILE CA C 171 61.420 61.840 -0.420 1
1 1011 . 5 1 1 A 82 82 ILE CB C 171 37.230 37.893 -0.663 1
1 1015 . 5 1 1 A 82 82 ILE N N 171 124.260 124.743 -0.483 1
1 1016 . 5 1 1 A 83 83 VAL H H 172 7.843 8.798 -0.955 1
1 1017 . 5 1 1 A 83 83 VAL HA H 172 4.818 5.030 -0.212 1
1 1025 . 5 1 1 A 83 83 VAL C C 172 174.918 175.642 -0.724 1
1 1026 . 5 1 1 A 83 83 VAL CA C 172 58.910 59.365 -0.455 1
1 1027 . 5 1 1 A 83 83 VAL CB C 172 34.570 34.981 -0.411 1
1 1030 . 5 1 1 A 83 83 VAL N N 172 118.856 122.351 -3.495 1
1 1031 . 5 1 1 A 84 84 LYS H H 173 8.347 8.750 -0.403 1
1 1032 . 5 1 1 A 84 84 LYS HA H 173 4.356 4.425 -0.069 1
1 1041 . 5 1 1 A 84 84 LYS C C 173 178.653 178.171 0.482 1
1 1042 . 5 1 1 A 84 84 LYS CA C 173 56.360 55.772 0.588 1
1 1043 . 5 1 1 A 84 84 LYS CB C 173 33.366 32.579 0.787 1
1 1047 . 5 1 1 A 84 84 LYS N N 173 119.602 121.884 -2.282 1
1 1048 . 5 1 1 A 85 85 HIS H H 174 9.143 9.200 -0.057 1
1 1049 . 5 1 1 A 85 85 HIS HA H 174 4.013 4.221 -0.208 1
1 1053 . 5 1 1 A 85 85 HIS C C 174 176.606 176.591 0.015 1
1 1054 . 5 1 1 A 85 85 HIS CA C 174 58.820 60.343 -1.523 1
1 1055 . 5 1 1 A 85 85 HIS CB C 174 28.186 29.896 -1.710 1
1 1057 . 5 1 1 A 85 85 HIS N N 174 120.022 122.421 -2.399 1
1 1058 . 5 1 1 A 86 86 GLU H H 175 8.403 8.368 0.035 1
1 1059 . 5 1 1 A 86 86 GLU HA H 175 3.863 3.634 0.229 1
1 1064 . 5 1 1 A 86 86 GLU C C 175 177.040 178.886 -1.846 1
1 1065 . 5 1 1 A 86 86 GLU CA C 175 57.830 60.070 -2.240 1
1 1066 . 5 1 1 A 86 86 GLU CB C 175 28.690 29.012 -0.322 1
1 1068 . 5 1 1 A 86 86 GLU N N 175 116.124 117.750 -1.626 1
1 1069 . 5 1 1 A 87 87 GLU H H 176 7.669 7.747 -0.078 1
1 1070 . 5 1 1 A 87 87 GLU HA H 176 4.039 4.569 -0.530 1
1 1075 . 5 1 1 A 87 87 GLU C C 176 175.688 177.326 -1.638 1
1 1076 . 5 1 1 A 87 87 GLU CA C 176 57.906 58.798 -0.892 1
1 1077 . 5 1 1 A 87 87 GLU CB C 176 30.430 28.961 1.469 1
1 1079 . 5 1 1 A 87 87 GLU N N 176 116.183 119.155 -2.972 1
1 1080 . 5 1 1 A 88 88 CYS H H 177 6.750 7.023 -0.273 1
1 1081 . 5 1 1 A 88 88 CYS HA H 177 4.991 4.497 0.494 1
1 1084 . 5 1 1 A 88 88 CYS C C 177 172.325 173.396 -1.071 1
1 1085 . 5 1 1 A 88 88 CYS CA C 177 55.030 54.068 0.962 1
1 1086 . 5 1 1 A 88 88 CYS CB C 177 45.610 41.990 3.620 1
1 1087 . 5 1 1 A 88 88 CYS N N 177 114.838 117.088 -2.250 1
1 1088 . 5 1 1 A 89 89 ILE H H 178 9.128 8.692 0.436 1
1 1089 . 5 1 1 A 89 89 ILE HA H 178 4.536 4.960 -0.424 1
1 1099 . 5 1 1 A 89 89 ILE C C 178 174.893 174.455 0.438 1
1 1100 . 5 1 1 A 89 89 ILE CA C 178 59.160 59.057 0.103 1
1 1101 . 5 1 1 A 89 89 ILE CB C 178 41.840 41.007 0.833 1
1 1105 . 5 1 1 A 89 89 ILE N N 178 120.564 120.969 -0.405 1
1 1106 . 5 1 1 A 90 90 TYR H H 179 9.349 9.100 0.249 1
1 1107 . 5 1 1 A 90 90 TYR HA H 179 3.568 4.233 -0.665 1
1 1112 . 5 1 1 A 90 90 TYR C C 179 173.950 173.842 0.108 1
1 1113 . 5 1 1 A 90 90 TYR CA C 179 61.180 57.730 3.450 1
1 1114 . 5 1 1 A 90 90 TYR CB C 179 37.530 38.477 -0.947 1
1 1116 . 5 1 1 A 90 90 TYR N N 179 129.033 126.168 2.865 1
1 1117 . 5 1 1 A 91 91 ASP H H 180 7.367 8.310 -0.943 1
1 1118 . 5 1 1 A 91 91 ASP HA H 180 4.662 4.549 0.113 1
1 1121 . 5 1 1 A 91 91 ASP C C 180 175.291 175.344 -0.053 1
1 1122 . 5 1 1 A 91 91 ASP CA C 180 52.230 52.120 0.110 1
1 1123 . 5 1 1 A 91 91 ASP CB C 180 43.650 40.889 2.761 1
1 1124 . 5 1 1 A 91 91 ASP N N 180 129.305 128.792 0.513 1
1 1125 . 5 1 1 A 92 92 ASP H H 181 8.783 8.417 0.366 1
1 1126 . 5 1 1 A 92 92 ASP HA H 181 4.114 3.647 0.467 1
1 1129 . 5 1 1 A 92 92 ASP C C 181 177.573 177.585 -0.012 1
1 1130 . 5 1 1 A 92 92 ASP CA C 181 56.390 56.453 -0.063 1
1 1131 . 5 1 1 A 92 92 ASP CB C 181 41.330 40.296 1.034 1
1 1132 . 5 1 1 A 92 92 ASP N N 181 125.665 126.158 -0.493 1
1 1133 . 5 1 1 A 93 93 THR H H 182 8.284 7.785 0.499 1
1 1134 . 5 1 1 A 93 93 THR HA H 182 4.037 3.843 0.194 1
1 1139 . 5 1 1 A 93 93 THR C C 182 176.333 176.574 -0.241 1
1 1140 . 5 1 1 A 93 93 THR CA C 182 65.320 66.603 -1.283 1
1 1141 . 5 1 1 A 93 93 THR CB C 182 68.560 68.119 0.441 1
1 1143 . 5 1 1 A 93 93 THR N N 182 114.688 116.201 -1.513 1
1 1144 . 5 1 1 A 94 94 ARG H H 183 7.784 7.443 0.341 1
1 1145 . 5 1 1 A 94 94 ARG HA H 183 4.142 4.161 -0.019 1
1 1152 . 5 1 1 A 94 94 ARG C C 183 177.015 176.842 0.173 1
1 1153 . 5 1 1 A 94 94 ARG CA C 183 55.350 56.230 -0.880 1
1 1154 . 5 1 1 A 94 94 ARG CB C 183 30.930 30.609 0.321 1
1 1157 . 5 1 1 A 94 94 ARG N N 183 120.156 118.396 1.760 1
1 1158 . 5 1 1 A 95 95 GLY H H 184 8.144 8.853 -0.709 1
1 1159 . 5 1 1 A 95 95 GLY HA2 H 184 3.839 3.811 0.028 1
1 1160 . 5 1 1 A 95 95 GLY HA3 H 184 3.681 3.840 -0.159 1
1 1161 . 5 1 1 A 95 95 GLY C C 184 173.653 173.329 0.324 1
1 1162 . 5 1 1 A 95 95 GLY CA C 184 46.160 45.569 0.591 1
1 1163 . 5 1 1 A 95 95 GLY N N 184 107.879 108.844 -0.965 1
1 1164 . 5 1 1 A 96 96 ASN H H 185 6.855 7.322 -0.467 1
1 1165 . 5 1 1 A 96 96 ASN HA H 185 4.909 5.058 -0.149 1
1 1170 . 5 1 1 A 96 96 ASN C C 185 174.223 173.356 0.867 1
1 1171 . 5 1 1 A 96 96 ASN CA C 185 52.720 52.157 0.563 1
1 1172 . 5 1 1 A 96 96 ASN CB C 185 45.620 41.921 3.699 1
1 1173 . 5 1 1 A 96 96 ASN N N 185 113.382 117.035 -3.653 1
1 1175 . 5 1 1 A 97 97 PHE H H 186 9.228 8.653 0.575 1
1 1176 . 5 1 1 A 97 97 PHE HA H 186 4.579 5.065 -0.486 1
1 1183 . 5 1 1 A 97 97 PHE C C 186 174.794 175.763 -0.969 1
1 1184 . 5 1 1 A 97 97 PHE CA C 186 59.384 58.573 0.811 1
1 1185 . 5 1 1 A 97 97 PHE CB C 186 40.450 40.012 0.438 1
1 1188 . 5 1 1 A 97 97 PHE N N 186 118.661 119.413 -0.752 1
1 1189 . 5 1 1 A 98 98 ILE H H 187 8.908 8.937 -0.029 1
1 1190 . 5 1 1 A 98 98 ILE HA H 187 5.440 4.748 0.692 1
1 1200 . 5 1 1 A 98 98 ILE C C 187 176.171 175.178 0.993 1
1 1201 . 5 1 1 A 98 98 ILE CA C 187 57.610 59.637 -2.027 1
1 1202 . 5 1 1 A 98 98 ILE CB C 187 41.280 41.344 -0.064 1
1 1206 . 5 1 1 A 98 98 ILE N N 187 120.585 123.350 -2.765 1
1 1207 . 5 1 1 A 99 99 ILE H H 188 8.602 8.608 -0.006 1
1 1208 . 5 1 1 A 99 99 ILE HA H 188 4.546 4.221 0.325 1
1 1218 . 5 1 1 A 99 99 ILE C C 188 176.668 175.564 1.104 1
1 1219 . 5 1 1 A 99 99 ILE CA C 188 58.920 61.504 -2.584 1
1 1220 . 5 1 1 A 99 99 ILE CB C 188 37.960 38.012 -0.052 1
1 1224 . 5 1 1 A 99 99 ILE N N 188 124.500 126.891 -2.391 1
1 1225 . 5 1 1 A 100 100 LYS H H 189 8.449 8.603 -0.154 1
1 1226 . 5 1 1 A 100 100 LYS HA H 189 4.108 4.668 -0.560 1
1 1235 . 5 1 1 A 100 100 LYS C C 189 176.866 175.149 1.717 1
1 1236 . 5 1 1 A 100 100 LYS CA C 189 56.800 55.296 1.504 1
1 1237 . 5 1 1 A 100 100 LYS CB C 189 33.400 33.911 -0.511 1
1 1241 . 5 1 1 A 100 100 LYS N N 189 128.581 126.602 1.979 1
1 1242 . 5 1 1 A 101 101 GLY H H 190 8.381 8.352 0.029 1
1 1243 . 5 1 1 A 101 101 GLY HA2 H 190 3.946 4.165 -0.219 1
1 1244 . 5 1 1 A 101 101 GLY HA3 H 190 3.828 4.174 -0.346 1
1 1245 . 5 1 1 A 101 101 GLY C C 190 172.902 173.502 -0.600 1
1 1246 . 5 1 1 A 101 101 GLY CA C 190 44.920 44.949 -0.029 1
1 1247 . 5 1 1 A 101 101 GLY N N 190 111.183 112.875 -1.692 1
1 7 . 6 1 1 A 2 2 GLN H H 91 8.786 8.720 0.066 1
1 8 . 6 1 1 A 2 2 GLN HA H 91 4.005 3.927 0.078 1
1 15 . 6 1 1 A 2 2 GLN C C 91 177.270 178.279 -1.009 1
1 16 . 6 1 1 A 2 2 GLN CA C 91 58.220 58.947 -0.727 1
1 17 . 6 1 1 A 2 2 GLN CB C 91 28.650 28.531 0.119 1
1 19 . 6 1 1 A 2 2 GLN N N 91 121.993 120.439 1.554 1
1 21 . 6 1 1 A 3 3 GLU H H 92 8.430 8.354 0.076 1
1 22 . 6 1 1 A 3 3 GLU HA H 92 4.007 4.089 -0.082 1
1 27 . 6 1 1 A 3 3 GLU C C 92 178.287 179.115 -0.828 1
1 28 . 6 1 1 A 3 3 GLU CA C 92 59.490 59.475 0.015 1
1 29 . 6 1 1 A 3 3 GLU CB C 92 29.506 29.346 0.160 1
1 31 . 6 1 1 A 3 3 GLU N N 92 120.195 120.567 -0.372 1
1 32 . 6 1 1 A 4 4 SER H H 93 8.209 8.047 0.162 1
1 33 . 6 1 1 A 4 4 SER HA H 93 4.272 4.222 0.050 1
1 36 . 6 1 1 A 4 4 SER C C 93 177.369 176.794 0.575 1
1 37 . 6 1 1 A 4 4 SER CA C 93 61.044 62.232 -1.188 1
1 38 . 6 1 1 A 4 4 SER CB C 93 62.950 62.849 0.101 1
1 39 . 6 1 1 A 4 4 SER N N 93 115.524 117.035 -1.511 1
1 40 . 6 1 1 A 5 5 ILE H H 94 8.080 7.633 0.447 1
1 41 . 6 1 1 A 5 5 ILE HA H 94 3.530 3.691 -0.161 1
1 51 . 6 1 1 A 5 5 ILE C C 94 177.778 177.555 0.223 1
1 52 . 6 1 1 A 5 5 ILE CA C 94 65.710 65.152 0.558 1
1 53 . 6 1 1 A 5 5 ILE CB C 94 37.800 37.409 0.391 1
1 57 . 6 1 1 A 5 5 ILE N N 94 124.148 121.901 2.247 1
1 58 . 6 1 1 A 6 6 GLN H H 95 8.374 8.433 -0.059 1
1 59 . 6 1 1 A 6 6 GLN HA H 95 4.125 3.925 0.200 1
1 66 . 6 1 1 A 6 6 GLN C C 95 179.726 179.318 0.408 1
1 67 . 6 1 1 A 6 6 GLN CA C 95 59.190 58.955 0.235 1
1 68 . 6 1 1 A 6 6 GLN CB C 95 27.060 28.450 -1.390 1
1 70 . 6 1 1 A 6 6 GLN N N 95 118.257 118.769 -0.512 1
1 72 . 6 1 1 A 7 7 ASN H H 96 8.456 8.076 0.380 1
1 73 . 6 1 1 A 7 7 ASN HA H 96 4.446 4.569 -0.123 1
1 78 . 6 1 1 A 7 7 ASN C C 96 177.257 177.552 -0.295 1
1 79 . 6 1 1 A 7 7 ASN CA C 96 56.020 56.092 -0.072 1
1 80 . 6 1 1 A 7 7 ASN CB C 96 38.126 37.787 0.339 1
1 81 . 6 1 1 A 7 7 ASN N N 96 118.597 118.434 0.163 1
1 83 . 6 1 1 A 8 8 LYS H H 97 7.732 7.758 -0.026 1
1 84 . 6 1 1 A 8 8 LYS HA H 97 4.129 4.046 0.083 1
1 93 . 6 1 1 A 8 8 LYS C C 97 179.143 179.263 -0.120 1
1 94 . 6 1 1 A 8 8 LYS CA C 97 59.126 59.760 -0.634 1
1 95 . 6 1 1 A 8 8 LYS CB C 97 32.070 32.328 -0.258 1
1 99 . 6 1 1 A 8 8 LYS N N 97 122.381 121.005 1.376 1
1 100 . 6 1 1 A 9 9 ILE H H 98 8.452 8.089 0.363 1
1 101 . 6 1 1 A 9 9 ILE HA H 98 3.480 3.948 -0.468 1
1 111 . 6 1 1 A 9 9 ILE C C 98 177.406 178.897 -1.491 1
1 112 . 6 1 1 A 9 9 ILE CA C 98 66.430 64.084 2.346 1
1 113 . 6 1 1 A 9 9 ILE CB C 98 37.980 37.255 0.725 1
1 117 . 6 1 1 A 9 9 ILE N N 98 119.950 120.457 -0.507 1
1 118 . 6 1 1 A 10 10 SER H H 99 7.924 7.935 -0.011 1
1 119 . 6 1 1 A 10 10 SER HA H 99 3.983 4.345 -0.362 1
1 122 . 6 1 1 A 10 10 SER C C 99 176.327 176.207 0.120 1
1 123 . 6 1 1 A 10 10 SER CA C 99 61.990 61.296 0.694 1
1 124 . 6 1 1 A 10 10 SER CB C 99 62.790 63.554 -0.764 1
1 125 . 6 1 1 A 10 10 SER N N 99 113.568 118.793 -5.225 1
1 126 . 6 1 1 A 11 11 GLN H H 100 7.832 7.775 0.057 1
1 127 . 6 1 1 A 11 11 GLN HA H 100 4.238 4.376 -0.138 1
1 134 . 6 1 1 A 11 11 GLN C C 100 178.088 177.810 0.278 1
1 135 . 6 1 1 A 11 11 GLN CA C 100 57.900 56.969 0.931 1
1 136 . 6 1 1 A 11 11 GLN CB C 100 29.790 29.433 0.357 1
1 138 . 6 1 1 A 11 11 GLN N N 100 117.487 117.464 0.023 1
1 140 . 6 1 1 A 12 12 CYS H H 101 7.920 7.981 -0.061 1
1 141 . 6 1 1 A 12 12 CYS HA H 101 4.657 4.560 0.097 1
1 144 . 6 1 1 A 12 12 CYS C C 101 175.439 174.522 0.917 1
1 145 . 6 1 1 A 12 12 CYS CA C 101 60.654 58.963 1.691 1
1 146 . 6 1 1 A 12 12 CYS CB C 101 29.310 28.487 0.823 1
1 147 . 6 1 1 A 12 12 CYS N N 101 114.221 118.608 -4.387 1
1 148 . 6 1 1 A 13 13 LYS H H 102 7.993 7.485 0.508 1
1 149 . 6 1 1 A 13 13 LYS HA H 102 5.038 4.590 0.448 1
1 158 . 6 1 1 A 13 13 LYS C C 102 174.757 176.316 -1.559 1
1 159 . 6 1 1 A 13 13 LYS CA C 102 56.660 56.114 0.546 1
1 160 . 6 1 1 A 13 13 LYS CB C 102 32.970 33.386 -0.416 1
1 164 . 6 1 1 A 13 13 LYS N N 102 123.841 118.763 5.078 1
1 165 . 6 1 1 A 14 14 PHE H H 103 8.822 8.697 0.125 1
1 166 . 6 1 1 A 14 14 PHE HA H 103 5.058 5.103 -0.045 1
1 174 . 6 1 1 A 14 14 PHE C C 103 173.560 172.818 0.742 1
1 175 . 6 1 1 A 14 14 PHE CA C 103 55.470 55.944 -0.474 1
1 176 . 6 1 1 A 14 14 PHE CB C 103 41.760 40.837 0.923 1
1 180 . 6 1 1 A 14 14 PHE N N 103 118.421 116.390 2.031 1
1 181 . 6 1 1 A 15 15 SER H H 104 8.826 8.824 0.002 1
1 182 . 6 1 1 A 15 15 SER HA H 104 4.602 4.747 -0.145 1
1 185 . 6 1 1 A 15 15 SER C C 104 173.851 173.579 0.272 1
1 186 . 6 1 1 A 15 15 SER CA C 104 58.610 58.592 0.018 1
1 187 . 6 1 1 A 15 15 SER CB C 104 62.690 62.361 0.329 1
1 188 . 6 1 1 A 15 15 SER N N 104 117.781 116.686 1.095 1
1 189 . 6 1 1 A 16 16 VAL H H 105 7.839 7.893 -0.054 1
1 190 . 6 1 1 A 16 16 VAL HA H 105 3.390 4.266 -0.876 1
1 198 . 6 1 1 A 16 16 VAL C C 105 174.987 175.440 -0.453 1
1 199 . 6 1 1 A 16 16 VAL CA C 105 63.650 62.646 1.004 1
1 200 . 6 1 1 A 16 16 VAL CB C 105 31.410 30.491 0.919 1
1 203 . 6 1 1 A 16 16 VAL N N 105 129.036 126.481 2.555 1
1 204 . 6 1 1 A 17 17 CYS H H 106 8.536 8.545 -0.009 1
1 205 . 6 1 1 A 17 17 CYS HA H 106 5.011 4.936 0.075 1
1 208 . 6 1 1 A 17 17 CYS CA C 106 55.260 56.504 -1.244 1
1 209 . 6 1 1 A 17 17 CYS CB C 106 28.210 30.753 -2.543 1
1 210 . 6 1 1 A 17 17 CYS N N 106 130.045 127.347 2.698 1
1 211 . 6 1 1 A 18 18 PRO HA H 107 3.991 4.411 -0.420 1
1 218 . 6 1 1 A 18 18 PRO C C 107 178.188 178.599 -0.411 1
1 219 . 6 1 1 A 18 18 PRO CA C 107 65.940 65.129 0.811 1
1 220 . 6 1 1 A 18 18 PRO CB C 107 32.000 31.966 0.034 1
1 223 . 6 1 1 A 19 19 GLU H H 108 9.260 9.075 0.185 1
1 224 . 6 1 1 A 19 19 GLU HA H 108 4.119 4.119 0.000 1
1 229 . 6 1 1 A 19 19 GLU C C 108 178.721 179.059 -0.338 1
1 230 . 6 1 1 A 19 19 GLU CA C 108 59.300 58.974 0.326 1
1 231 . 6 1 1 A 19 19 GLU CB C 108 28.920 28.603 0.317 1
1 233 . 6 1 1 A 19 19 GLU N N 108 118.270 116.597 1.673 1
1 234 . 6 1 1 A 20 20 ARG H H 109 7.672 8.070 -0.398 1
1 235 . 6 1 1 A 20 20 ARG HA H 109 4.331 4.129 0.202 1
1 242 . 6 1 1 A 20 20 ARG C C 109 177.977 178.034 -0.057 1
1 243 . 6 1 1 A 20 20 ARG CA C 109 57.350 59.038 -1.688 1
1 244 . 6 1 1 A 20 20 ARG CB C 109 30.820 30.767 0.053 1
1 247 . 6 1 1 A 20 20 ARG N N 109 118.357 119.122 -0.765 1
1 248 . 6 1 1 A 21 21 LEU H H 110 7.601 7.862 -0.261 1
1 249 . 6 1 1 A 21 21 LEU HA H 110 4.380 4.389 -0.009 1
1 259 . 6 1 1 A 21 21 LEU C C 110 176.562 176.144 0.418 1
1 260 . 6 1 1 A 21 21 LEU CA C 110 56.096 55.330 0.766 1
1 261 . 6 1 1 A 21 21 LEU CB C 110 44.016 42.185 1.831 1
1 265 . 6 1 1 A 21 21 LEU N N 110 118.626 117.766 0.860 1
1 266 . 6 1 1 A 22 22 GLN H H 111 7.750 7.971 -0.221 1
1 267 . 6 1 1 A 22 22 GLN HA H 111 3.870 3.978 -0.108 1
1 274 . 6 1 1 A 22 22 GLN C C 111 173.336 174.135 -0.799 1
1 275 . 6 1 1 A 22 22 GLN CA C 111 56.510 57.386 -0.876 1
1 276 . 6 1 1 A 22 22 GLN CB C 111 26.800 26.666 0.134 1
1 278 . 6 1 1 A 22 22 GLN N N 111 113.926 115.755 -1.829 1
1 280 . 6 1 1 A 23 23 CYS H H 112 7.407 7.612 -0.205 1
1 281 . 6 1 1 A 23 23 CYS HA H 112 4.469 5.024 -0.555 1
1 284 . 6 1 1 A 23 23 CYS CA C 112 52.650 56.650 -4.000 1
1 285 . 6 1 1 A 23 23 CYS CB C 112 29.750 30.313 -0.563 1
1 286 . 6 1 1 A 23 23 CYS N N 112 112.681 117.304 -4.623 1
1 287 . 6 1 1 A 24 24 PRO HA H 113 4.408 4.499 -0.091 1
1 294 . 6 1 1 A 24 24 PRO C C 113 178.175 177.461 0.714 1
1 295 . 6 1 1 A 24 24 PRO CA C 113 62.040 62.511 -0.471 1
1 296 . 6 1 1 A 24 24 PRO CB C 113 31.920 33.461 -1.541 1
1 299 . 6 1 1 A 25 25 LEU H H 114 8.593 8.843 -0.250 1
1 300 . 6 1 1 A 25 25 LEU HA H 114 3.765 4.059 -0.294 1
1 310 . 6 1 1 A 25 25 LEU C C 114 179.950 178.628 1.322 1
1 311 . 6 1 1 A 25 25 LEU CA C 114 57.674 57.895 -0.221 1
1 312 . 6 1 1 A 25 25 LEU CB C 114 40.690 41.387 -0.697 1
1 316 . 6 1 1 A 25 25 LEU N N 114 123.729 123.495 0.234 1
1 317 . 6 1 1 A 26 26 GLU H H 115 9.108 8.347 0.761 1
1 318 . 6 1 1 A 26 26 GLU HA H 115 3.876 3.977 -0.101 1
1 323 . 6 1 1 A 26 26 GLU C C 115 177.505 179.347 -1.842 1
1 324 . 6 1 1 A 26 26 GLU CA C 115 59.410 59.517 -0.107 1
1 325 . 6 1 1 A 26 26 GLU CB C 115 28.460 29.277 -0.817 1
1 327 . 6 1 1 A 26 26 GLU N N 115 116.817 118.071 -1.254 1
1 328 . 6 1 1 A 27 27 ALA H H 116 7.360 7.644 -0.284 1
1 329 . 6 1 1 A 27 27 ALA HA H 116 4.408 3.827 0.581 1
1 333 . 6 1 1 A 27 27 ALA C C 116 177.046 178.151 -1.105 1
1 334 . 6 1 1 A 27 27 ALA CA C 116 52.970 54.608 -1.638 1
1 335 . 6 1 1 A 27 27 ALA CB C 116 19.916 17.862 2.054 1
1 336 . 6 1 1 A 27 27 ALA N N 116 118.966 121.373 -2.407 1
1 337 . 6 1 1 A 28 28 ILE H H 117 7.168 7.165 0.003 1
1 338 . 6 1 1 A 28 28 ILE HA H 117 4.432 4.678 -0.246 1
1 348 . 6 1 1 A 28 28 ILE C C 117 172.641 175.610 -2.969 1
1 349 . 6 1 1 A 28 28 ILE CA C 117 59.980 60.253 -0.273 1
1 350 . 6 1 1 A 28 28 ILE CB C 117 37.350 37.958 -0.608 1
1 354 . 6 1 1 A 28 28 ILE N N 117 108.913 108.897 0.016 1
1 355 . 6 1 1 A 29 29 GLN H H 118 6.562 7.322 -0.760 1
1 356 . 6 1 1 A 29 29 GLN HA H 118 3.922 4.221 -0.299 1
1 363 . 6 1 1 A 29 29 GLN C C 118 175.049 175.470 -0.421 1
1 364 . 6 1 1 A 29 29 GLN CA C 118 54.596 56.099 -1.503 1
1 365 . 6 1 1 A 29 29 GLN CB C 118 29.570 29.112 0.458 1
1 367 . 6 1 1 A 29 29 GLN N N 118 116.455 122.999 -6.544 1
1 369 . 6 1 1 A 30 30 CYS H H 119 8.138 8.388 -0.250 1
1 370 . 6 1 1 A 30 30 CYS HA H 119 4.580 4.543 0.037 1
1 373 . 6 1 1 A 30 30 CYS CA C 119 57.810 57.446 0.364 1
1 374 . 6 1 1 A 30 30 CYS CB C 119 30.200 28.831 1.369 1
1 375 . 6 1 1 A 30 30 CYS N N 119 134.136 125.470 8.666 1
1 376 . 6 1 1 A 31 31 PRO HA H 120 4.424 4.356 0.068 1
1 383 . 6 1 1 A 31 31 PRO C C 120 177.431 179.169 -1.738 1
1 384 . 6 1 1 A 31 31 PRO CA C 120 64.060 65.349 -1.289 1
1 385 . 6 1 1 A 31 31 PRO CB C 120 32.776 32.126 0.650 1
1 388 . 6 1 1 A 32 32 ILE H H 121 11.318 7.621 3.697 1
1 389 . 6 1 1 A 32 32 ILE HA H 121 4.038 3.934 0.104 1
1 399 . 6 1 1 A 32 32 ILE C C 121 178.485 177.318 1.167 1
1 400 . 6 1 1 A 32 32 ILE CA C 121 64.060 64.289 -0.229 1
1 401 . 6 1 1 A 32 32 ILE CB C 121 39.340 37.987 1.353 1
1 405 . 6 1 1 A 32 32 ILE N N 121 124.500 116.650 7.850 1
1 406 . 6 1 1 A 33 33 THR H H 122 9.928 7.351 2.577 1
1 407 . 6 1 1 A 33 33 THR HA H 122 4.048 4.452 -0.404 1
1 412 . 6 1 1 A 33 33 THR C C 122 175.793 174.620 1.173 1
1 413 . 6 1 1 A 33 33 THR CA C 122 62.990 61.559 1.431 1
1 414 . 6 1 1 A 33 33 THR CB C 122 70.300 69.201 1.099 1
1 416 . 6 1 1 A 33 33 THR N N 122 115.136 108.872 6.264 1
1 417 . 6 1 1 A 34 34 LEU H H 123 8.439 7.733 0.706 1
1 418 . 6 1 1 A 34 34 LEU HA H 123 3.912 4.009 -0.097 1
1 428 . 6 1 1 A 34 34 LEU C C 123 175.495 175.506 -0.011 1
1 429 . 6 1 1 A 34 34 LEU CA C 123 56.290 55.960 0.330 1
1 430 . 6 1 1 A 34 34 LEU CB C 123 38.500 39.718 -1.218 1
1 434 . 6 1 1 A 34 34 LEU N N 123 117.230 121.728 -4.498 1
1 435 . 6 1 1 A 35 35 GLU H H 124 7.816 7.534 0.282 1
1 436 . 6 1 1 A 35 35 GLU HA H 124 4.634 4.707 -0.073 1
1 441 . 6 1 1 A 35 35 GLU C C 124 174.838 174.144 0.694 1
1 442 . 6 1 1 A 35 35 GLU CA C 124 53.780 54.671 -0.891 1
1 443 . 6 1 1 A 35 35 GLU CB C 124 33.710 32.439 1.271 1
1 445 . 6 1 1 A 35 35 GLU N N 124 116.577 116.449 0.128 1
1 446 . 6 1 1 A 36 36 GLN H H 125 8.532 8.570 -0.038 1
1 447 . 6 1 1 A 36 36 GLN HA H 125 4.958 4.376 0.582 1
1 454 . 6 1 1 A 36 36 GLN CA C 125 53.350 53.853 -0.503 1
1 455 . 6 1 1 A 36 36 GLN CB C 125 29.950 29.928 0.022 1
1 457 . 6 1 1 A 36 36 GLN N N 125 123.034 121.506 1.528 1
1 459 . 6 1 1 A 37 37 PRO HA H 126 4.458 4.262 0.196 1
1 466 . 6 1 1 A 37 37 PRO C C 126 176.314 177.391 -1.077 1
1 467 . 6 1 1 A 37 37 PRO CA C 126 62.816 65.764 -2.948 1
1 468 . 6 1 1 A 37 37 PRO CB C 126 33.070 31.556 1.514 1
1 471 . 6 1 1 A 38 38 GLU H H 127 8.626 8.055 0.571 1
1 472 . 6 1 1 A 38 38 GLU HA H 127 4.274 4.421 -0.147 1
1 477 . 6 1 1 A 38 38 GLU C C 127 177.809 175.092 2.717 1
1 478 . 6 1 1 A 38 38 GLU CA C 127 58.730 58.338 0.392 1
1 479 . 6 1 1 A 38 38 GLU CB C 127 30.340 29.453 0.887 1
1 481 . 6 1 1 A 38 38 GLU N N 127 120.691 119.285 1.406 1
1 482 . 6 1 1 A 39 39 LYS H H 128 7.891 7.936 -0.045 1
1 483 . 6 1 1 A 39 39 LYS HA H 128 4.870 4.743 0.127 1
1 492 . 6 1 1 A 39 39 LYS C C 128 175.452 175.664 -0.212 1
1 493 . 6 1 1 A 39 39 LYS CA C 128 53.540 54.757 -1.217 1
1 494 . 6 1 1 A 39 39 LYS CB C 128 33.630 34.424 -0.794 1
1 498 . 6 1 1 A 39 39 LYS N N 128 118.149 117.864 0.285 1
1 499 . 6 1 1 A 40 40 GLY H H 129 8.524 8.133 0.391 1
1 500 . 6 1 1 A 40 40 GLY HA2 H 129 4.973 4.020 0.953 1
1 501 . 6 1 1 A 40 40 GLY HA3 H 129 2.459 4.157 -1.698 1
1 502 . 6 1 1 A 40 40 GLY C C 129 169.943 171.950 -2.007 1
1 503 . 6 1 1 A 40 40 GLY CA C 129 42.910 44.692 -1.782 1
1 504 . 6 1 1 A 40 40 GLY N N 129 112.845 111.103 1.742 1
1 505 . 6 1 1 A 41 41 ILE H H 130 8.659 8.126 0.533 1
1 506 . 6 1 1 A 41 41 ILE HA H 130 4.591 4.774 -0.183 1
1 516 . 6 1 1 A 41 41 ILE C C 130 172.586 174.031 -1.445 1
1 517 . 6 1 1 A 41 41 ILE CA C 130 58.090 59.071 -0.981 1
1 518 . 6 1 1 A 41 41 ILE CB C 130 43.320 42.045 1.275 1
1 522 . 6 1 1 A 41 41 ILE N N 130 114.060 119.371 -5.311 1
1 523 . 6 1 1 A 42 42 PHE H H 131 9.206 8.729 0.477 1
1 524 . 6 1 1 A 42 42 PHE HA H 131 5.159 4.679 0.480 1
1 532 . 6 1 1 A 42 42 PHE C C 131 174.931 175.766 -0.835 1
1 533 . 6 1 1 A 42 42 PHE CA C 131 57.790 58.186 -0.396 1
1 534 . 6 1 1 A 42 42 PHE CB C 131 42.220 39.231 2.989 1
1 538 . 6 1 1 A 42 42 PHE N N 131 126.002 128.409 -2.407 1
1 539 . 6 1 1 A 43 43 VAL H H 132 8.502 8.874 -0.372 1
1 540 . 6 1 1 A 43 43 VAL HA H 132 4.921 4.681 0.240 1
1 548 . 6 1 1 A 43 43 VAL C C 132 178.219 175.296 2.923 1
1 549 . 6 1 1 A 43 43 VAL CA C 132 59.600 60.360 -0.760 1
1 550 . 6 1 1 A 43 43 VAL CB C 132 35.920 35.442 0.478 1
1 553 . 6 1 1 A 43 43 VAL N N 132 119.068 122.579 -3.511 1
1 554 . 6 1 1 A 44 44 LYS H H 133 10.036 8.792 1.244 1
1 555 . 6 1 1 A 44 44 LYS HA H 133 5.070 4.295 0.775 1
1 564 . 6 1 1 A 44 44 LYS C C 133 177.276 177.610 -0.334 1
1 565 . 6 1 1 A 44 44 LYS CA C 133 56.720 57.168 -0.448 1
1 566 . 6 1 1 A 44 44 LYS CB C 133 34.410 32.514 1.896 1
1 570 . 6 1 1 A 44 44 LYS N N 133 130.934 126.082 4.852 1
1 571 . 6 1 1 A 45 45 ASN H H 134 8.093 8.680 -0.587 1
1 572 . 6 1 1 A 45 45 ASN HA H 134 4.152 4.524 -0.372 1
1 577 . 6 1 1 A 45 45 ASN C C 134 174.087 174.699 -0.612 1
1 578 . 6 1 1 A 45 45 ASN CA C 134 55.360 55.908 -0.548 1
1 579 . 6 1 1 A 45 45 ASN CB C 134 37.530 39.146 -1.616 1
1 580 . 6 1 1 A 45 45 ASN N N 134 117.963 123.671 -5.708 1
1 582 . 6 1 1 A 46 46 SER H H 135 7.524 7.330 0.194 1
1 583 . 6 1 1 A 46 46 SER HA H 135 4.219 4.787 -0.568 1
1 586 . 6 1 1 A 46 46 SER C C 135 174.490 173.708 0.782 1
1 587 . 6 1 1 A 46 46 SER CA C 135 57.090 57.699 -0.609 1
1 588 . 6 1 1 A 46 46 SER CB C 135 63.860 65.562 -1.702 1
1 589 . 6 1 1 A 46 46 SER N N 135 105.939 111.177 -5.238 1
1 590 . 6 1 1 A 47 47 ASP H H 136 9.113 9.036 0.077 1
1 591 . 6 1 1 A 47 47 ASP HA H 136 4.220 4.289 -0.069 1
1 594 . 6 1 1 A 47 47 ASP CA C 136 57.610 57.122 0.488 1
1 595 . 6 1 1 A 47 47 ASP CB C 136 40.810 40.570 0.240 1
1 596 . 6 1 1 A 47 47 ASP N N 136 120.995 127.342 -6.347 1
1 597 . 6 1 1 A 48 48 GLY H H 137 8.181 8.195 -0.014 1
1 598 . 6 1 1 A 48 48 GLY HA2 H 137 4.120 3.984 0.136 1
1 599 . 6 1 1 A 48 48 GLY HA3 H 137 3.659 3.986 -0.327 1
1 600 . 6 1 1 A 48 48 GLY C C 137 174.062 174.172 -0.110 1
1 601 . 6 1 1 A 48 48 GLY CA C 137 45.130 46.328 -1.198 1
1 602 . 6 1 1 A 48 48 GLY N N 137 106.197 107.164 -0.967 1
1 603 . 6 1 1 A 49 49 SER H H 138 7.179 7.527 -0.348 1
1 604 . 6 1 1 A 49 49 SER HA H 138 4.383 4.822 -0.439 1
1 607 . 6 1 1 A 49 49 SER C C 138 173.864 173.895 -0.031 1
1 608 . 6 1 1 A 49 49 SER CA C 138 57.614 57.383 0.231 1
1 609 . 6 1 1 A 49 49 SER CB C 138 65.100 65.777 -0.677 1
1 610 . 6 1 1 A 49 49 SER N N 138 115.015 116.107 -1.092 1
1 611 . 6 1 1 A 50 50 ASP H H 139 8.078 8.546 -0.468 1
1 612 . 6 1 1 A 50 50 ASP HA H 139 4.642 4.744 -0.102 1
1 615 . 6 1 1 A 50 50 ASP C C 139 174.261 174.474 -0.213 1
1 616 . 6 1 1 A 50 50 ASP CA C 139 52.406 53.981 -1.575 1
1 617 . 6 1 1 A 50 50 ASP CB C 139 40.254 39.064 1.190 1
1 618 . 6 1 1 A 50 50 ASP N N 139 122.400 122.557 -0.157 1
1 619 . 6 1 1 A 51 51 VAL H H 140 8.111 7.607 0.504 1
1 620 . 6 1 1 A 51 51 VAL HA H 140 4.360 4.762 -0.402 1
1 628 . 6 1 1 A 51 51 VAL C C 140 176.147 173.561 2.586 1
1 629 . 6 1 1 A 51 51 VAL CA C 140 62.670 60.473 2.197 1
1 630 . 6 1 1 A 51 51 VAL CB C 140 33.930 33.330 0.600 1
1 632 . 6 1 1 A 51 51 VAL N N 140 120.374 119.756 0.618 1
1 633 . 6 1 1 A 52 52 CYS H H 141 8.358 8.837 -0.479 1
1 634 . 6 1 1 A 52 52 CYS HA H 141 4.957 5.430 -0.473 1
1 637 . 6 1 1 A 52 52 CYS C C 141 173.070 172.813 0.257 1
1 638 . 6 1 1 A 52 52 CYS CA C 141 53.380 54.044 -0.664 1
1 639 . 6 1 1 A 52 52 CYS CB C 141 46.110 46.145 -0.035 1
1 640 . 6 1 1 A 52 52 CYS N N 141 121.305 129.065 -7.760 1
1 641 . 6 1 1 A 53 53 THR H H 142 8.929 8.965 -0.036 1
1 642 . 6 1 1 A 53 53 THR HA H 142 4.498 5.078 -0.580 1
1 648 . 6 1 1 A 53 53 THR C C 142 172.151 172.668 -0.517 1
1 649 . 6 1 1 A 53 53 THR CA C 142 62.960 61.429 1.531 1
1 650 . 6 1 1 A 53 53 THR CB C 142 70.540 71.421 -0.881 1
1 652 . 6 1 1 A 53 53 THR N N 142 120.105 121.307 -1.202 1
1 653 . 6 1 1 A 54 54 LEU H H 143 8.448 8.673 -0.225 1
1 654 . 6 1 1 A 54 54 LEU HA H 143 4.322 4.754 -0.432 1
1 664 . 6 1 1 A 54 54 LEU C C 143 174.484 174.388 0.096 1
1 665 . 6 1 1 A 54 54 LEU CA C 143 54.596 53.276 1.320 1
1 666 . 6 1 1 A 54 54 LEU CB C 143 42.396 43.626 -1.230 1
1 670 . 6 1 1 A 54 54 LEU N N 143 128.819 128.699 0.120 1
1 671 . 6 1 1 A 55 55 PHE H H 144 8.661 8.672 -0.011 1
1 672 . 6 1 1 A 55 55 PHE HA H 144 5.459 4.996 0.463 1
1 680 . 6 1 1 A 55 55 PHE C C 144 176.035 174.674 1.361 1
1 681 . 6 1 1 A 55 55 PHE CA C 144 55.020 56.674 -1.654 1
1 682 . 6 1 1 A 55 55 PHE CB C 144 44.100 42.730 1.370 1
1 686 . 6 1 1 A 55 55 PHE N N 144 121.897 126.127 -4.230 1
1 687 . 6 1 1 A 56 56 ASP H H 145 11.616 8.587 3.029 1
1 688 . 6 1 1 A 56 56 ASP HA H 145 4.417 4.697 -0.280 1
1 691 . 6 1 1 A 56 56 ASP C C 145 176.748 177.175 -0.427 1
1 692 . 6 1 1 A 56 56 ASP CA C 145 55.844 54.101 1.743 1
1 693 . 6 1 1 A 56 56 ASP CB C 145 44.390 43.164 1.226 1
1 694 . 6 1 1 A 56 56 ASP N N 145 122.131 121.296 0.835 1
1 695 . 6 1 1 A 57 57 ALA H H 146 8.508 9.034 -0.526 1
1 696 . 6 1 1 A 57 57 ALA HA H 146 3.797 4.037 -0.240 1
1 700 . 6 1 1 A 57 57 ALA C C 146 178.696 180.084 -1.388 1
1 701 . 6 1 1 A 57 57 ALA CA C 146 55.990 55.284 0.706 1
1 702 . 6 1 1 A 57 57 ALA CB C 146 18.840 18.158 0.682 1
1 703 . 6 1 1 A 57 57 ALA N N 146 130.243 128.563 1.680 1
1 704 . 6 1 1 A 58 58 ALA H H 147 8.378 7.688 0.690 1
1 705 . 6 1 1 A 58 58 ALA HA H 147 4.078 4.214 -0.136 1
1 709 . 6 1 1 A 58 58 ALA C C 147 181.091 179.765 1.326 1
1 710 . 6 1 1 A 58 58 ALA CA C 147 54.770 54.947 -0.177 1
1 711 . 6 1 1 A 58 58 ALA CB C 147 17.700 18.413 -0.713 1
1 712 . 6 1 1 A 58 58 ALA N N 147 121.997 119.916 2.081 1
1 713 . 6 1 1 A 59 59 ALA H H 148 9.138 8.050 1.088 1
1 714 . 6 1 1 A 59 59 ALA HA H 148 3.975 4.091 -0.116 1
1 718 . 6 1 1 A 59 59 ALA C C 148 180.508 179.799 0.709 1
1 719 . 6 1 1 A 59 59 ALA CA C 148 54.840 55.013 -0.173 1
1 720 . 6 1 1 A 59 59 ALA CB C 148 18.600 18.655 -0.055 1
1 721 . 6 1 1 A 59 59 ALA N N 148 123.595 120.458 3.137 1
1 722 . 6 1 1 A 60 60 PHE H H 149 8.814 8.003 0.811 1
1 723 . 6 1 1 A 60 60 PHE HA H 149 3.722 3.937 -0.215 1
1 731 . 6 1 1 A 60 60 PHE C C 149 176.773 177.642 -0.869 1
1 732 . 6 1 1 A 60 60 PHE CA C 149 62.030 61.487 0.543 1
1 733 . 6 1 1 A 60 60 PHE CB C 149 39.960 38.958 1.002 1
1 737 . 6 1 1 A 60 60 PHE N N 149 120.354 119.957 0.397 1
1 738 . 6 1 1 A 61 61 SER H H 150 8.276 8.104 0.172 1
1 739 . 6 1 1 A 61 61 SER HA H 150 3.880 4.079 -0.199 1
1 742 . 6 1 1 A 61 61 SER C C 150 177.691 176.488 1.203 1
1 743 . 6 1 1 A 61 61 SER CA C 150 62.190 61.396 0.794 1
1 744 . 6 1 1 A 61 61 SER CB C 150 63.016 62.979 0.037 1
1 745 . 6 1 1 A 61 61 SER N N 150 112.086 114.182 -2.096 1
1 746 . 6 1 1 A 62 62 ARG H H 151 7.829 7.796 0.033 1
1 747 . 6 1 1 A 62 62 ARG HA H 151 3.971 4.065 -0.094 1
1 754 . 6 1 1 A 62 62 ARG C C 151 178.287 178.396 -0.109 1
1 755 . 6 1 1 A 62 62 ARG CA C 151 59.340 58.990 0.350 1
1 756 . 6 1 1 A 62 62 ARG CB C 151 29.760 29.732 0.028 1
1 759 . 6 1 1 A 62 62 ARG N N 151 121.090 119.341 1.749 1
1 760 . 6 1 1 A 63 63 LEU H H 152 7.390 7.569 -0.179 1
1 761 . 6 1 1 A 63 63 LEU HA H 152 3.791 3.900 -0.109 1
1 771 . 6 1 1 A 63 63 LEU C C 152 179.106 178.174 0.932 1
1 772 . 6 1 1 A 63 63 LEU CA C 152 58.900 58.268 0.632 1
1 773 . 6 1 1 A 63 63 LEU CB C 152 41.140 41.334 -0.194 1
1 777 . 6 1 1 A 63 63 LEU N N 152 121.129 122.061 -0.932 1
1 778 . 6 1 1 A 64 64 VAL H H 153 7.552 8.016 -0.464 1
1 779 . 6 1 1 A 64 64 VAL HA H 153 3.411 3.470 -0.059 1
1 787 . 6 1 1 A 64 64 VAL C C 153 180.595 178.686 1.909 1
1 788 . 6 1 1 A 64 64 VAL CA C 153 65.644 66.069 -0.425 1
1 789 . 6 1 1 A 64 64 VAL CB C 153 31.410 31.295 0.115 1
1 792 . 6 1 1 A 64 64 VAL N N 153 118.280 118.910 -0.630 1
1 793 . 6 1 1 A 65 65 GLY H H 154 8.061 8.266 -0.205 1
1 794 . 6 1 1 A 65 65 GLY HA2 H 154 3.846 3.780 0.066 1
1 795 . 6 1 1 A 65 65 GLY HA3 H 154 3.809 3.782 0.027 1
1 796 . 6 1 1 A 65 65 GLY C C 154 175.235 175.449 -0.214 1
1 797 . 6 1 1 A 65 65 GLY CA C 154 46.630 46.785 -0.155 1
1 798 . 6 1 1 A 65 65 GLY N N 154 108.622 107.923 0.699 1
1 799 . 6 1 1 A 66 66 GLU H H 155 7.528 7.493 0.035 1
1 800 . 6 1 1 A 66 66 GLU HA H 155 4.228 4.354 -0.126 1
1 805 . 6 1 1 A 66 66 GLU C C 155 176.761 176.920 -0.159 1
1 806 . 6 1 1 A 66 66 GLU CA C 155 56.590 56.269 0.321 1
1 807 . 6 1 1 A 66 66 GLU CB C 155 30.490 30.243 0.247 1
1 809 . 6 1 1 A 66 66 GLU N N 155 118.361 118.808 -0.447 1
1 810 . 6 1 1 A 67 67 GLY H H 156 7.884 7.858 0.026 1
1 811 . 6 1 1 A 67 67 GLY HA2 H 156 3.918 3.850 0.068 1
1 812 . 6 1 1 A 67 67 GLY HA3 H 156 3.747 3.864 -0.117 1
1 813 . 6 1 1 A 67 67 GLY C C 156 174.788 174.566 0.222 1
1 814 . 6 1 1 A 67 67 GLY CA C 156 45.890 45.905 -0.015 1
1 815 . 6 1 1 A 67 67 GLY N N 156 108.465 109.508 -1.043 1
1 816 . 6 1 1 A 68 68 LEU H H 157 7.332 7.780 -0.448 1
1 817 . 6 1 1 A 68 68 LEU HA H 157 4.361 4.554 -0.193 1
1 827 . 6 1 1 A 68 68 LEU CA C 157 53.060 52.343 0.717 1
1 828 . 6 1 1 A 68 68 LEU CB C 157 41.100 41.559 -0.459 1
1 832 . 6 1 1 A 68 68 LEU N N 157 121.920 121.895 0.025 1
1 833 . 6 1 1 A 69 69 PRO HA H 158 4.485 4.603 -0.118 1
1 840 . 6 1 1 A 69 69 PRO C C 158 174.602 176.235 -1.633 1
1 841 . 6 1 1 A 69 69 PRO CA C 158 61.556 62.254 -0.698 1
1 842 . 6 1 1 A 69 69 PRO CB C 158 32.370 32.781 -0.411 1
1 845 . 6 1 1 A 70 70 HIS H H 159 8.734 8.694 0.040 1
1 846 . 6 1 1 A 70 70 HIS HA H 159 3.947 4.600 -0.653 1
1 852 . 6 1 1 A 70 70 HIS CA C 159 56.250 55.240 1.010 1
1 853 . 6 1 1 A 70 70 HIS CB C 159 32.280 31.104 1.176 1
1 856 . 6 1 1 A 70 70 HIS N N 159 119.423 120.582 -1.159 1
1 857 . 6 1 1 A 71 71 PRO HA H 160 4.424 4.152 0.272 1
1 864 . 6 1 1 A 71 71 PRO C C 160 177.567 178.639 -1.072 1
1 865 . 6 1 1 A 71 71 PRO CA C 160 64.574 65.565 -0.991 1
1 866 . 6 1 1 A 71 71 PRO CB C 160 32.340 31.789 0.551 1
1 869 . 6 1 1 A 72 72 LEU H H 161 10.123 7.568 2.555 1
1 870 . 6 1 1 A 72 72 LEU HA H 161 4.778 4.313 0.465 1
1 880 . 6 1 1 A 72 72 LEU C C 161 178.721 177.999 0.722 1
1 881 . 6 1 1 A 72 72 LEU CA C 161 55.800 57.139 -1.339 1
1 882 . 6 1 1 A 72 72 LEU CB C 161 42.440 42.501 -0.061 1
1 886 . 6 1 1 A 72 72 LEU N N 161 117.374 117.787 -0.413 1
1 887 . 6 1 1 A 73 73 THR H H 162 7.523 7.810 -0.287 1
1 888 . 6 1 1 A 73 73 THR HA H 162 4.291 4.555 -0.264 1
1 893 . 6 1 1 A 73 73 THR C C 162 175.557 174.369 1.188 1
1 894 . 6 1 1 A 73 73 THR CA C 162 61.440 62.223 -0.783 1
1 895 . 6 1 1 A 73 73 THR CB C 162 70.500 69.611 0.889 1
1 897 . 6 1 1 A 73 73 THR N N 162 107.787 111.316 -3.529 1
1 898 . 6 1 1 A 74 74 ARG H H 163 8.361 7.863 0.498 1
1 899 . 6 1 1 A 74 74 ARG HA H 163 3.836 4.248 -0.412 1
1 906 . 6 1 1 A 74 74 ARG C C 163 174.701 175.356 -0.655 1
1 907 . 6 1 1 A 74 74 ARG CA C 163 57.980 57.692 0.288 1
1 908 . 6 1 1 A 74 74 ARG CB C 163 26.770 27.145 -0.375 1
1 911 . 6 1 1 A 74 74 ARG N N 163 115.130 118.319 -3.189 1
1 912 . 6 1 1 A 75 75 GLU H H 164 7.430 8.054 -0.624 1
1 913 . 6 1 1 A 75 75 GLU HA H 164 4.636 4.456 0.180 1
1 918 . 6 1 1 A 75 75 GLU CA C 164 53.699 55.203 -1.504 1
1 919 . 6 1 1 A 75 75 GLU CB C 164 29.550 28.687 0.863 1
1 921 . 6 1 1 A 75 75 GLU N N 164 120.076 118.943 1.133 1
1 922 . 6 1 1 A 76 76 PRO HA H 165 4.272 4.613 -0.341 1
1 929 . 6 1 1 A 76 76 PRO C C 165 176.649 176.948 -0.299 1
1 930 . 6 1 1 A 76 76 PRO CA C 165 63.204 63.038 0.166 1
1 931 . 6 1 1 A 76 76 PRO CB C 165 31.680 31.580 0.100 1
1 934 . 6 1 1 A 77 77 ILE H H 166 8.812 8.228 0.584 1
1 935 . 6 1 1 A 77 77 ILE HA H 166 3.838 4.340 -0.502 1
1 945 . 6 1 1 A 77 77 ILE C C 166 175.235 175.432 -0.197 1
1 946 . 6 1 1 A 77 77 ILE CA C 166 62.816 60.853 1.963 1
1 947 . 6 1 1 A 77 77 ILE CB C 166 37.750 36.761 0.989 1
1 951 . 6 1 1 A 77 77 ILE N N 166 123.831 124.124 -0.293 1
1 952 . 6 1 1 A 78 78 THR H H 167 6.625 8.659 -2.034 1
1 953 . 6 1 1 A 78 78 THR HA H 167 4.632 5.051 -0.419 1
1 958 . 6 1 1 A 78 78 THR C C 167 174.143 174.666 -0.523 1
1 959 . 6 1 1 A 78 78 THR CA C 167 58.750 59.852 -1.102 1
1 960 . 6 1 1 A 78 78 THR CB C 167 71.320 71.343 -0.023 1
1 962 . 6 1 1 A 78 78 THR N N 167 115.293 119.878 -4.585 1
1 963 . 6 1 1 A 79 79 ALA H H 168 9.088 9.024 0.064 1
1 964 . 6 1 1 A 79 79 ALA HA H 168 3.916 4.140 -0.224 1
1 968 . 6 1 1 A 79 79 ALA C C 168 179.770 179.464 0.306 1
1 969 . 6 1 1 A 79 79 ALA CA C 168 55.480 54.980 0.500 1
1 970 . 6 1 1 A 79 79 ALA CB C 168 17.630 18.449 -0.819 1
1 971 . 6 1 1 A 79 79 ALA N N 168 122.102 127.372 -5.270 1
1 972 . 6 1 1 A 80 80 SER H H 169 7.988 7.595 0.393 1
1 973 . 6 1 1 A 80 80 SER HA H 169 4.091 4.214 -0.123 1
1 976 . 6 1 1 A 80 80 SER C C 169 175.836 176.561 -0.725 1
1 977 . 6 1 1 A 80 80 SER CA C 169 60.750 61.440 -0.690 1
1 978 . 6 1 1 A 80 80 SER CB C 169 62.510 63.093 -0.583 1
1 979 . 6 1 1 A 80 80 SER N N 169 109.660 113.219 -3.559 1
1 980 . 6 1 1 A 81 81 ILE H H 170 7.052 7.693 -0.641 1
1 981 . 6 1 1 A 81 81 ILE HA H 170 4.344 4.083 0.261 1
1 991 . 6 1 1 A 81 81 ILE C C 170 174.236 176.550 -2.314 1
1 992 . 6 1 1 A 81 81 ILE CA C 170 61.760 63.876 -2.116 1
1 993 . 6 1 1 A 81 81 ILE CB C 170 37.950 37.631 0.319 1
1 997 . 6 1 1 A 81 81 ILE N N 170 112.623 113.839 -1.216 1
1 998 . 6 1 1 A 82 82 ILE H H 171 7.345 7.579 -0.234 1
1 999 . 6 1 1 A 82 82 ILE HA H 171 4.288 4.000 0.288 1
1 1009 . 6 1 1 A 82 82 ILE C C 171 174.931 175.549 -0.618 1
1 1010 . 6 1 1 A 82 82 ILE CA C 171 61.420 62.260 -0.840 1
1 1011 . 6 1 1 A 82 82 ILE CB C 171 37.230 37.654 -0.424 1
1 1015 . 6 1 1 A 82 82 ILE N N 171 124.260 125.099 -0.839 1
1 1016 . 6 1 1 A 83 83 VAL H H 172 7.843 8.868 -1.025 1
1 1017 . 6 1 1 A 83 83 VAL HA H 172 4.818 5.143 -0.325 1
1 1025 . 6 1 1 A 83 83 VAL C C 172 174.918 175.282 -0.364 1
1 1026 . 6 1 1 A 83 83 VAL CA C 172 58.910 59.064 -0.154 1
1 1027 . 6 1 1 A 83 83 VAL CB C 172 34.570 35.735 -1.165 1
1 1030 . 6 1 1 A 83 83 VAL N N 172 118.856 121.669 -2.813 1
1 1031 . 6 1 1 A 84 84 LYS H H 173 8.347 8.588 -0.241 1
1 1032 . 6 1 1 A 84 84 LYS HA H 173 4.356 4.800 -0.444 1
1 1041 . 6 1 1 A 84 84 LYS C C 173 178.653 178.250 0.403 1
1 1042 . 6 1 1 A 84 84 LYS CA C 173 56.360 54.587 1.773 1
1 1043 . 6 1 1 A 84 84 LYS CB C 173 33.366 34.770 -1.404 1
1 1047 . 6 1 1 A 84 84 LYS N N 173 119.602 120.992 -1.390 1
1 1048 . 6 1 1 A 85 85 HIS H H 174 9.143 9.034 0.109 1
1 1049 . 6 1 1 A 85 85 HIS HA H 174 4.013 4.150 -0.137 1
1 1053 . 6 1 1 A 85 85 HIS C C 174 176.606 176.966 -0.360 1
1 1054 . 6 1 1 A 85 85 HIS CA C 174 58.820 59.551 -0.731 1
1 1055 . 6 1 1 A 85 85 HIS CB C 174 28.186 29.913 -1.727 1
1 1057 . 6 1 1 A 85 85 HIS N N 174 120.022 122.390 -2.368 1
1 1058 . 6 1 1 A 86 86 GLU H H 175 8.403 8.482 -0.079 1
1 1059 . 6 1 1 A 86 86 GLU HA H 175 3.863 3.794 0.069 1
1 1064 . 6 1 1 A 86 86 GLU C C 175 177.040 178.408 -1.368 1
1 1065 . 6 1 1 A 86 86 GLU CA C 175 57.830 59.647 -1.817 1
1 1066 . 6 1 1 A 86 86 GLU CB C 175 28.690 29.105 -0.415 1
1 1068 . 6 1 1 A 86 86 GLU N N 175 116.124 119.741 -3.617 1
1 1069 . 6 1 1 A 87 87 GLU H H 176 7.669 7.968 -0.299 1
1 1070 . 6 1 1 A 87 87 GLU HA H 176 4.039 4.138 -0.099 1
1 1075 . 6 1 1 A 87 87 GLU C C 176 175.688 177.312 -1.624 1
1 1076 . 6 1 1 A 87 87 GLU CA C 176 57.906 59.195 -1.289 1
1 1077 . 6 1 1 A 87 87 GLU CB C 176 30.430 29.000 1.430 1
1 1079 . 6 1 1 A 87 87 GLU N N 176 116.183 118.436 -2.253 1
1 1080 . 6 1 1 A 88 88 CYS H H 177 6.750 7.520 -0.770 1
1 1081 . 6 1 1 A 88 88 CYS HA H 177 4.991 4.605 0.386 1
1 1084 . 6 1 1 A 88 88 CYS C C 177 172.325 173.550 -1.225 1
1 1085 . 6 1 1 A 88 88 CYS CA C 177 55.030 54.306 0.724 1
1 1086 . 6 1 1 A 88 88 CYS CB C 177 45.610 42.185 3.425 1
1 1087 . 6 1 1 A 88 88 CYS N N 177 114.838 116.637 -1.799 1
1 1088 . 6 1 1 A 89 89 ILE H H 178 9.128 8.540 0.588 1
1 1089 . 6 1 1 A 89 89 ILE HA H 178 4.536 4.842 -0.306 1
1 1099 . 6 1 1 A 89 89 ILE C C 178 174.893 174.318 0.575 1
1 1100 . 6 1 1 A 89 89 ILE CA C 178 59.160 59.270 -0.110 1
1 1101 . 6 1 1 A 89 89 ILE CB C 178 41.840 40.770 1.070 1
1 1105 . 6 1 1 A 89 89 ILE N N 178 120.564 121.362 -0.798 1
1 1106 . 6 1 1 A 90 90 TYR H H 179 9.349 9.019 0.330 1
1 1107 . 6 1 1 A 90 90 TYR HA H 179 3.568 4.056 -0.488 1
1 1112 . 6 1 1 A 90 90 TYR C C 179 173.950 173.697 0.253 1
1 1113 . 6 1 1 A 90 90 TYR CA C 179 61.180 57.785 3.395 1
1 1114 . 6 1 1 A 90 90 TYR CB C 179 37.530 38.139 -0.609 1
1 1116 . 6 1 1 A 90 90 TYR N N 179 129.033 126.675 2.358 1
1 1117 . 6 1 1 A 91 91 ASP H H 180 7.367 8.193 -0.826 1
1 1118 . 6 1 1 A 91 91 ASP HA H 180 4.662 4.601 0.061 1
1 1121 . 6 1 1 A 91 91 ASP C C 180 175.291 175.488 -0.197 1
1 1122 . 6 1 1 A 91 91 ASP CA C 180 52.230 52.185 0.045 1
1 1123 . 6 1 1 A 91 91 ASP CB C 180 43.650 42.040 1.610 1
1 1124 . 6 1 1 A 91 91 ASP N N 180 129.305 128.809 0.496 1
1 1125 . 6 1 1 A 92 92 ASP H H 181 8.783 8.656 0.127 1
1 1126 . 6 1 1 A 92 92 ASP HA H 181 4.114 3.952 0.162 1
1 1129 . 6 1 1 A 92 92 ASP C C 181 177.573 178.146 -0.573 1
1 1130 . 6 1 1 A 92 92 ASP CA C 181 56.390 57.207 -0.817 1
1 1131 . 6 1 1 A 92 92 ASP CB C 181 41.330 40.227 1.103 1
1 1132 . 6 1 1 A 92 92 ASP N N 181 125.665 125.381 0.284 1
1 1133 . 6 1 1 A 93 93 THR H H 182 8.284 8.014 0.270 1
1 1134 . 6 1 1 A 93 93 THR HA H 182 4.037 3.839 0.198 1
1 1139 . 6 1 1 A 93 93 THR C C 182 176.333 176.071 0.262 1
1 1140 . 6 1 1 A 93 93 THR CA C 182 65.320 66.962 -1.642 1
1 1141 . 6 1 1 A 93 93 THR CB C 182 68.560 68.588 -0.028 1
1 1143 . 6 1 1 A 93 93 THR N N 182 114.688 116.845 -2.157 1
1 1144 . 6 1 1 A 94 94 ARG H H 183 7.784 7.481 0.303 1
1 1145 . 6 1 1 A 94 94 ARG HA H 183 4.142 4.264 -0.122 1
1 1152 . 6 1 1 A 94 94 ARG C C 183 177.015 177.064 -0.049 1
1 1153 . 6 1 1 A 94 94 ARG CA C 183 55.350 56.119 -0.769 1
1 1154 . 6 1 1 A 94 94 ARG CB C 183 30.930 31.015 -0.085 1
1 1157 . 6 1 1 A 94 94 ARG N N 183 120.156 118.416 1.740 1
1 1158 . 6 1 1 A 95 95 GLY H H 184 8.144 8.828 -0.684 1
1 1159 . 6 1 1 A 95 95 GLY HA2 H 184 3.839 3.928 -0.089 1
1 1160 . 6 1 1 A 95 95 GLY HA3 H 184 3.681 3.928 -0.247 1
1 1161 . 6 1 1 A 95 95 GLY C C 184 173.653 173.344 0.309 1
1 1162 . 6 1 1 A 95 95 GLY CA C 184 46.160 46.102 0.058 1
1 1163 . 6 1 1 A 95 95 GLY N N 184 107.879 109.023 -1.144 1
1 1164 . 6 1 1 A 96 96 ASN H H 185 6.855 7.340 -0.485 1
1 1165 . 6 1 1 A 96 96 ASN HA H 185 4.909 5.225 -0.316 1
1 1170 . 6 1 1 A 96 96 ASN C C 185 174.223 173.257 0.966 1
1 1171 . 6 1 1 A 96 96 ASN CA C 185 52.720 52.486 0.234 1
1 1172 . 6 1 1 A 96 96 ASN CB C 185 45.620 42.217 3.403 1
1 1173 . 6 1 1 A 96 96 ASN N N 185 113.382 116.751 -3.369 1
1 1175 . 6 1 1 A 97 97 PHE H H 186 9.228 8.934 0.294 1
1 1176 . 6 1 1 A 97 97 PHE HA H 186 4.579 5.056 -0.477 1
1 1183 . 6 1 1 A 97 97 PHE C C 186 174.794 175.314 -0.520 1
1 1184 . 6 1 1 A 97 97 PHE CA C 186 59.384 58.337 1.047 1
1 1185 . 6 1 1 A 97 97 PHE CB C 186 40.450 39.375 1.075 1
1 1188 . 6 1 1 A 97 97 PHE N N 186 118.661 119.997 -1.336 1
1 1189 . 6 1 1 A 98 98 ILE H H 187 8.908 9.225 -0.317 1
1 1190 . 6 1 1 A 98 98 ILE HA H 187 5.440 4.529 0.911 1
1 1200 . 6 1 1 A 98 98 ILE C C 187 176.171 175.308 0.863 1
1 1201 . 6 1 1 A 98 98 ILE CA C 187 57.610 60.276 -2.666 1
1 1202 . 6 1 1 A 98 98 ILE CB C 187 41.280 40.398 0.882 1
1 1206 . 6 1 1 A 98 98 ILE N N 187 120.585 123.377 -2.792 1
1 1207 . 6 1 1 A 99 99 ILE H H 188 8.602 8.572 0.030 1
1 1208 . 6 1 1 A 99 99 ILE HA H 188 4.546 4.782 -0.236 1
1 1218 . 6 1 1 A 99 99 ILE C C 188 176.668 175.199 1.469 1
1 1219 . 6 1 1 A 99 99 ILE CA C 188 58.920 60.702 -1.782 1
1 1220 . 6 1 1 A 99 99 ILE CB C 188 37.960 37.815 0.145 1
1 1224 . 6 1 1 A 99 99 ILE N N 188 124.500 127.913 -3.413 1
1 1225 . 6 1 1 A 100 100 LYS H H 189 8.449 8.618 -0.169 1
1 1226 . 6 1 1 A 100 100 LYS HA H 189 4.108 5.005 -0.897 1
1 1235 . 6 1 1 A 100 100 LYS C C 189 176.866 176.082 0.784 1
1 1236 . 6 1 1 A 100 100 LYS CA C 189 56.800 54.797 2.003 1
1 1237 . 6 1 1 A 100 100 LYS CB C 189 33.400 34.791 -1.391 1
1 1241 . 6 1 1 A 100 100 LYS N N 189 128.581 126.507 2.074 1
1 1242 . 6 1 1 A 101 101 GLY H H 190 8.381 8.277 0.104 1
1 1243 . 6 1 1 A 101 101 GLY HA2 H 190 3.946 3.954 -0.008 1
1 1244 . 6 1 1 A 101 101 GLY HA3 H 190 3.828 3.955 -0.127 1
1 1245 . 6 1 1 A 101 101 GLY C C 190 172.902 174.466 -1.564 1
1 1246 . 6 1 1 A 101 101 GLY CA C 190 44.920 45.514 -0.594 1
1 1247 . 6 1 1 A 101 101 GLY N N 190 111.183 111.673 -0.490 1
1 7 . 7 1 1 A 2 2 GLN H H 91 8.786 7.939 0.847 1
1 8 . 7 1 1 A 2 2 GLN HA H 91 4.005 3.977 0.028 1
1 15 . 7 1 1 A 2 2 GLN C C 91 177.270 178.437 -1.167 1
1 16 . 7 1 1 A 2 2 GLN CA C 91 58.220 59.117 -0.897 1
1 17 . 7 1 1 A 2 2 GLN CB C 91 28.650 28.002 0.648 1
1 19 . 7 1 1 A 2 2 GLN N N 91 121.993 121.000 0.993 1
1 21 . 7 1 1 A 3 3 GLU H H 92 8.430 8.415 0.015 1
1 22 . 7 1 1 A 3 3 GLU HA H 92 4.007 4.082 -0.075 1
1 27 . 7 1 1 A 3 3 GLU C C 92 178.287 179.192 -0.905 1
1 28 . 7 1 1 A 3 3 GLU CA C 92 59.490 59.603 -0.113 1
1 29 . 7 1 1 A 3 3 GLU CB C 92 29.506 29.301 0.205 1
1 31 . 7 1 1 A 3 3 GLU N N 92 120.195 120.853 -0.658 1
1 32 . 7 1 1 A 4 4 SER H H 93 8.209 8.018 0.191 1
1 33 . 7 1 1 A 4 4 SER HA H 93 4.272 4.213 0.059 1
1 36 . 7 1 1 A 4 4 SER C C 93 177.369 176.898 0.471 1
1 37 . 7 1 1 A 4 4 SER CA C 93 61.044 62.254 -1.210 1
1 38 . 7 1 1 A 4 4 SER CB C 93 62.950 62.850 0.100 1
1 39 . 7 1 1 A 4 4 SER N N 93 115.524 116.762 -1.238 1
1 40 . 7 1 1 A 5 5 ILE H H 94 8.080 7.759 0.321 1
1 41 . 7 1 1 A 5 5 ILE HA H 94 3.530 3.643 -0.113 1
1 51 . 7 1 1 A 5 5 ILE C C 94 177.778 177.657 0.121 1
1 52 . 7 1 1 A 5 5 ILE CA C 94 65.710 65.299 0.411 1
1 53 . 7 1 1 A 5 5 ILE CB C 94 37.800 37.265 0.535 1
1 57 . 7 1 1 A 5 5 ILE N N 94 124.148 121.660 2.488 1
1 58 . 7 1 1 A 6 6 GLN H H 95 8.374 8.467 -0.093 1
1 59 . 7 1 1 A 6 6 GLN HA H 95 4.125 3.916 0.209 1
1 66 . 7 1 1 A 6 6 GLN C C 95 179.726 179.294 0.432 1
1 67 . 7 1 1 A 6 6 GLN CA C 95 59.190 58.955 0.235 1
1 68 . 7 1 1 A 6 6 GLN CB C 95 27.060 28.293 -1.233 1
1 70 . 7 1 1 A 6 6 GLN N N 95 118.257 119.120 -0.863 1
1 72 . 7 1 1 A 7 7 ASN H H 96 8.456 7.927 0.529 1
1 73 . 7 1 1 A 7 7 ASN HA H 96 4.446 4.551 -0.105 1
1 78 . 7 1 1 A 7 7 ASN C C 96 177.257 177.628 -0.371 1
1 79 . 7 1 1 A 7 7 ASN CA C 96 56.020 56.205 -0.185 1
1 80 . 7 1 1 A 7 7 ASN CB C 96 38.126 37.740 0.386 1
1 81 . 7 1 1 A 7 7 ASN N N 96 118.597 118.439 0.158 1
1 83 . 7 1 1 A 8 8 LYS H H 97 7.732 7.851 -0.119 1
1 84 . 7 1 1 A 8 8 LYS HA H 97 4.129 4.068 0.061 1
1 93 . 7 1 1 A 8 8 LYS C C 97 179.143 179.279 -0.136 1
1 94 . 7 1 1 A 8 8 LYS CA C 97 59.126 59.961 -0.835 1
1 95 . 7 1 1 A 8 8 LYS CB C 97 32.070 32.470 -0.400 1
1 99 . 7 1 1 A 8 8 LYS N N 97 122.381 120.833 1.548 1
1 100 . 7 1 1 A 9 9 ILE H H 98 8.452 8.058 0.394 1
1 101 . 7 1 1 A 9 9 ILE HA H 98 3.480 3.914 -0.434 1
1 111 . 7 1 1 A 9 9 ILE C C 98 177.406 178.776 -1.370 1
1 112 . 7 1 1 A 9 9 ILE CA C 98 66.430 64.292 2.138 1
1 113 . 7 1 1 A 9 9 ILE CB C 98 37.980 36.913 1.067 1
1 117 . 7 1 1 A 9 9 ILE N N 98 119.950 120.083 -0.133 1
1 118 . 7 1 1 A 10 10 SER H H 99 7.924 7.890 0.034 1
1 119 . 7 1 1 A 10 10 SER HA H 99 3.983 4.256 -0.273 1
1 122 . 7 1 1 A 10 10 SER C C 99 176.327 176.203 0.124 1
1 123 . 7 1 1 A 10 10 SER CA C 99 61.990 61.448 0.542 1
1 124 . 7 1 1 A 10 10 SER CB C 99 62.790 63.341 -0.551 1
1 125 . 7 1 1 A 10 10 SER N N 99 113.568 117.470 -3.902 1
1 126 . 7 1 1 A 11 11 GLN H H 100 7.832 7.855 -0.023 1
1 127 . 7 1 1 A 11 11 GLN HA H 100 4.238 4.383 -0.145 1
1 134 . 7 1 1 A 11 11 GLN C C 100 178.088 177.887 0.201 1
1 135 . 7 1 1 A 11 11 GLN CA C 100 57.900 57.194 0.706 1
1 136 . 7 1 1 A 11 11 GLN CB C 100 29.790 29.664 0.126 1
1 138 . 7 1 1 A 11 11 GLN N N 100 117.487 117.474 0.013 1
1 140 . 7 1 1 A 12 12 CYS H H 101 7.920 8.110 -0.190 1
1 141 . 7 1 1 A 12 12 CYS HA H 101 4.657 4.528 0.129 1
1 144 . 7 1 1 A 12 12 CYS C C 101 175.439 174.823 0.616 1
1 145 . 7 1 1 A 12 12 CYS CA C 101 60.654 60.529 0.125 1
1 146 . 7 1 1 A 12 12 CYS CB C 101 29.310 27.919 1.391 1
1 147 . 7 1 1 A 12 12 CYS N N 101 114.221 117.253 -3.032 1
1 148 . 7 1 1 A 13 13 LYS H H 102 7.993 7.480 0.513 1
1 149 . 7 1 1 A 13 13 LYS HA H 102 5.038 4.427 0.611 1
1 158 . 7 1 1 A 13 13 LYS C C 102 174.757 176.305 -1.548 1
1 159 . 7 1 1 A 13 13 LYS CA C 102 56.660 56.113 0.547 1
1 160 . 7 1 1 A 13 13 LYS CB C 102 32.970 33.386 -0.416 1
1 164 . 7 1 1 A 13 13 LYS N N 102 123.841 119.546 4.295 1
1 165 . 7 1 1 A 14 14 PHE H H 103 8.822 8.698 0.124 1
1 166 . 7 1 1 A 14 14 PHE HA H 103 5.058 5.050 0.008 1
1 174 . 7 1 1 A 14 14 PHE C C 103 173.560 173.007 0.553 1
1 175 . 7 1 1 A 14 14 PHE CA C 103 55.470 55.981 -0.511 1
1 176 . 7 1 1 A 14 14 PHE CB C 103 41.760 40.990 0.770 1
1 180 . 7 1 1 A 14 14 PHE N N 103 118.421 116.450 1.971 1
1 181 . 7 1 1 A 15 15 SER H H 104 8.826 8.850 -0.024 1
1 182 . 7 1 1 A 15 15 SER HA H 104 4.602 4.633 -0.031 1
1 185 . 7 1 1 A 15 15 SER C C 104 173.851 173.583 0.268 1
1 186 . 7 1 1 A 15 15 SER CA C 104 58.610 58.778 -0.168 1
1 187 . 7 1 1 A 15 15 SER CB C 104 62.690 62.475 0.215 1
1 188 . 7 1 1 A 15 15 SER N N 104 117.781 116.643 1.138 1
1 189 . 7 1 1 A 16 16 VAL H H 105 7.839 8.263 -0.424 1
1 190 . 7 1 1 A 16 16 VAL HA H 105 3.390 4.325 -0.935 1
1 198 . 7 1 1 A 16 16 VAL C C 105 174.987 175.125 -0.138 1
1 199 . 7 1 1 A 16 16 VAL CA C 105 63.650 62.196 1.454 1
1 200 . 7 1 1 A 16 16 VAL CB C 105 31.410 30.281 1.129 1
1 203 . 7 1 1 A 16 16 VAL N N 105 129.036 126.813 2.223 1
1 204 . 7 1 1 A 17 17 CYS H H 106 8.536 8.159 0.377 1
1 205 . 7 1 1 A 17 17 CYS HA H 106 5.011 4.936 0.075 1
1 208 . 7 1 1 A 17 17 CYS CA C 106 55.260 56.304 -1.044 1
1 209 . 7 1 1 A 17 17 CYS CB C 106 28.210 30.241 -2.031 1
1 210 . 7 1 1 A 17 17 CYS N N 106 130.045 127.534 2.511 1
1 211 . 7 1 1 A 18 18 PRO HA H 107 3.991 4.363 -0.372 1
1 218 . 7 1 1 A 18 18 PRO C C 107 178.188 178.601 -0.413 1
1 219 . 7 1 1 A 18 18 PRO CA C 107 65.940 65.459 0.481 1
1 220 . 7 1 1 A 18 18 PRO CB C 107 32.000 31.893 0.107 1
1 223 . 7 1 1 A 19 19 GLU H H 108 9.260 9.013 0.247 1
1 224 . 7 1 1 A 19 19 GLU HA H 108 4.119 4.107 0.012 1
1 229 . 7 1 1 A 19 19 GLU C C 108 178.721 179.218 -0.497 1
1 230 . 7 1 1 A 19 19 GLU CA C 108 59.300 59.165 0.135 1
1 231 . 7 1 1 A 19 19 GLU CB C 108 28.920 28.673 0.247 1
1 233 . 7 1 1 A 19 19 GLU N N 108 118.270 116.687 1.583 1
1 234 . 7 1 1 A 20 20 ARG H H 109 7.672 7.949 -0.277 1
1 235 . 7 1 1 A 20 20 ARG HA H 109 4.331 4.112 0.219 1
1 242 . 7 1 1 A 20 20 ARG C C 109 177.977 178.636 -0.659 1
1 243 . 7 1 1 A 20 20 ARG CA C 109 57.350 59.221 -1.871 1
1 244 . 7 1 1 A 20 20 ARG CB C 109 30.820 30.301 0.519 1
1 247 . 7 1 1 A 20 20 ARG N N 109 118.357 119.636 -1.279 1
1 248 . 7 1 1 A 21 21 LEU H H 110 7.601 7.877 -0.276 1
1 249 . 7 1 1 A 21 21 LEU HA H 110 4.380 4.350 0.030 1
1 259 . 7 1 1 A 21 21 LEU C C 110 176.562 176.506 0.056 1
1 260 . 7 1 1 A 21 21 LEU CA C 110 56.096 55.727 0.369 1
1 261 . 7 1 1 A 21 21 LEU CB C 110 44.016 42.307 1.709 1
1 265 . 7 1 1 A 21 21 LEU N N 110 118.626 119.019 -0.393 1
1 266 . 7 1 1 A 22 22 GLN H H 111 7.750 7.635 0.115 1
1 267 . 7 1 1 A 22 22 GLN HA H 111 3.870 3.976 -0.106 1
1 274 . 7 1 1 A 22 22 GLN C C 111 173.336 173.982 -0.646 1
1 275 . 7 1 1 A 22 22 GLN CA C 111 56.510 57.418 -0.908 1
1 276 . 7 1 1 A 22 22 GLN CB C 111 26.800 26.486 0.314 1
1 278 . 7 1 1 A 22 22 GLN N N 111 113.926 115.784 -1.858 1
1 280 . 7 1 1 A 23 23 CYS H H 112 7.407 7.625 -0.218 1
1 281 . 7 1 1 A 23 23 CYS HA H 112 4.469 4.810 -0.341 1
1 284 . 7 1 1 A 23 23 CYS CA C 112 52.650 56.610 -3.960 1
1 285 . 7 1 1 A 23 23 CYS CB C 112 29.750 28.634 1.116 1
1 286 . 7 1 1 A 23 23 CYS N N 112 112.681 117.490 -4.809 1
1 287 . 7 1 1 A 24 24 PRO HA H 113 4.408 4.455 -0.047 1
1 294 . 7 1 1 A 24 24 PRO C C 113 178.175 177.489 0.686 1
1 295 . 7 1 1 A 24 24 PRO CA C 113 62.040 62.529 -0.489 1
1 296 . 7 1 1 A 24 24 PRO CB C 113 31.920 32.847 -0.927 1
1 299 . 7 1 1 A 25 25 LEU H H 114 8.593 8.828 -0.235 1
1 300 . 7 1 1 A 25 25 LEU HA H 114 3.765 4.051 -0.286 1
1 310 . 7 1 1 A 25 25 LEU C C 114 179.950 178.638 1.312 1
1 311 . 7 1 1 A 25 25 LEU CA C 114 57.674 57.982 -0.308 1
1 312 . 7 1 1 A 25 25 LEU CB C 114 40.690 41.425 -0.735 1
1 316 . 7 1 1 A 25 25 LEU N N 114 123.729 123.829 -0.100 1
1 317 . 7 1 1 A 26 26 GLU H H 115 9.108 8.232 0.876 1
1 318 . 7 1 1 A 26 26 GLU HA H 115 3.876 3.995 -0.119 1
1 323 . 7 1 1 A 26 26 GLU C C 115 177.505 178.976 -1.471 1
1 324 . 7 1 1 A 26 26 GLU CA C 115 59.410 59.590 -0.180 1
1 325 . 7 1 1 A 26 26 GLU CB C 115 28.460 29.303 -0.843 1
1 327 . 7 1 1 A 26 26 GLU N N 115 116.817 118.124 -1.307 1
1 328 . 7 1 1 A 27 27 ALA H H 116 7.360 7.848 -0.488 1
1 329 . 7 1 1 A 27 27 ALA HA H 116 4.408 3.900 0.508 1
1 333 . 7 1 1 A 27 27 ALA C C 116 177.046 178.701 -1.655 1
1 334 . 7 1 1 A 27 27 ALA CA C 116 52.970 54.681 -1.711 1
1 335 . 7 1 1 A 27 27 ALA CB C 116 19.916 17.873 2.043 1
1 336 . 7 1 1 A 27 27 ALA N N 116 118.966 122.030 -3.064 1
1 337 . 7 1 1 A 28 28 ILE H H 117 7.168 7.200 -0.032 1
1 338 . 7 1 1 A 28 28 ILE HA H 117 4.432 4.661 -0.229 1
1 348 . 7 1 1 A 28 28 ILE C C 117 172.641 175.697 -3.056 1
1 349 . 7 1 1 A 28 28 ILE CA C 117 59.980 60.504 -0.524 1
1 350 . 7 1 1 A 28 28 ILE CB C 117 37.350 37.917 -0.567 1
1 354 . 7 1 1 A 28 28 ILE N N 117 108.913 109.229 -0.316 1
1 355 . 7 1 1 A 29 29 GLN H H 118 6.562 7.356 -0.794 1
1 356 . 7 1 1 A 29 29 GLN HA H 118 3.922 4.201 -0.279 1
1 363 . 7 1 1 A 29 29 GLN C C 118 175.049 175.705 -0.656 1
1 364 . 7 1 1 A 29 29 GLN CA C 118 54.596 55.922 -1.326 1
1 365 . 7 1 1 A 29 29 GLN CB C 118 29.570 29.067 0.503 1
1 367 . 7 1 1 A 29 29 GLN N N 118 116.455 123.272 -6.817 1
1 369 . 7 1 1 A 30 30 CYS H H 119 8.138 8.393 -0.255 1
1 370 . 7 1 1 A 30 30 CYS HA H 119 4.580 4.480 0.100 1
1 373 . 7 1 1 A 30 30 CYS CA C 119 57.810 57.625 0.185 1
1 374 . 7 1 1 A 30 30 CYS CB C 119 30.200 28.665 1.535 1
1 375 . 7 1 1 A 30 30 CYS N N 119 134.136 125.255 8.881 1
1 376 . 7 1 1 A 31 31 PRO HA H 120 4.424 4.504 -0.080 1
1 383 . 7 1 1 A 31 31 PRO C C 120 177.431 177.674 -0.243 1
1 384 . 7 1 1 A 31 31 PRO CA C 120 64.060 64.292 -0.232 1
1 385 . 7 1 1 A 31 31 PRO CB C 120 32.776 31.884 0.892 1
1 388 . 7 1 1 A 32 32 ILE H H 121 11.318 7.227 4.091 1
1 389 . 7 1 1 A 32 32 ILE HA H 121 4.038 3.999 0.039 1
1 399 . 7 1 1 A 32 32 ILE C C 121 178.485 177.742 0.743 1
1 400 . 7 1 1 A 32 32 ILE CA C 121 64.060 63.921 0.139 1
1 401 . 7 1 1 A 32 32 ILE CB C 121 39.340 38.702 0.638 1
1 405 . 7 1 1 A 32 32 ILE N N 121 124.500 116.793 7.707 1
1 406 . 7 1 1 A 33 33 THR H H 122 9.928 7.391 2.537 1
1 407 . 7 1 1 A 33 33 THR HA H 122 4.048 4.462 -0.414 1
1 412 . 7 1 1 A 33 33 THR C C 122 175.793 174.471 1.322 1
1 413 . 7 1 1 A 33 33 THR CA C 122 62.990 61.502 1.488 1
1 414 . 7 1 1 A 33 33 THR CB C 122 70.300 69.213 1.087 1
1 416 . 7 1 1 A 33 33 THR N N 122 115.136 108.639 6.497 1
1 417 . 7 1 1 A 34 34 LEU H H 123 8.439 7.763 0.676 1
1 418 . 7 1 1 A 34 34 LEU HA H 123 3.912 4.080 -0.168 1
1 428 . 7 1 1 A 34 34 LEU C C 123 175.495 175.507 -0.012 1
1 429 . 7 1 1 A 34 34 LEU CA C 123 56.290 55.742 0.548 1
1 430 . 7 1 1 A 34 34 LEU CB C 123 38.500 39.689 -1.189 1
1 434 . 7 1 1 A 34 34 LEU N N 123 117.230 121.123 -3.893 1
1 435 . 7 1 1 A 35 35 GLU H H 124 7.816 7.499 0.317 1
1 436 . 7 1 1 A 35 35 GLU HA H 124 4.634 4.709 -0.075 1
1 441 . 7 1 1 A 35 35 GLU C C 124 174.838 174.096 0.742 1
1 442 . 7 1 1 A 35 35 GLU CA C 124 53.780 54.755 -0.975 1
1 443 . 7 1 1 A 35 35 GLU CB C 124 33.710 32.127 1.583 1
1 445 . 7 1 1 A 35 35 GLU N N 124 116.577 116.124 0.453 1
1 446 . 7 1 1 A 36 36 GLN H H 125 8.532 8.562 -0.030 1
1 447 . 7 1 1 A 36 36 GLN HA H 125 4.958 4.397 0.561 1
1 454 . 7 1 1 A 36 36 GLN CA C 125 53.350 53.706 -0.356 1
1 455 . 7 1 1 A 36 36 GLN CB C 125 29.950 29.861 0.089 1
1 457 . 7 1 1 A 36 36 GLN N N 125 123.034 121.463 1.571 1
1 459 . 7 1 1 A 37 37 PRO HA H 126 4.458 4.554 -0.096 1
1 466 . 7 1 1 A 37 37 PRO C C 126 176.314 177.345 -1.031 1
1 467 . 7 1 1 A 37 37 PRO CA C 126 62.816 65.578 -2.762 1
1 468 . 7 1 1 A 37 37 PRO CB C 126 33.070 31.569 1.501 1
1 471 . 7 1 1 A 38 38 GLU H H 127 8.626 7.674 0.952 1
1 472 . 7 1 1 A 38 38 GLU HA H 127 4.274 4.441 -0.167 1
1 477 . 7 1 1 A 38 38 GLU C C 127 177.809 175.092 2.717 1
1 478 . 7 1 1 A 38 38 GLU CA C 127 58.730 58.355 0.375 1
1 479 . 7 1 1 A 38 38 GLU CB C 127 30.340 29.459 0.881 1
1 481 . 7 1 1 A 38 38 GLU N N 127 120.691 119.319 1.372 1
1 482 . 7 1 1 A 39 39 LYS H H 128 7.891 7.934 -0.043 1
1 483 . 7 1 1 A 39 39 LYS HA H 128 4.870 4.732 0.138 1
1 492 . 7 1 1 A 39 39 LYS C C 128 175.452 175.929 -0.477 1
1 493 . 7 1 1 A 39 39 LYS CA C 128 53.540 54.661 -1.121 1
1 494 . 7 1 1 A 39 39 LYS CB C 128 33.630 34.874 -1.244 1
1 498 . 7 1 1 A 39 39 LYS N N 128 118.149 118.026 0.123 1
1 499 . 7 1 1 A 40 40 GLY H H 129 8.524 8.010 0.514 1
1 500 . 7 1 1 A 40 40 GLY HA2 H 129 4.973 4.094 0.879 1
1 501 . 7 1 1 A 40 40 GLY HA3 H 129 2.459 4.221 -1.762 1
1 502 . 7 1 1 A 40 40 GLY C C 129 169.943 171.931 -1.988 1
1 503 . 7 1 1 A 40 40 GLY CA C 129 42.910 45.103 -2.193 1
1 504 . 7 1 1 A 40 40 GLY N N 129 112.845 110.381 2.464 1
1 505 . 7 1 1 A 41 41 ILE H H 130 8.659 8.034 0.625 1
1 506 . 7 1 1 A 41 41 ILE HA H 130 4.591 4.722 -0.131 1
1 516 . 7 1 1 A 41 41 ILE C C 130 172.586 174.024 -1.438 1
1 517 . 7 1 1 A 41 41 ILE CA C 130 58.090 59.158 -1.068 1
1 518 . 7 1 1 A 41 41 ILE CB C 130 43.320 41.919 1.401 1
1 522 . 7 1 1 A 41 41 ILE N N 130 114.060 119.457 -5.397 1
1 523 . 7 1 1 A 42 42 PHE H H 131 9.206 8.759 0.447 1
1 524 . 7 1 1 A 42 42 PHE HA H 131 5.159 4.785 0.374 1
1 532 . 7 1 1 A 42 42 PHE C C 131 174.931 175.856 -0.925 1
1 533 . 7 1 1 A 42 42 PHE CA C 131 57.790 58.207 -0.417 1
1 534 . 7 1 1 A 42 42 PHE CB C 131 42.220 39.176 3.044 1
1 538 . 7 1 1 A 42 42 PHE N N 131 126.002 128.423 -2.421 1
1 539 . 7 1 1 A 43 43 VAL H H 132 8.502 8.984 -0.482 1
1 540 . 7 1 1 A 43 43 VAL HA H 132 4.921 4.680 0.241 1
1 548 . 7 1 1 A 43 43 VAL C C 132 178.219 175.450 2.769 1
1 549 . 7 1 1 A 43 43 VAL CA C 132 59.600 60.047 -0.447 1
1 550 . 7 1 1 A 43 43 VAL CB C 132 35.920 35.588 0.332 1
1 553 . 7 1 1 A 43 43 VAL N N 132 119.068 122.775 -3.707 1
1 554 . 7 1 1 A 44 44 LYS H H 133 10.036 8.681 1.355 1
1 555 . 7 1 1 A 44 44 LYS HA H 133 5.070 4.298 0.772 1
1 564 . 7 1 1 A 44 44 LYS C C 133 177.276 177.790 -0.514 1
1 565 . 7 1 1 A 44 44 LYS CA C 133 56.720 57.380 -0.660 1
1 566 . 7 1 1 A 44 44 LYS CB C 133 34.410 32.763 1.647 1
1 570 . 7 1 1 A 44 44 LYS N N 133 130.934 125.253 5.681 1
1 571 . 7 1 1 A 45 45 ASN H H 134 8.093 8.722 -0.629 1
1 572 . 7 1 1 A 45 45 ASN HA H 134 4.152 4.780 -0.628 1
1 577 . 7 1 1 A 45 45 ASN C C 134 174.087 174.943 -0.856 1
1 578 . 7 1 1 A 45 45 ASN CA C 134 55.360 55.965 -0.605 1
1 579 . 7 1 1 A 45 45 ASN CB C 134 37.530 39.051 -1.521 1
1 580 . 7 1 1 A 45 45 ASN N N 134 117.963 123.097 -5.134 1
1 582 . 7 1 1 A 46 46 SER H H 135 7.524 7.703 -0.179 1
1 583 . 7 1 1 A 46 46 SER HA H 135 4.219 4.746 -0.527 1
1 586 . 7 1 1 A 46 46 SER C C 135 174.490 173.887 0.603 1
1 587 . 7 1 1 A 46 46 SER CA C 135 57.090 57.505 -0.415 1
1 588 . 7 1 1 A 46 46 SER CB C 135 63.860 66.270 -2.410 1
1 589 . 7 1 1 A 46 46 SER N N 135 105.939 110.531 -4.592 1
1 590 . 7 1 1 A 47 47 ASP H H 136 9.113 8.929 0.184 1
1 591 . 7 1 1 A 47 47 ASP HA H 136 4.220 4.231 -0.011 1
1 594 . 7 1 1 A 47 47 ASP CA C 136 57.610 57.134 0.476 1
1 595 . 7 1 1 A 47 47 ASP CB C 136 40.810 40.580 0.230 1
1 596 . 7 1 1 A 47 47 ASP N N 136 120.995 125.221 -4.226 1
1 597 . 7 1 1 A 48 48 GLY H H 137 8.181 8.087 0.094 1
1 598 . 7 1 1 A 48 48 GLY HA2 H 137 4.120 3.925 0.195 1
1 599 . 7 1 1 A 48 48 GLY HA3 H 137 3.659 3.926 -0.267 1
1 600 . 7 1 1 A 48 48 GLY C C 137 174.062 174.540 -0.478 1
1 601 . 7 1 1 A 48 48 GLY CA C 137 45.130 46.651 -1.521 1
1 602 . 7 1 1 A 48 48 GLY N N 137 106.197 107.113 -0.916 1
1 603 . 7 1 1 A 49 49 SER H H 138 7.179 7.827 -0.648 1
1 604 . 7 1 1 A 49 49 SER HA H 138 4.383 4.382 0.001 1
1 607 . 7 1 1 A 49 49 SER C C 138 173.864 174.136 -0.272 1
1 608 . 7 1 1 A 49 49 SER CA C 138 57.614 59.294 -1.680 1
1 609 . 7 1 1 A 49 49 SER CB C 138 65.100 63.743 1.357 1
1 610 . 7 1 1 A 49 49 SER N N 138 115.015 116.539 -1.524 1
1 611 . 7 1 1 A 50 50 ASP H H 139 8.078 9.062 -0.984 1
1 612 . 7 1 1 A 50 50 ASP HA H 139 4.642 4.679 -0.037 1
1 615 . 7 1 1 A 50 50 ASP C C 139 174.261 175.946 -1.685 1
1 616 . 7 1 1 A 50 50 ASP CA C 139 52.406 55.678 -3.272 1
1 617 . 7 1 1 A 50 50 ASP CB C 139 40.254 40.885 -0.631 1
1 618 . 7 1 1 A 50 50 ASP N N 139 122.400 124.553 -2.153 1
1 619 . 7 1 1 A 51 51 VAL H H 140 8.111 7.429 0.682 1
1 620 . 7 1 1 A 51 51 VAL HA H 140 4.360 4.062 0.298 1
1 628 . 7 1 1 A 51 51 VAL C C 140 176.147 174.390 1.757 1
1 629 . 7 1 1 A 51 51 VAL CA C 140 62.670 62.300 0.370 1
1 630 . 7 1 1 A 51 51 VAL CB C 140 33.930 31.667 2.263 1
1 632 . 7 1 1 A 51 51 VAL N N 140 120.374 120.918 -0.544 1
1 633 . 7 1 1 A 52 52 CYS H H 141 8.358 8.893 -0.535 1
1 634 . 7 1 1 A 52 52 CYS HA H 141 4.957 5.392 -0.435 1
1 637 . 7 1 1 A 52 52 CYS C C 141 173.070 173.235 -0.165 1
1 638 . 7 1 1 A 52 52 CYS CA C 141 53.380 54.708 -1.328 1
1 639 . 7 1 1 A 52 52 CYS CB C 141 46.110 44.790 1.320 1
1 640 . 7 1 1 A 52 52 CYS N N 141 121.305 129.015 -7.710 1
1 641 . 7 1 1 A 53 53 THR H H 142 8.929 8.723 0.206 1
1 642 . 7 1 1 A 53 53 THR HA H 142 4.498 4.962 -0.464 1
1 648 . 7 1 1 A 53 53 THR C C 142 172.151 172.549 -0.398 1
1 649 . 7 1 1 A 53 53 THR CA C 142 62.960 61.438 1.522 1
1 650 . 7 1 1 A 53 53 THR CB C 142 70.540 72.481 -1.941 1
1 652 . 7 1 1 A 53 53 THR N N 142 120.105 119.536 0.569 1
1 653 . 7 1 1 A 54 54 LEU H H 143 8.448 8.724 -0.276 1
1 654 . 7 1 1 A 54 54 LEU HA H 143 4.322 4.857 -0.535 1
1 664 . 7 1 1 A 54 54 LEU C C 143 174.484 174.620 -0.136 1
1 665 . 7 1 1 A 54 54 LEU CA C 143 54.596 53.619 0.977 1
1 666 . 7 1 1 A 54 54 LEU CB C 143 42.396 43.762 -1.366 1
1 670 . 7 1 1 A 54 54 LEU N N 143 128.819 129.131 -0.312 1
1 671 . 7 1 1 A 55 55 PHE H H 144 8.661 8.767 -0.106 1
1 672 . 7 1 1 A 55 55 PHE HA H 144 5.459 4.969 0.490 1
1 680 . 7 1 1 A 55 55 PHE C C 144 176.035 174.770 1.265 1
1 681 . 7 1 1 A 55 55 PHE CA C 144 55.020 56.789 -1.769 1
1 682 . 7 1 1 A 55 55 PHE CB C 144 44.100 42.563 1.537 1
1 686 . 7 1 1 A 55 55 PHE N N 144 121.897 126.242 -4.345 1
1 687 . 7 1 1 A 56 56 ASP H H 145 11.616 8.554 3.062 1
1 688 . 7 1 1 A 56 56 ASP HA H 145 4.417 4.736 -0.319 1
1 691 . 7 1 1 A 56 56 ASP C C 145 176.748 177.157 -0.409 1
1 692 . 7 1 1 A 56 56 ASP CA C 145 55.844 54.045 1.799 1
1 693 . 7 1 1 A 56 56 ASP CB C 145 44.390 42.990 1.400 1
1 694 . 7 1 1 A 56 56 ASP N N 145 122.131 121.235 0.896 1
1 695 . 7 1 1 A 57 57 ALA H H 146 8.508 8.948 -0.440 1
1 696 . 7 1 1 A 57 57 ALA HA H 146 3.797 4.075 -0.278 1
1 700 . 7 1 1 A 57 57 ALA C C 146 178.696 180.077 -1.381 1
1 701 . 7 1 1 A 57 57 ALA CA C 146 55.990 55.381 0.609 1
1 702 . 7 1 1 A 57 57 ALA CB C 146 18.840 18.078 0.762 1
1 703 . 7 1 1 A 57 57 ALA N N 146 130.243 128.621 1.622 1
1 704 . 7 1 1 A 58 58 ALA H H 147 8.378 8.027 0.351 1
1 705 . 7 1 1 A 58 58 ALA HA H 147 4.078 4.201 -0.123 1
1 709 . 7 1 1 A 58 58 ALA C C 147 181.091 179.684 1.407 1
1 710 . 7 1 1 A 58 58 ALA CA C 147 54.770 54.863 -0.093 1
1 711 . 7 1 1 A 58 58 ALA CB C 147 17.700 18.441 -0.741 1
1 712 . 7 1 1 A 58 58 ALA N N 147 121.997 119.759 2.238 1
1 713 . 7 1 1 A 59 59 ALA H H 148 9.138 7.983 1.155 1
1 714 . 7 1 1 A 59 59 ALA HA H 148 3.975 4.082 -0.107 1
1 718 . 7 1 1 A 59 59 ALA C C 148 180.508 179.396 1.112 1
1 719 . 7 1 1 A 59 59 ALA CA C 148 54.840 55.061 -0.221 1
1 720 . 7 1 1 A 59 59 ALA CB C 148 18.600 18.673 -0.073 1
1 721 . 7 1 1 A 59 59 ALA N N 148 123.595 120.427 3.168 1
1 722 . 7 1 1 A 60 60 PHE H H 149 8.814 8.102 0.712 1
1 723 . 7 1 1 A 60 60 PHE HA H 149 3.722 3.983 -0.261 1
1 731 . 7 1 1 A 60 60 PHE C C 149 176.773 177.615 -0.842 1
1 732 . 7 1 1 A 60 60 PHE CA C 149 62.030 61.672 0.358 1
1 733 . 7 1 1 A 60 60 PHE CB C 149 39.960 38.800 1.160 1
1 737 . 7 1 1 A 60 60 PHE N N 149 120.354 119.606 0.748 1
1 738 . 7 1 1 A 61 61 SER H H 150 8.276 8.067 0.209 1
1 739 . 7 1 1 A 61 61 SER HA H 150 3.880 4.027 -0.147 1
1 742 . 7 1 1 A 61 61 SER C C 150 177.691 176.528 1.163 1
1 743 . 7 1 1 A 61 61 SER CA C 150 62.190 61.488 0.702 1
1 744 . 7 1 1 A 61 61 SER CB C 150 63.016 62.948 0.068 1
1 745 . 7 1 1 A 61 61 SER N N 150 112.086 114.020 -1.934 1
1 746 . 7 1 1 A 62 62 ARG H H 151 7.829 7.852 -0.023 1
1 747 . 7 1 1 A 62 62 ARG HA H 151 3.971 4.068 -0.097 1
1 754 . 7 1 1 A 62 62 ARG C C 151 178.287 178.407 -0.120 1
1 755 . 7 1 1 A 62 62 ARG CA C 151 59.340 58.879 0.461 1
1 756 . 7 1 1 A 62 62 ARG CB C 151 29.760 29.457 0.303 1
1 759 . 7 1 1 A 62 62 ARG N N 151 121.090 119.428 1.662 1
1 760 . 7 1 1 A 63 63 LEU H H 152 7.390 7.531 -0.141 1
1 761 . 7 1 1 A 63 63 LEU HA H 152 3.791 3.903 -0.112 1
1 771 . 7 1 1 A 63 63 LEU C C 152 179.106 178.121 0.985 1
1 772 . 7 1 1 A 63 63 LEU CA C 152 58.900 58.257 0.643 1
1 773 . 7 1 1 A 63 63 LEU CB C 152 41.140 41.268 -0.128 1
1 777 . 7 1 1 A 63 63 LEU N N 152 121.129 122.334 -1.205 1
1 778 . 7 1 1 A 64 64 VAL H H 153 7.552 7.943 -0.391 1
1 779 . 7 1 1 A 64 64 VAL HA H 153 3.411 3.482 -0.071 1
1 787 . 7 1 1 A 64 64 VAL C C 153 180.595 178.183 2.412 1
1 788 . 7 1 1 A 64 64 VAL CA C 153 65.644 66.054 -0.410 1
1 789 . 7 1 1 A 64 64 VAL CB C 153 31.410 31.289 0.121 1
1 792 . 7 1 1 A 64 64 VAL N N 153 118.280 118.936 -0.656 1
1 793 . 7 1 1 A 65 65 GLY H H 154 8.061 8.163 -0.102 1
1 794 . 7 1 1 A 65 65 GLY HA2 H 154 3.846 3.708 0.138 1
1 795 . 7 1 1 A 65 65 GLY HA3 H 154 3.809 3.708 0.101 1
1 796 . 7 1 1 A 65 65 GLY C C 154 175.235 176.013 -0.778 1
1 797 . 7 1 1 A 65 65 GLY CA C 154 46.630 47.128 -0.498 1
1 798 . 7 1 1 A 65 65 GLY N N 154 108.622 107.507 1.115 1
1 799 . 7 1 1 A 66 66 GLU H H 155 7.528 7.526 0.002 1
1 800 . 7 1 1 A 66 66 GLU HA H 155 4.228 4.118 0.110 1
1 805 . 7 1 1 A 66 66 GLU C C 155 176.761 177.100 -0.339 1
1 806 . 7 1 1 A 66 66 GLU CA C 155 56.590 57.346 -0.756 1
1 807 . 7 1 1 A 66 66 GLU CB C 155 30.490 29.856 0.634 1
1 809 . 7 1 1 A 66 66 GLU N N 155 118.361 119.957 -1.596 1
1 810 . 7 1 1 A 67 67 GLY H H 156 7.884 7.852 0.032 1
1 811 . 7 1 1 A 67 67 GLY HA2 H 156 3.918 3.908 0.010 1
1 812 . 7 1 1 A 67 67 GLY HA3 H 156 3.747 3.921 -0.174 1
1 813 . 7 1 1 A 67 67 GLY C C 156 174.788 174.482 0.306 1
1 814 . 7 1 1 A 67 67 GLY CA C 156 45.890 45.750 0.140 1
1 815 . 7 1 1 A 67 67 GLY N N 156 108.465 107.827 0.638 1
1 816 . 7 1 1 A 68 68 LEU H H 157 7.332 7.596 -0.264 1
1 817 . 7 1 1 A 68 68 LEU HA H 157 4.361 4.644 -0.283 1
1 827 . 7 1 1 A 68 68 LEU CA C 157 53.060 52.220 0.840 1
1 828 . 7 1 1 A 68 68 LEU CB C 157 41.100 41.558 -0.458 1
1 832 . 7 1 1 A 68 68 LEU N N 157 121.920 121.843 0.077 1
1 833 . 7 1 1 A 69 69 PRO HA H 158 4.485 4.623 -0.138 1
1 840 . 7 1 1 A 69 69 PRO C C 158 174.602 176.374 -1.772 1
1 841 . 7 1 1 A 69 69 PRO CA C 158 61.556 62.206 -0.650 1
1 842 . 7 1 1 A 69 69 PRO CB C 158 32.370 32.924 -0.554 1
1 845 . 7 1 1 A 70 70 HIS H H 159 8.734 8.650 0.084 1
1 846 . 7 1 1 A 70 70 HIS HA H 159 3.947 4.684 -0.737 1
1 852 . 7 1 1 A 70 70 HIS CA C 159 56.250 55.219 1.031 1
1 853 . 7 1 1 A 70 70 HIS CB C 159 32.280 31.133 1.147 1
1 856 . 7 1 1 A 70 70 HIS N N 159 119.423 121.642 -2.219 1
1 857 . 7 1 1 A 71 71 PRO HA H 160 4.424 4.181 0.243 1
1 864 . 7 1 1 A 71 71 PRO C C 160 177.567 178.477 -0.910 1
1 865 . 7 1 1 A 71 71 PRO CA C 160 64.574 65.533 -0.959 1
1 866 . 7 1 1 A 71 71 PRO CB C 160 32.340 31.840 0.500 1
1 869 . 7 1 1 A 72 72 LEU H H 161 10.123 7.425 2.698 1
1 870 . 7 1 1 A 72 72 LEU HA H 161 4.778 4.296 0.482 1
1 880 . 7 1 1 A 72 72 LEU C C 161 178.721 177.871 0.850 1
1 881 . 7 1 1 A 72 72 LEU CA C 161 55.800 57.494 -1.694 1
1 882 . 7 1 1 A 72 72 LEU CB C 161 42.440 43.113 -0.673 1
1 886 . 7 1 1 A 72 72 LEU N N 161 117.374 117.327 0.047 1
1 887 . 7 1 1 A 73 73 THR H H 162 7.523 7.757 -0.234 1
1 888 . 7 1 1 A 73 73 THR HA H 162 4.291 4.586 -0.295 1
1 893 . 7 1 1 A 73 73 THR C C 162 175.557 174.444 1.113 1
1 894 . 7 1 1 A 73 73 THR CA C 162 61.440 62.379 -0.939 1
1 895 . 7 1 1 A 73 73 THR CB C 162 70.500 70.107 0.393 1
1 897 . 7 1 1 A 73 73 THR N N 162 107.787 112.056 -4.269 1
1 898 . 7 1 1 A 74 74 ARG H H 163 8.361 7.914 0.447 1
1 899 . 7 1 1 A 74 74 ARG HA H 163 3.836 4.228 -0.392 1
1 906 . 7 1 1 A 74 74 ARG C C 163 174.701 175.050 -0.349 1
1 907 . 7 1 1 A 74 74 ARG CA C 163 57.980 57.408 0.572 1
1 908 . 7 1 1 A 74 74 ARG CB C 163 26.770 26.896 -0.126 1
1 911 . 7 1 1 A 74 74 ARG N N 163 115.130 118.795 -3.665 1
1 912 . 7 1 1 A 75 75 GLU H H 164 7.430 8.053 -0.623 1
1 913 . 7 1 1 A 75 75 GLU HA H 164 4.636 4.580 0.056 1
1 918 . 7 1 1 A 75 75 GLU CA C 164 53.699 54.911 -1.212 1
1 919 . 7 1 1 A 75 75 GLU CB C 164 29.550 28.178 1.372 1
1 921 . 7 1 1 A 75 75 GLU N N 164 120.076 118.886 1.190 1
1 922 . 7 1 1 A 76 76 PRO HA H 165 4.272 4.419 -0.147 1
1 929 . 7 1 1 A 76 76 PRO C C 165 176.649 176.932 -0.283 1
1 930 . 7 1 1 A 76 76 PRO CA C 165 63.204 63.331 -0.127 1
1 931 . 7 1 1 A 76 76 PRO CB C 165 31.680 31.668 0.012 1
1 934 . 7 1 1 A 77 77 ILE H H 166 8.812 8.252 0.560 1
1 935 . 7 1 1 A 77 77 ILE HA H 166 3.838 4.330 -0.492 1
1 945 . 7 1 1 A 77 77 ILE C C 166 175.235 175.419 -0.184 1
1 946 . 7 1 1 A 77 77 ILE CA C 166 62.816 60.805 2.011 1
1 947 . 7 1 1 A 77 77 ILE CB C 166 37.750 36.906 0.844 1
1 951 . 7 1 1 A 77 77 ILE N N 166 123.831 124.372 -0.541 1
1 952 . 7 1 1 A 78 78 THR H H 167 6.625 8.599 -1.974 1
1 953 . 7 1 1 A 78 78 THR HA H 167 4.632 5.033 -0.401 1
1 958 . 7 1 1 A 78 78 THR C C 167 174.143 174.622 -0.479 1
1 959 . 7 1 1 A 78 78 THR CA C 167 58.750 59.860 -1.110 1
1 960 . 7 1 1 A 78 78 THR CB C 167 71.320 71.400 -0.080 1
1 962 . 7 1 1 A 78 78 THR N N 167 115.293 119.129 -3.836 1
1 963 . 7 1 1 A 79 79 ALA H H 168 9.088 9.006 0.082 1
1 964 . 7 1 1 A 79 79 ALA HA H 168 3.916 4.113 -0.197 1
1 968 . 7 1 1 A 79 79 ALA C C 168 179.770 179.529 0.241 1
1 969 . 7 1 1 A 79 79 ALA CA C 168 55.480 55.039 0.441 1
1 970 . 7 1 1 A 79 79 ALA CB C 168 17.630 18.340 -0.710 1
1 971 . 7 1 1 A 79 79 ALA N N 168 122.102 127.400 -5.298 1
1 972 . 7 1 1 A 80 80 SER H H 169 7.988 7.583 0.405 1
1 973 . 7 1 1 A 80 80 SER HA H 169 4.091 4.231 -0.140 1
1 976 . 7 1 1 A 80 80 SER C C 169 175.836 176.479 -0.643 1
1 977 . 7 1 1 A 80 80 SER CA C 169 60.750 61.421 -0.671 1
1 978 . 7 1 1 A 80 80 SER CB C 169 62.510 63.007 -0.497 1
1 979 . 7 1 1 A 80 80 SER N N 169 109.660 113.406 -3.746 1
1 980 . 7 1 1 A 81 81 ILE H H 170 7.052 7.597 -0.545 1
1 981 . 7 1 1 A 81 81 ILE HA H 170 4.344 4.047 0.297 1
1 991 . 7 1 1 A 81 81 ILE C C 170 174.236 176.516 -2.280 1
1 992 . 7 1 1 A 81 81 ILE CA C 170 61.760 64.066 -2.306 1
1 993 . 7 1 1 A 81 81 ILE CB C 170 37.950 37.434 0.516 1
1 997 . 7 1 1 A 81 81 ILE N N 170 112.623 114.300 -1.677 1
1 998 . 7 1 1 A 82 82 ILE H H 171 7.345 7.610 -0.265 1
1 999 . 7 1 1 A 82 82 ILE HA H 171 4.288 4.004 0.284 1
1 1009 . 7 1 1 A 82 82 ILE C C 171 174.931 175.344 -0.413 1
1 1010 . 7 1 1 A 82 82 ILE CA C 171 61.420 61.620 -0.200 1
1 1011 . 7 1 1 A 82 82 ILE CB C 171 37.230 37.657 -0.427 1
1 1015 . 7 1 1 A 82 82 ILE N N 171 124.260 124.670 -0.410 1
1 1016 . 7 1 1 A 83 83 VAL H H 172 7.843 8.745 -0.902 1
1 1017 . 7 1 1 A 83 83 VAL HA H 172 4.818 5.070 -0.252 1
1 1025 . 7 1 1 A 83 83 VAL C C 172 174.918 175.569 -0.651 1
1 1026 . 7 1 1 A 83 83 VAL CA C 172 58.910 59.131 -0.221 1
1 1027 . 7 1 1 A 83 83 VAL CB C 172 34.570 35.241 -0.671 1
1 1030 . 7 1 1 A 83 83 VAL N N 172 118.856 121.862 -3.006 1
1 1031 . 7 1 1 A 84 84 LYS H H 173 8.347 8.709 -0.362 1
1 1032 . 7 1 1 A 84 84 LYS HA H 173 4.356 4.461 -0.105 1
1 1041 . 7 1 1 A 84 84 LYS C C 173 178.653 178.305 0.348 1
1 1042 . 7 1 1 A 84 84 LYS CA C 173 56.360 56.069 0.291 1
1 1043 . 7 1 1 A 84 84 LYS CB C 173 33.366 33.374 -0.008 1
1 1047 . 7 1 1 A 84 84 LYS N N 173 119.602 122.259 -2.657 1
1 1048 . 7 1 1 A 85 85 HIS H H 174 9.143 9.077 0.066 1
1 1049 . 7 1 1 A 85 85 HIS HA H 174 4.013 4.296 -0.283 1
1 1053 . 7 1 1 A 85 85 HIS C C 174 176.606 177.016 -0.410 1
1 1054 . 7 1 1 A 85 85 HIS CA C 174 58.820 60.471 -1.651 1
1 1055 . 7 1 1 A 85 85 HIS CB C 174 28.186 29.807 -1.621 1
1 1057 . 7 1 1 A 85 85 HIS N N 174 120.022 122.594 -2.572 1
1 1058 . 7 1 1 A 86 86 GLU H H 175 8.403 8.234 0.169 1
1 1059 . 7 1 1 A 86 86 GLU HA H 175 3.863 3.982 -0.119 1
1 1064 . 7 1 1 A 86 86 GLU C C 175 177.040 178.478 -1.438 1
1 1065 . 7 1 1 A 86 86 GLU CA C 175 57.830 59.665 -1.835 1
1 1066 . 7 1 1 A 86 86 GLU CB C 175 28.690 29.294 -0.604 1
1 1068 . 7 1 1 A 86 86 GLU N N 175 116.124 118.387 -2.263 1
1 1069 . 7 1 1 A 87 87 GLU H H 176 7.669 7.814 -0.145 1
1 1070 . 7 1 1 A 87 87 GLU HA H 176 4.039 4.520 -0.481 1
1 1075 . 7 1 1 A 87 87 GLU C C 176 175.688 175.488 0.200 1
1 1076 . 7 1 1 A 87 87 GLU CA C 176 57.906 57.369 0.537 1
1 1077 . 7 1 1 A 87 87 GLU CB C 176 30.430 29.136 1.294 1
1 1079 . 7 1 1 A 87 87 GLU N N 176 116.183 117.541 -1.358 1
1 1080 . 7 1 1 A 88 88 CYS H H 177 6.750 7.295 -0.545 1
1 1081 . 7 1 1 A 88 88 CYS HA H 177 4.991 5.162 -0.171 1
1 1084 . 7 1 1 A 88 88 CYS C C 177 172.325 172.160 0.165 1
1 1085 . 7 1 1 A 88 88 CYS CA C 177 55.030 55.923 -0.893 1
1 1086 . 7 1 1 A 88 88 CYS CB C 177 45.610 44.228 1.382 1
1 1087 . 7 1 1 A 88 88 CYS N N 177 114.838 116.523 -1.685 1
1 1088 . 7 1 1 A 89 89 ILE H H 178 9.128 8.734 0.394 1
1 1089 . 7 1 1 A 89 89 ILE HA H 178 4.536 5.001 -0.465 1
1 1099 . 7 1 1 A 89 89 ILE C C 178 174.893 174.313 0.580 1
1 1100 . 7 1 1 A 89 89 ILE CA C 178 59.160 59.303 -0.143 1
1 1101 . 7 1 1 A 89 89 ILE CB C 178 41.840 40.928 0.912 1
1 1105 . 7 1 1 A 89 89 ILE N N 178 120.564 121.926 -1.362 1
1 1106 . 7 1 1 A 90 90 TYR H H 179 9.349 8.924 0.425 1
1 1107 . 7 1 1 A 90 90 TYR HA H 179 3.568 4.088 -0.520 1
1 1112 . 7 1 1 A 90 90 TYR C C 179 173.950 174.008 -0.058 1
1 1113 . 7 1 1 A 90 90 TYR CA C 179 61.180 57.137 4.043 1
1 1114 . 7 1 1 A 90 90 TYR CB C 179 37.530 38.033 -0.503 1
1 1116 . 7 1 1 A 90 90 TYR N N 179 129.033 126.629 2.404 1
1 1117 . 7 1 1 A 91 91 ASP H H 180 7.367 8.353 -0.986 1
1 1118 . 7 1 1 A 91 91 ASP HA H 180 4.662 4.615 0.047 1
1 1121 . 7 1 1 A 91 91 ASP C C 180 175.291 176.207 -0.916 1
1 1122 . 7 1 1 A 91 91 ASP CA C 180 52.230 53.456 -1.226 1
1 1123 . 7 1 1 A 91 91 ASP CB C 180 43.650 41.923 1.727 1
1 1124 . 7 1 1 A 91 91 ASP N N 180 129.305 128.908 0.397 1
1 1125 . 7 1 1 A 92 92 ASP H H 181 8.783 8.764 0.019 1
1 1126 . 7 1 1 A 92 92 ASP HA H 181 4.114 4.125 -0.011 1
1 1129 . 7 1 1 A 92 92 ASP C C 181 177.573 178.197 -0.624 1
1 1130 . 7 1 1 A 92 92 ASP CA C 181 56.390 57.087 -0.697 1
1 1131 . 7 1 1 A 92 92 ASP CB C 181 41.330 40.432 0.898 1
1 1132 . 7 1 1 A 92 92 ASP N N 181 125.665 125.689 -0.024 1
1 1133 . 7 1 1 A 93 93 THR H H 182 8.284 7.656 0.628 1
1 1134 . 7 1 1 A 93 93 THR HA H 182 4.037 3.998 0.039 1
1 1139 . 7 1 1 A 93 93 THR C C 182 176.333 175.987 0.346 1
1 1140 . 7 1 1 A 93 93 THR CA C 182 65.320 66.449 -1.129 1
1 1141 . 7 1 1 A 93 93 THR CB C 182 68.560 68.277 0.283 1
1 1143 . 7 1 1 A 93 93 THR N N 182 114.688 116.808 -2.120 1
1 1144 . 7 1 1 A 94 94 ARG H H 183 7.784 7.443 0.341 1
1 1145 . 7 1 1 A 94 94 ARG HA H 183 4.142 4.250 -0.108 1
1 1152 . 7 1 1 A 94 94 ARG C C 183 177.015 177.032 -0.017 1
1 1153 . 7 1 1 A 94 94 ARG CA C 183 55.350 56.172 -0.822 1
1 1154 . 7 1 1 A 94 94 ARG CB C 183 30.930 31.096 -0.166 1
1 1157 . 7 1 1 A 94 94 ARG N N 183 120.156 118.495 1.661 1
1 1158 . 7 1 1 A 95 95 GLY H H 184 8.144 8.833 -0.689 1
1 1159 . 7 1 1 A 95 95 GLY HA2 H 184 3.839 3.626 0.213 1
1 1160 . 7 1 1 A 95 95 GLY HA3 H 184 3.681 3.833 -0.152 1
1 1161 . 7 1 1 A 95 95 GLY C C 184 173.653 173.089 0.564 1
1 1162 . 7 1 1 A 95 95 GLY CA C 184 46.160 46.045 0.115 1
1 1163 . 7 1 1 A 95 95 GLY N N 184 107.879 108.634 -0.755 1
1 1164 . 7 1 1 A 96 96 ASN H H 185 6.855 6.978 -0.123 1
1 1165 . 7 1 1 A 96 96 ASN HA H 185 4.909 5.046 -0.137 1
1 1170 . 7 1 1 A 96 96 ASN C C 185 174.223 173.231 0.992 1
1 1171 . 7 1 1 A 96 96 ASN CA C 185 52.720 52.284 0.436 1
1 1172 . 7 1 1 A 96 96 ASN CB C 185 45.620 41.806 3.814 1
1 1173 . 7 1 1 A 96 96 ASN N N 185 113.382 115.903 -2.521 1
1 1175 . 7 1 1 A 97 97 PHE H H 186 9.228 8.682 0.546 1
1 1176 . 7 1 1 A 97 97 PHE HA H 186 4.579 4.831 -0.252 1
1 1183 . 7 1 1 A 97 97 PHE C C 186 174.794 175.752 -0.958 1
1 1184 . 7 1 1 A 97 97 PHE CA C 186 59.384 58.979 0.405 1
1 1185 . 7 1 1 A 97 97 PHE CB C 186 40.450 39.692 0.758 1
1 1188 . 7 1 1 A 97 97 PHE N N 186 118.661 119.495 -0.834 1
1 1189 . 7 1 1 A 98 98 ILE H H 187 8.908 8.690 0.218 1
1 1190 . 7 1 1 A 98 98 ILE HA H 187 5.440 4.810 0.630 1
1 1200 . 7 1 1 A 98 98 ILE C C 187 176.171 175.422 0.749 1
1 1201 . 7 1 1 A 98 98 ILE CA C 187 57.610 59.503 -1.893 1
1 1202 . 7 1 1 A 98 98 ILE CB C 187 41.280 41.344 -0.064 1
1 1206 . 7 1 1 A 98 98 ILE N N 187 120.585 123.367 -2.782 1
1 1207 . 7 1 1 A 99 99 ILE H H 188 8.602 8.115 0.487 1
1 1208 . 7 1 1 A 99 99 ILE HA H 188 4.546 4.586 -0.040 1
1 1218 . 7 1 1 A 99 99 ILE C C 188 176.668 174.878 1.790 1
1 1219 . 7 1 1 A 99 99 ILE CA C 188 58.920 62.181 -3.261 1
1 1220 . 7 1 1 A 99 99 ILE CB C 188 37.960 37.624 0.336 1
1 1224 . 7 1 1 A 99 99 ILE N N 188 124.500 125.356 -0.856 1
1 1225 . 7 1 1 A 100 100 LYS H H 189 8.449 8.540 -0.091 1
1 1226 . 7 1 1 A 100 100 LYS HA H 189 4.108 4.671 -0.563 1
1 1235 . 7 1 1 A 100 100 LYS C C 189 176.866 176.148 0.718 1
1 1236 . 7 1 1 A 100 100 LYS CA C 189 56.800 54.939 1.861 1
1 1237 . 7 1 1 A 100 100 LYS CB C 189 33.400 33.225 0.175 1
1 1241 . 7 1 1 A 100 100 LYS N N 189 128.581 128.974 -0.393 1
1 1242 . 7 1 1 A 101 101 GLY H H 190 8.381 8.632 -0.251 1
1 1243 . 7 1 1 A 101 101 GLY HA2 H 190 3.946 3.960 -0.014 1
1 1244 . 7 1 1 A 101 101 GLY HA3 H 190 3.828 3.963 -0.135 1
1 1245 . 7 1 1 A 101 101 GLY C C 190 172.902 174.647 -1.745 1
1 1246 . 7 1 1 A 101 101 GLY CA C 190 44.920 45.582 -0.662 1
1 1247 . 7 1 1 A 101 101 GLY N N 190 111.183 113.617 -2.434 1
1 7 . 8 1 1 A 2 2 GLN H H 91 8.786 7.968 0.818 1
1 8 . 8 1 1 A 2 2 GLN HA H 91 4.005 3.915 0.090 1
1 15 . 8 1 1 A 2 2 GLN C C 91 177.270 178.356 -1.086 1
1 16 . 8 1 1 A 2 2 GLN CA C 91 58.220 59.228 -1.008 1
1 17 . 8 1 1 A 2 2 GLN CB C 91 28.650 28.128 0.522 1
1 19 . 8 1 1 A 2 2 GLN N N 91 121.993 122.269 -0.276 1
1 21 . 8 1 1 A 3 3 GLU H H 92 8.430 8.255 0.175 1
1 22 . 8 1 1 A 3 3 GLU HA H 92 4.007 4.072 -0.065 1
1 27 . 8 1 1 A 3 3 GLU C C 92 178.287 178.684 -0.397 1
1 28 . 8 1 1 A 3 3 GLU CA C 92 59.490 59.296 0.194 1
1 29 . 8 1 1 A 3 3 GLU CB C 92 29.506 29.255 0.251 1
1 31 . 8 1 1 A 3 3 GLU N N 92 120.195 119.362 0.833 1
1 32 . 8 1 1 A 4 4 SER H H 93 8.209 7.485 0.724 1
1 33 . 8 1 1 A 4 4 SER HA H 93 4.272 4.291 -0.019 1
1 36 . 8 1 1 A 4 4 SER C C 93 177.369 177.428 -0.059 1
1 37 . 8 1 1 A 4 4 SER CA C 93 61.044 61.288 -0.244 1
1 38 . 8 1 1 A 4 4 SER CB C 93 62.950 62.783 0.167 1
1 39 . 8 1 1 A 4 4 SER N N 93 115.524 114.304 1.220 1
1 40 . 8 1 1 A 5 5 ILE H H 94 8.080 7.835 0.245 1
1 41 . 8 1 1 A 5 5 ILE HA H 94 3.530 3.617 -0.087 1
1 51 . 8 1 1 A 5 5 ILE C C 94 177.778 177.677 0.101 1
1 52 . 8 1 1 A 5 5 ILE CA C 94 65.710 65.391 0.319 1
1 53 . 8 1 1 A 5 5 ILE CB C 94 37.800 37.612 0.188 1
1 57 . 8 1 1 A 5 5 ILE N N 94 124.148 122.068 2.080 1
1 58 . 8 1 1 A 6 6 GLN H H 95 8.374 8.226 0.148 1
1 59 . 8 1 1 A 6 6 GLN HA H 95 4.125 3.945 0.180 1
1 66 . 8 1 1 A 6 6 GLN C C 95 179.726 179.363 0.363 1
1 67 . 8 1 1 A 6 6 GLN CA C 95 59.190 59.107 0.083 1
1 68 . 8 1 1 A 6 6 GLN CB C 95 27.060 28.688 -1.628 1
1 70 . 8 1 1 A 6 6 GLN N N 95 118.257 118.304 -0.047 1
1 72 . 8 1 1 A 7 7 ASN H H 96 8.456 8.162 0.294 1
1 73 . 8 1 1 A 7 7 ASN HA H 96 4.446 4.541 -0.095 1
1 78 . 8 1 1 A 7 7 ASN C C 96 177.257 178.380 -1.123 1
1 79 . 8 1 1 A 7 7 ASN CA C 96 56.020 56.140 -0.120 1
1 80 . 8 1 1 A 7 7 ASN CB C 96 38.126 37.701 0.425 1
1 81 . 8 1 1 A 7 7 ASN N N 96 118.597 118.365 0.232 1
1 83 . 8 1 1 A 8 8 LYS H H 97 7.732 7.859 -0.127 1
1 84 . 8 1 1 A 8 8 LYS HA H 97 4.129 4.178 -0.049 1
1 93 . 8 1 1 A 8 8 LYS C C 97 179.143 179.107 0.036 1
1 94 . 8 1 1 A 8 8 LYS CA C 97 59.126 59.330 -0.204 1
1 95 . 8 1 1 A 8 8 LYS CB C 97 32.070 32.078 -0.008 1
1 99 . 8 1 1 A 8 8 LYS N N 97 122.381 119.105 3.276 1
1 100 . 8 1 1 A 9 9 ILE H H 98 8.452 8.050 0.402 1
1 101 . 8 1 1 A 9 9 ILE HA H 98 3.480 3.960 -0.480 1
1 111 . 8 1 1 A 9 9 ILE C C 98 177.406 177.824 -0.418 1
1 112 . 8 1 1 A 9 9 ILE CA C 98 66.430 63.613 2.817 1
1 113 . 8 1 1 A 9 9 ILE CB C 98 37.980 37.405 0.575 1
1 117 . 8 1 1 A 9 9 ILE N N 98 119.950 120.752 -0.802 1
1 118 . 8 1 1 A 10 10 SER H H 99 7.924 7.575 0.349 1
1 119 . 8 1 1 A 10 10 SER HA H 99 3.983 4.368 -0.385 1
1 122 . 8 1 1 A 10 10 SER C C 99 176.327 176.305 0.022 1
1 123 . 8 1 1 A 10 10 SER CA C 99 61.990 61.270 0.720 1
1 124 . 8 1 1 A 10 10 SER CB C 99 62.790 63.215 -0.425 1
1 125 . 8 1 1 A 10 10 SER N N 99 113.568 117.793 -4.225 1
1 126 . 8 1 1 A 11 11 GLN H H 100 7.832 8.087 -0.255 1
1 127 . 8 1 1 A 11 11 GLN HA H 100 4.238 4.318 -0.080 1
1 134 . 8 1 1 A 11 11 GLN C C 100 178.088 178.369 -0.281 1
1 135 . 8 1 1 A 11 11 GLN CA C 100 57.900 58.124 -0.224 1
1 136 . 8 1 1 A 11 11 GLN CB C 100 29.790 29.520 0.270 1
1 138 . 8 1 1 A 11 11 GLN N N 100 117.487 118.120 -0.633 1
1 140 . 8 1 1 A 12 12 CYS H H 101 7.920 7.934 -0.014 1
1 141 . 8 1 1 A 12 12 CYS HA H 101 4.657 4.485 0.172 1
1 144 . 8 1 1 A 12 12 CYS C C 101 175.439 174.570 0.869 1
1 145 . 8 1 1 A 12 12 CYS CA C 101 60.654 59.796 0.858 1
1 146 . 8 1 1 A 12 12 CYS CB C 101 29.310 28.115 1.195 1
1 147 . 8 1 1 A 12 12 CYS N N 101 114.221 118.914 -4.693 1
1 148 . 8 1 1 A 13 13 LYS H H 102 7.993 7.465 0.528 1
1 149 . 8 1 1 A 13 13 LYS HA H 102 5.038 4.571 0.467 1
1 158 . 8 1 1 A 13 13 LYS C C 102 174.757 176.230 -1.473 1
1 159 . 8 1 1 A 13 13 LYS CA C 102 56.660 56.036 0.624 1
1 160 . 8 1 1 A 13 13 LYS CB C 102 32.970 33.442 -0.472 1
1 164 . 8 1 1 A 13 13 LYS N N 102 123.841 118.456 5.385 1
1 165 . 8 1 1 A 14 14 PHE H H 103 8.822 8.632 0.190 1
1 166 . 8 1 1 A 14 14 PHE HA H 103 5.058 5.093 -0.035 1
1 174 . 8 1 1 A 14 14 PHE C C 103 173.560 173.551 0.009 1
1 175 . 8 1 1 A 14 14 PHE CA C 103 55.470 55.978 -0.508 1
1 176 . 8 1 1 A 14 14 PHE CB C 103 41.760 40.443 1.317 1
1 180 . 8 1 1 A 14 14 PHE N N 103 118.421 116.499 1.922 1
1 181 . 8 1 1 A 15 15 SER H H 104 8.826 8.587 0.239 1
1 182 . 8 1 1 A 15 15 SER HA H 104 4.602 4.623 -0.021 1
1 185 . 8 1 1 A 15 15 SER C C 104 173.851 173.686 0.165 1
1 186 . 8 1 1 A 15 15 SER CA C 104 58.610 57.785 0.825 1
1 187 . 8 1 1 A 15 15 SER CB C 104 62.690 62.222 0.468 1
1 188 . 8 1 1 A 15 15 SER N N 104 117.781 115.016 2.765 1
1 189 . 8 1 1 A 16 16 VAL H H 105 7.839 8.083 -0.244 1
1 190 . 8 1 1 A 16 16 VAL HA H 105 3.390 4.270 -0.880 1
1 198 . 8 1 1 A 16 16 VAL C C 105 174.987 175.130 -0.143 1
1 199 . 8 1 1 A 16 16 VAL CA C 105 63.650 62.273 1.377 1
1 200 . 8 1 1 A 16 16 VAL CB C 105 31.410 30.094 1.316 1
1 203 . 8 1 1 A 16 16 VAL N N 105 129.036 126.191 2.845 1
1 204 . 8 1 1 A 17 17 CYS H H 106 8.536 7.956 0.580 1
1 205 . 8 1 1 A 17 17 CYS HA H 106 5.011 4.930 0.081 1
1 208 . 8 1 1 A 17 17 CYS CA C 106 55.260 56.375 -1.115 1
1 209 . 8 1 1 A 17 17 CYS CB C 106 28.210 30.396 -2.186 1
1 210 . 8 1 1 A 17 17 CYS N N 106 130.045 127.155 2.890 1
1 211 . 8 1 1 A 18 18 PRO HA H 107 3.991 4.573 -0.582 1
1 218 . 8 1 1 A 18 18 PRO C C 107 178.188 178.744 -0.556 1
1 219 . 8 1 1 A 18 18 PRO CA C 107 65.940 64.589 1.351 1
1 220 . 8 1 1 A 18 18 PRO CB C 107 32.000 32.120 -0.120 1
1 223 . 8 1 1 A 19 19 GLU H H 108 9.260 8.468 0.792 1
1 224 . 8 1 1 A 19 19 GLU HA H 108 4.119 4.075 0.044 1
1 229 . 8 1 1 A 19 19 GLU C C 108 178.721 179.272 -0.551 1
1 230 . 8 1 1 A 19 19 GLU CA C 108 59.300 60.041 -0.741 1
1 231 . 8 1 1 A 19 19 GLU CB C 108 28.920 29.128 -0.208 1
1 233 . 8 1 1 A 19 19 GLU N N 108 118.270 118.190 0.080 1
1 234 . 8 1 1 A 20 20 ARG H H 109 7.672 7.859 -0.187 1
1 235 . 8 1 1 A 20 20 ARG HA H 109 4.331 4.130 0.201 1
1 242 . 8 1 1 A 20 20 ARG C C 109 177.977 178.215 -0.238 1
1 243 . 8 1 1 A 20 20 ARG CA C 109 57.350 59.226 -1.876 1
1 244 . 8 1 1 A 20 20 ARG CB C 109 30.820 30.420 0.400 1
1 247 . 8 1 1 A 20 20 ARG N N 109 118.357 119.439 -1.082 1
1 248 . 8 1 1 A 21 21 LEU H H 110 7.601 7.809 -0.208 1
1 249 . 8 1 1 A 21 21 LEU HA H 110 4.380 4.330 0.050 1
1 259 . 8 1 1 A 21 21 LEU C C 110 176.562 176.245 0.317 1
1 260 . 8 1 1 A 21 21 LEU CA C 110 56.096 55.338 0.758 1
1 261 . 8 1 1 A 21 21 LEU CB C 110 44.016 42.228 1.788 1
1 265 . 8 1 1 A 21 21 LEU N N 110 118.626 118.528 0.098 1
1 266 . 8 1 1 A 22 22 GLN H H 111 7.750 7.565 0.185 1
1 267 . 8 1 1 A 22 22 GLN HA H 111 3.870 4.010 -0.140 1
1 274 . 8 1 1 A 22 22 GLN C C 111 173.336 174.197 -0.861 1
1 275 . 8 1 1 A 22 22 GLN CA C 111 56.510 57.382 -0.872 1
1 276 . 8 1 1 A 22 22 GLN CB C 111 26.800 26.540 0.260 1
1 278 . 8 1 1 A 22 22 GLN N N 111 113.926 115.720 -1.794 1
1 280 . 8 1 1 A 23 23 CYS H H 112 7.407 7.836 -0.429 1
1 281 . 8 1 1 A 23 23 CYS HA H 112 4.469 4.870 -0.401 1
1 284 . 8 1 1 A 23 23 CYS CA C 112 52.650 56.536 -3.886 1
1 285 . 8 1 1 A 23 23 CYS CB C 112 29.750 28.528 1.222 1
1 286 . 8 1 1 A 23 23 CYS N N 112 112.681 117.387 -4.706 1
1 287 . 8 1 1 A 24 24 PRO HA H 113 4.408 4.483 -0.075 1
1 294 . 8 1 1 A 24 24 PRO C C 113 178.175 177.322 0.853 1
1 295 . 8 1 1 A 24 24 PRO CA C 113 62.040 62.364 -0.324 1
1 296 . 8 1 1 A 24 24 PRO CB C 113 31.920 33.602 -1.682 1
1 299 . 8 1 1 A 25 25 LEU H H 114 8.593 8.845 -0.252 1
1 300 . 8 1 1 A 25 25 LEU HA H 114 3.765 4.053 -0.288 1
1 310 . 8 1 1 A 25 25 LEU C C 114 179.950 178.625 1.325 1
1 311 . 8 1 1 A 25 25 LEU CA C 114 57.674 57.885 -0.211 1
1 312 . 8 1 1 A 25 25 LEU CB C 114 40.690 41.423 -0.733 1
1 316 . 8 1 1 A 25 25 LEU N N 114 123.729 123.336 0.393 1
1 317 . 8 1 1 A 26 26 GLU H H 115 9.108 8.375 0.733 1
1 318 . 8 1 1 A 26 26 GLU HA H 115 3.876 3.987 -0.111 1
1 323 . 8 1 1 A 26 26 GLU C C 115 177.505 179.355 -1.850 1
1 324 . 8 1 1 A 26 26 GLU CA C 115 59.410 59.540 -0.130 1
1 325 . 8 1 1 A 26 26 GLU CB C 115 28.460 29.316 -0.856 1
1 327 . 8 1 1 A 26 26 GLU N N 115 116.817 118.174 -1.357 1
1 328 . 8 1 1 A 27 27 ALA H H 116 7.360 7.833 -0.473 1
1 329 . 8 1 1 A 27 27 ALA HA H 116 4.408 3.910 0.498 1
1 333 . 8 1 1 A 27 27 ALA C C 116 177.046 177.802 -0.756 1
1 334 . 8 1 1 A 27 27 ALA CA C 116 52.970 54.314 -1.344 1
1 335 . 8 1 1 A 27 27 ALA CB C 116 19.916 17.977 1.939 1
1 336 . 8 1 1 A 27 27 ALA N N 116 118.966 121.008 -2.042 1
1 337 . 8 1 1 A 28 28 ILE H H 117 7.168 7.016 0.152 1
1 338 . 8 1 1 A 28 28 ILE HA H 117 4.432 4.761 -0.329 1
1 348 . 8 1 1 A 28 28 ILE C C 117 172.641 175.472 -2.831 1
1 349 . 8 1 1 A 28 28 ILE CA C 117 59.980 59.708 0.272 1
1 350 . 8 1 1 A 28 28 ILE CB C 117 37.350 37.956 -0.606 1
1 354 . 8 1 1 A 28 28 ILE N N 117 108.913 108.678 0.235 1
1 355 . 8 1 1 A 29 29 GLN H H 118 6.562 7.319 -0.757 1
1 356 . 8 1 1 A 29 29 GLN HA H 118 3.922 4.318 -0.396 1
1 363 . 8 1 1 A 29 29 GLN C C 118 175.049 175.659 -0.610 1
1 364 . 8 1 1 A 29 29 GLN CA C 118 54.596 55.967 -1.371 1
1 365 . 8 1 1 A 29 29 GLN CB C 118 29.570 29.523 0.047 1
1 367 . 8 1 1 A 29 29 GLN N N 118 116.455 123.572 -7.117 1
1 369 . 8 1 1 A 30 30 CYS H H 119 8.138 8.295 -0.157 1
1 370 . 8 1 1 A 30 30 CYS HA H 119 4.580 4.679 -0.099 1
1 373 . 8 1 1 A 30 30 CYS CA C 119 57.810 57.148 0.662 1
1 374 . 8 1 1 A 30 30 CYS CB C 119 30.200 28.882 1.318 1
1 375 . 8 1 1 A 30 30 CYS N N 119 134.136 125.571 8.565 1
1 376 . 8 1 1 A 31 31 PRO HA H 120 4.424 4.401 0.023 1
1 383 . 8 1 1 A 31 31 PRO C C 120 177.431 178.529 -1.098 1
1 384 . 8 1 1 A 31 31 PRO CA C 120 64.060 64.529 -0.469 1
1 385 . 8 1 1 A 31 31 PRO CB C 120 32.776 32.256 0.520 1
1 388 . 8 1 1 A 32 32 ILE H H 121 11.318 7.196 4.122 1
1 389 . 8 1 1 A 32 32 ILE HA H 121 4.038 3.941 0.097 1
1 399 . 8 1 1 A 32 32 ILE C C 121 178.485 177.642 0.843 1
1 400 . 8 1 1 A 32 32 ILE CA C 121 64.060 64.233 -0.173 1
1 401 . 8 1 1 A 32 32 ILE CB C 121 39.340 38.306 1.034 1
1 405 . 8 1 1 A 32 32 ILE N N 121 124.500 116.835 7.665 1
1 406 . 8 1 1 A 33 33 THR H H 122 9.928 7.320 2.608 1
1 407 . 8 1 1 A 33 33 THR HA H 122 4.048 4.453 -0.405 1
1 412 . 8 1 1 A 33 33 THR C C 122 175.793 174.466 1.327 1
1 413 . 8 1 1 A 33 33 THR CA C 122 62.990 61.593 1.397 1
1 414 . 8 1 1 A 33 33 THR CB C 122 70.300 69.611 0.689 1
1 416 . 8 1 1 A 33 33 THR N N 122 115.136 108.641 6.495 1
1 417 . 8 1 1 A 34 34 LEU H H 123 8.439 7.871 0.568 1
1 418 . 8 1 1 A 34 34 LEU HA H 123 3.912 4.126 -0.214 1
1 428 . 8 1 1 A 34 34 LEU C C 123 175.495 175.553 -0.058 1
1 429 . 8 1 1 A 34 34 LEU CA C 123 56.290 55.722 0.568 1
1 430 . 8 1 1 A 34 34 LEU CB C 123 38.500 39.728 -1.228 1
1 434 . 8 1 1 A 34 34 LEU N N 123 117.230 121.671 -4.441 1
1 435 . 8 1 1 A 35 35 GLU H H 124 7.816 7.489 0.327 1
1 436 . 8 1 1 A 35 35 GLU HA H 124 4.634 4.639 -0.005 1
1 441 . 8 1 1 A 35 35 GLU C C 124 174.838 174.013 0.825 1
1 442 . 8 1 1 A 35 35 GLU CA C 124 53.780 54.782 -1.002 1
1 443 . 8 1 1 A 35 35 GLU CB C 124 33.710 31.989 1.721 1
1 445 . 8 1 1 A 35 35 GLU N N 124 116.577 116.104 0.473 1
1 446 . 8 1 1 A 36 36 GLN H H 125 8.532 8.592 -0.060 1
1 447 . 8 1 1 A 36 36 GLN HA H 125 4.958 4.399 0.559 1
1 454 . 8 1 1 A 36 36 GLN CA C 125 53.350 53.709 -0.359 1
1 455 . 8 1 1 A 36 36 GLN CB C 125 29.950 29.890 0.060 1
1 457 . 8 1 1 A 36 36 GLN N N 125 123.034 121.448 1.586 1
1 459 . 8 1 1 A 37 37 PRO HA H 126 4.458 4.494 -0.036 1
1 466 . 8 1 1 A 37 37 PRO C C 126 176.314 177.294 -0.980 1
1 467 . 8 1 1 A 37 37 PRO CA C 126 62.816 65.649 -2.833 1
1 468 . 8 1 1 A 37 37 PRO CB C 126 33.070 31.581 1.489 1
1 471 . 8 1 1 A 38 38 GLU H H 127 8.626 7.720 0.906 1
1 472 . 8 1 1 A 38 38 GLU HA H 127 4.274 4.427 -0.153 1
1 477 . 8 1 1 A 38 38 GLU C C 127 177.809 175.102 2.707 1
1 478 . 8 1 1 A 38 38 GLU CA C 127 58.730 58.357 0.373 1
1 479 . 8 1 1 A 38 38 GLU CB C 127 30.340 29.472 0.868 1
1 481 . 8 1 1 A 38 38 GLU N N 127 120.691 119.279 1.412 1
1 482 . 8 1 1 A 39 39 LYS H H 128 7.891 7.908 -0.017 1
1 483 . 8 1 1 A 39 39 LYS HA H 128 4.870 4.751 0.119 1
1 492 . 8 1 1 A 39 39 LYS C C 128 175.452 175.608 -0.156 1
1 493 . 8 1 1 A 39 39 LYS CA C 128 53.540 54.715 -1.175 1
1 494 . 8 1 1 A 39 39 LYS CB C 128 33.630 34.412 -0.782 1
1 498 . 8 1 1 A 39 39 LYS N N 128 118.149 117.670 0.479 1
1 499 . 8 1 1 A 40 40 GLY H H 129 8.524 8.109 0.415 1
1 500 . 8 1 1 A 40 40 GLY HA2 H 129 4.973 4.049 0.924 1
1 501 . 8 1 1 A 40 40 GLY HA3 H 129 2.459 4.167 -1.708 1
1 502 . 8 1 1 A 40 40 GLY C C 129 169.943 172.019 -2.076 1
1 503 . 8 1 1 A 40 40 GLY CA C 129 42.910 44.783 -1.873 1
1 504 . 8 1 1 A 40 40 GLY N N 129 112.845 111.122 1.723 1
1 505 . 8 1 1 A 41 41 ILE H H 130 8.659 8.193 0.466 1
1 506 . 8 1 1 A 41 41 ILE HA H 130 4.591 4.830 -0.239 1
1 516 . 8 1 1 A 41 41 ILE C C 130 172.586 174.026 -1.440 1
1 517 . 8 1 1 A 41 41 ILE CA C 130 58.090 58.910 -0.820 1
1 518 . 8 1 1 A 41 41 ILE CB C 130 43.320 42.186 1.134 1
1 522 . 8 1 1 A 41 41 ILE N N 130 114.060 119.385 -5.325 1
1 523 . 8 1 1 A 42 42 PHE H H 131 9.206 8.776 0.430 1
1 524 . 8 1 1 A 42 42 PHE HA H 131 5.159 4.702 0.457 1
1 532 . 8 1 1 A 42 42 PHE C C 131 174.931 175.858 -0.927 1
1 533 . 8 1 1 A 42 42 PHE CA C 131 57.790 58.146 -0.356 1
1 534 . 8 1 1 A 42 42 PHE CB C 131 42.220 39.126 3.094 1
1 538 . 8 1 1 A 42 42 PHE N N 131 126.002 128.266 -2.264 1
1 539 . 8 1 1 A 43 43 VAL H H 132 8.502 8.880 -0.378 1
1 540 . 8 1 1 A 43 43 VAL HA H 132 4.921 4.700 0.221 1
1 548 . 8 1 1 A 43 43 VAL C C 132 178.219 175.653 2.566 1
1 549 . 8 1 1 A 43 43 VAL CA C 132 59.600 60.261 -0.661 1
1 550 . 8 1 1 A 43 43 VAL CB C 132 35.920 35.394 0.526 1
1 553 . 8 1 1 A 43 43 VAL N N 132 119.068 122.882 -3.814 1
1 554 . 8 1 1 A 44 44 LYS H H 133 10.036 8.736 1.300 1
1 555 . 8 1 1 A 44 44 LYS HA H 133 5.070 4.317 0.753 1
1 564 . 8 1 1 A 44 44 LYS C C 133 177.276 177.892 -0.616 1
1 565 . 8 1 1 A 44 44 LYS CA C 133 56.720 57.149 -0.429 1
1 566 . 8 1 1 A 44 44 LYS CB C 133 34.410 32.998 1.412 1
1 570 . 8 1 1 A 44 44 LYS N N 133 130.934 125.365 5.569 1
1 571 . 8 1 1 A 45 45 ASN H H 134 8.093 8.592 -0.499 1
1 572 . 8 1 1 A 45 45 ASN HA H 134 4.152 4.717 -0.565 1
1 577 . 8 1 1 A 45 45 ASN C C 134 174.087 175.167 -1.080 1
1 578 . 8 1 1 A 45 45 ASN CA C 134 55.360 55.855 -0.495 1
1 579 . 8 1 1 A 45 45 ASN CB C 134 37.530 39.194 -1.664 1
1 580 . 8 1 1 A 45 45 ASN N N 134 117.963 121.538 -3.575 1
1 582 . 8 1 1 A 46 46 SER H H 135 7.524 7.862 -0.338 1
1 583 . 8 1 1 A 46 46 SER HA H 135 4.219 4.623 -0.404 1
1 586 . 8 1 1 A 46 46 SER C C 135 174.490 174.237 0.253 1
1 587 . 8 1 1 A 46 46 SER CA C 135 57.090 55.727 1.363 1
1 588 . 8 1 1 A 46 46 SER CB C 135 63.860 66.746 -2.886 1
1 589 . 8 1 1 A 46 46 SER N N 135 105.939 108.692 -2.753 1
1 590 . 8 1 1 A 47 47 ASP H H 136 9.113 8.997 0.116 1
1 591 . 8 1 1 A 47 47 ASP HA H 136 4.220 4.246 -0.026 1
1 594 . 8 1 1 A 47 47 ASP CA C 136 57.610 57.144 0.466 1
1 595 . 8 1 1 A 47 47 ASP CB C 136 40.810 40.625 0.185 1
1 596 . 8 1 1 A 47 47 ASP N N 136 120.995 122.413 -1.418 1
1 597 . 8 1 1 A 48 48 GLY H H 137 8.181 8.078 0.103 1
1 598 . 8 1 1 A 48 48 GLY HA2 H 137 4.120 3.864 0.256 1
1 599 . 8 1 1 A 48 48 GLY HA3 H 137 3.659 3.864 -0.205 1
1 600 . 8 1 1 A 48 48 GLY C C 137 174.062 173.487 0.575 1
1 601 . 8 1 1 A 48 48 GLY CA C 137 45.130 46.206 -1.076 1
1 602 . 8 1 1 A 48 48 GLY N N 137 106.197 106.563 -0.366 1
1 603 . 8 1 1 A 49 49 SER H H 138 7.179 7.315 -0.136 1
1 604 . 8 1 1 A 49 49 SER HA H 138 4.383 5.003 -0.620 1
1 607 . 8 1 1 A 49 49 SER C C 138 173.864 173.480 0.384 1
1 608 . 8 1 1 A 49 49 SER CA C 138 57.614 57.533 0.081 1
1 609 . 8 1 1 A 49 49 SER CB C 138 65.100 66.818 -1.718 1
1 610 . 8 1 1 A 49 49 SER N N 138 115.015 114.101 0.914 1
1 611 . 8 1 1 A 50 50 ASP H H 139 8.078 8.385 -0.307 1
1 612 . 8 1 1 A 50 50 ASP HA H 139 4.642 4.802 -0.160 1
1 615 . 8 1 1 A 50 50 ASP C C 139 174.261 174.827 -0.566 1
1 616 . 8 1 1 A 50 50 ASP CA C 139 52.406 54.212 -1.806 1
1 617 . 8 1 1 A 50 50 ASP CB C 139 40.254 40.912 -0.658 1
1 618 . 8 1 1 A 50 50 ASP N N 139 122.400 123.152 -0.752 1
1 619 . 8 1 1 A 51 51 VAL H H 140 8.111 7.539 0.572 1
1 620 . 8 1 1 A 51 51 VAL HA H 140 4.360 4.716 -0.356 1
1 628 . 8 1 1 A 51 51 VAL C C 140 176.147 173.630 2.517 1
1 629 . 8 1 1 A 51 51 VAL CA C 140 62.670 60.152 2.518 1
1 630 . 8 1 1 A 51 51 VAL CB C 140 33.930 34.027 -0.097 1
1 632 . 8 1 1 A 51 51 VAL N N 140 120.374 119.266 1.108 1
1 633 . 8 1 1 A 52 52 CYS H H 141 8.358 9.017 -0.659 1
1 634 . 8 1 1 A 52 52 CYS HA H 141 4.957 5.431 -0.474 1
1 637 . 8 1 1 A 52 52 CYS C C 141 173.070 172.975 0.095 1
1 638 . 8 1 1 A 52 52 CYS CA C 141 53.380 54.345 -0.965 1
1 639 . 8 1 1 A 52 52 CYS CB C 141 46.110 45.517 0.593 1
1 640 . 8 1 1 A 52 52 CYS N N 141 121.305 129.301 -7.996 1
1 641 . 8 1 1 A 53 53 THR H H 142 8.929 8.617 0.312 1
1 642 . 8 1 1 A 53 53 THR HA H 142 4.498 4.833 -0.335 1
1 648 . 8 1 1 A 53 53 THR C C 142 172.151 172.359 -0.208 1
1 649 . 8 1 1 A 53 53 THR CA C 142 62.960 61.252 1.708 1
1 650 . 8 1 1 A 53 53 THR CB C 142 70.540 72.782 -2.242 1
1 652 . 8 1 1 A 53 53 THR N N 142 120.105 118.559 1.546 1
1 653 . 8 1 1 A 54 54 LEU H H 143 8.448 8.734 -0.286 1
1 654 . 8 1 1 A 54 54 LEU HA H 143 4.322 4.770 -0.448 1
1 664 . 8 1 1 A 54 54 LEU C C 143 174.484 174.383 0.101 1
1 665 . 8 1 1 A 54 54 LEU CA C 143 54.596 53.305 1.291 1
1 666 . 8 1 1 A 54 54 LEU CB C 143 42.396 43.648 -1.252 1
1 670 . 8 1 1 A 54 54 LEU N N 143 128.819 128.882 -0.063 1
1 671 . 8 1 1 A 55 55 PHE H H 144 8.661 8.776 -0.115 1
1 672 . 8 1 1 A 55 55 PHE HA H 144 5.459 5.029 0.430 1
1 680 . 8 1 1 A 55 55 PHE C C 144 176.035 174.607 1.428 1
1 681 . 8 1 1 A 55 55 PHE CA C 144 55.020 56.706 -1.686 1
1 682 . 8 1 1 A 55 55 PHE CB C 144 44.100 42.835 1.265 1
1 686 . 8 1 1 A 55 55 PHE N N 144 121.897 126.159 -4.262 1
1 687 . 8 1 1 A 56 56 ASP H H 145 11.616 8.643 2.973 1
1 688 . 8 1 1 A 56 56 ASP HA H 145 4.417 4.751 -0.334 1
1 691 . 8 1 1 A 56 56 ASP C C 145 176.748 177.155 -0.407 1
1 692 . 8 1 1 A 56 56 ASP CA C 145 55.844 54.048 1.796 1
1 693 . 8 1 1 A 56 56 ASP CB C 145 44.390 42.952 1.438 1
1 694 . 8 1 1 A 56 56 ASP N N 145 122.131 121.263 0.868 1
1 695 . 8 1 1 A 57 57 ALA H H 146 8.508 8.882 -0.374 1
1 696 . 8 1 1 A 57 57 ALA HA H 146 3.797 4.067 -0.270 1
1 700 . 8 1 1 A 57 57 ALA C C 146 178.696 180.095 -1.399 1
1 701 . 8 1 1 A 57 57 ALA CA C 146 55.990 55.272 0.718 1
1 702 . 8 1 1 A 57 57 ALA CB C 146 18.840 18.137 0.703 1
1 703 . 8 1 1 A 57 57 ALA N N 146 130.243 128.698 1.545 1
1 704 . 8 1 1 A 58 58 ALA H H 147 8.378 7.819 0.559 1
1 705 . 8 1 1 A 58 58 ALA HA H 147 4.078 4.186 -0.108 1
1 709 . 8 1 1 A 58 58 ALA C C 147 181.091 179.831 1.260 1
1 710 . 8 1 1 A 58 58 ALA CA C 147 54.770 54.940 -0.170 1
1 711 . 8 1 1 A 58 58 ALA CB C 147 17.700 18.387 -0.687 1
1 712 . 8 1 1 A 58 58 ALA N N 147 121.997 119.878 2.119 1
1 713 . 8 1 1 A 59 59 ALA H H 148 9.138 7.984 1.154 1
1 714 . 8 1 1 A 59 59 ALA HA H 148 3.975 4.131 -0.156 1
1 718 . 8 1 1 A 59 59 ALA C C 148 180.508 179.824 0.684 1
1 719 . 8 1 1 A 59 59 ALA CA C 148 54.840 54.928 -0.088 1
1 720 . 8 1 1 A 59 59 ALA CB C 148 18.600 18.580 0.020 1
1 721 . 8 1 1 A 59 59 ALA N N 148 123.595 120.689 2.906 1
1 722 . 8 1 1 A 60 60 PHE H H 149 8.814 8.046 0.768 1
1 723 . 8 1 1 A 60 60 PHE HA H 149 3.722 3.978 -0.256 1
1 731 . 8 1 1 A 60 60 PHE C C 149 176.773 177.445 -0.672 1
1 732 . 8 1 1 A 60 60 PHE CA C 149 62.030 61.484 0.546 1
1 733 . 8 1 1 A 60 60 PHE CB C 149 39.960 38.966 0.994 1
1 737 . 8 1 1 A 60 60 PHE N N 149 120.354 120.237 0.117 1
1 738 . 8 1 1 A 61 61 SER H H 150 8.276 8.331 -0.055 1
1 739 . 8 1 1 A 61 61 SER HA H 150 3.880 3.987 -0.107 1
1 742 . 8 1 1 A 61 61 SER C C 150 177.691 176.435 1.256 1
1 743 . 8 1 1 A 61 61 SER CA C 150 62.190 61.638 0.552 1
1 744 . 8 1 1 A 61 61 SER CB C 150 63.016 63.001 0.015 1
1 745 . 8 1 1 A 61 61 SER N N 150 112.086 114.106 -2.020 1
1 746 . 8 1 1 A 62 62 ARG H H 151 7.829 7.904 -0.075 1
1 747 . 8 1 1 A 62 62 ARG HA H 151 3.971 4.021 -0.050 1
1 754 . 8 1 1 A 62 62 ARG C C 151 178.287 178.402 -0.115 1
1 755 . 8 1 1 A 62 62 ARG CA C 151 59.340 58.778 0.562 1
1 756 . 8 1 1 A 62 62 ARG CB C 151 29.760 29.683 0.077 1
1 759 . 8 1 1 A 62 62 ARG N N 151 121.090 119.370 1.720 1
1 760 . 8 1 1 A 63 63 LEU H H 152 7.390 7.533 -0.143 1
1 761 . 8 1 1 A 63 63 LEU HA H 152 3.791 3.919 -0.128 1
1 771 . 8 1 1 A 63 63 LEU C C 152 179.106 178.118 0.988 1
1 772 . 8 1 1 A 63 63 LEU CA C 152 58.900 58.209 0.691 1
1 773 . 8 1 1 A 63 63 LEU CB C 152 41.140 41.369 -0.229 1
1 777 . 8 1 1 A 63 63 LEU N N 152 121.129 122.102 -0.973 1
1 778 . 8 1 1 A 64 64 VAL H H 153 7.552 7.952 -0.400 1
1 779 . 8 1 1 A 64 64 VAL HA H 153 3.411 3.511 -0.100 1
1 787 . 8 1 1 A 64 64 VAL C C 153 180.595 178.263 2.332 1
1 788 . 8 1 1 A 64 64 VAL CA C 153 65.644 66.039 -0.395 1
1 789 . 8 1 1 A 64 64 VAL CB C 153 31.410 31.296 0.114 1
1 792 . 8 1 1 A 64 64 VAL N N 153 118.280 118.958 -0.678 1
1 793 . 8 1 1 A 65 65 GLY H H 154 8.061 8.225 -0.164 1
1 794 . 8 1 1 A 65 65 GLY HA2 H 154 3.846 3.716 0.130 1
1 795 . 8 1 1 A 65 65 GLY HA3 H 154 3.809 3.718 0.091 1
1 796 . 8 1 1 A 65 65 GLY C C 154 175.235 176.345 -1.110 1
1 797 . 8 1 1 A 65 65 GLY CA C 154 46.630 47.230 -0.600 1
1 798 . 8 1 1 A 65 65 GLY N N 154 108.622 107.675 0.947 1
1 799 . 8 1 1 A 66 66 GLU H H 155 7.528 7.568 -0.040 1
1 800 . 8 1 1 A 66 66 GLU HA H 155 4.228 4.288 -0.060 1
1 805 . 8 1 1 A 66 66 GLU C C 155 176.761 177.123 -0.362 1
1 806 . 8 1 1 A 66 66 GLU CA C 155 56.590 56.345 0.245 1
1 807 . 8 1 1 A 66 66 GLU CB C 155 30.490 30.108 0.382 1
1 809 . 8 1 1 A 66 66 GLU N N 155 118.361 120.038 -1.677 1
1 810 . 8 1 1 A 67 67 GLY H H 156 7.884 7.737 0.147 1
1 811 . 8 1 1 A 67 67 GLY HA2 H 156 3.918 3.913 0.005 1
1 812 . 8 1 1 A 67 67 GLY HA3 H 156 3.747 3.928 -0.181 1
1 813 . 8 1 1 A 67 67 GLY C C 156 174.788 174.846 -0.058 1
1 814 . 8 1 1 A 67 67 GLY CA C 156 45.890 46.478 -0.588 1
1 815 . 8 1 1 A 67 67 GLY N N 156 108.465 109.664 -1.199 1
1 816 . 8 1 1 A 68 68 LEU H H 157 7.332 7.771 -0.439 1
1 817 . 8 1 1 A 68 68 LEU HA H 157 4.361 4.580 -0.219 1
1 827 . 8 1 1 A 68 68 LEU CA C 157 53.060 52.144 0.916 1
1 828 . 8 1 1 A 68 68 LEU CB C 157 41.100 41.329 -0.229 1
1 832 . 8 1 1 A 68 68 LEU N N 157 121.920 121.373 0.547 1
1 833 . 8 1 1 A 69 69 PRO HA H 158 4.485 4.556 -0.071 1
1 840 . 8 1 1 A 69 69 PRO C C 158 174.602 176.447 -1.845 1
1 841 . 8 1 1 A 69 69 PRO CA C 158 61.556 62.295 -0.739 1
1 842 . 8 1 1 A 69 69 PRO CB C 158 32.370 32.374 -0.004 1
1 845 . 8 1 1 A 70 70 HIS H H 159 8.734 8.570 0.164 1
1 846 . 8 1 1 A 70 70 HIS HA H 159 3.947 4.395 -0.448 1
1 852 . 8 1 1 A 70 70 HIS CA C 159 56.250 55.236 1.014 1
1 853 . 8 1 1 A 70 70 HIS CB C 159 32.280 30.913 1.367 1
1 856 . 8 1 1 A 70 70 HIS N N 159 119.423 121.939 -2.516 1
1 857 . 8 1 1 A 71 71 PRO HA H 160 4.424 4.166 0.258 1
1 864 . 8 1 1 A 71 71 PRO C C 160 177.567 178.205 -0.638 1
1 865 . 8 1 1 A 71 71 PRO CA C 160 64.574 65.370 -0.796 1
1 866 . 8 1 1 A 71 71 PRO CB C 160 32.340 31.663 0.677 1
1 869 . 8 1 1 A 72 72 LEU H H 161 10.123 7.387 2.736 1
1 870 . 8 1 1 A 72 72 LEU HA H 161 4.778 4.337 0.441 1
1 880 . 8 1 1 A 72 72 LEU C C 161 178.721 178.793 -0.072 1
1 881 . 8 1 1 A 72 72 LEU CA C 161 55.800 56.808 -1.008 1
1 882 . 8 1 1 A 72 72 LEU CB C 161 42.440 42.101 0.339 1
1 886 . 8 1 1 A 72 72 LEU N N 161 117.374 117.436 -0.062 1
1 887 . 8 1 1 A 73 73 THR H H 162 7.523 7.862 -0.339 1
1 888 . 8 1 1 A 73 73 THR HA H 162 4.291 4.423 -0.132 1
1 893 . 8 1 1 A 73 73 THR C C 162 175.557 174.191 1.366 1
1 894 . 8 1 1 A 73 73 THR CA C 162 61.440 63.744 -2.304 1
1 895 . 8 1 1 A 73 73 THR CB C 162 70.500 69.386 1.114 1
1 897 . 8 1 1 A 73 73 THR N N 162 107.787 112.481 -4.694 1
1 898 . 8 1 1 A 74 74 ARG H H 163 8.361 7.791 0.570 1
1 899 . 8 1 1 A 74 74 ARG HA H 163 3.836 4.214 -0.378 1
1 906 . 8 1 1 A 74 74 ARG C C 163 174.701 175.239 -0.538 1
1 907 . 8 1 1 A 74 74 ARG CA C 163 57.980 57.658 0.322 1
1 908 . 8 1 1 A 74 74 ARG CB C 163 26.770 27.009 -0.239 1
1 911 . 8 1 1 A 74 74 ARG N N 163 115.130 118.300 -3.170 1
1 912 . 8 1 1 A 75 75 GLU H H 164 7.430 8.094 -0.664 1
1 913 . 8 1 1 A 75 75 GLU HA H 164 4.636 4.450 0.186 1
1 918 . 8 1 1 A 75 75 GLU CA C 164 53.699 55.196 -1.497 1
1 919 . 8 1 1 A 75 75 GLU CB C 164 29.550 28.537 1.013 1
1 921 . 8 1 1 A 75 75 GLU N N 164 120.076 119.093 0.983 1
1 922 . 8 1 1 A 76 76 PRO HA H 165 4.272 4.438 -0.166 1
1 929 . 8 1 1 A 76 76 PRO C C 165 176.649 176.914 -0.265 1
1 930 . 8 1 1 A 76 76 PRO CA C 165 63.204 63.148 0.056 1
1 931 . 8 1 1 A 76 76 PRO CB C 165 31.680 31.619 0.061 1
1 934 . 8 1 1 A 77 77 ILE H H 166 8.812 8.214 0.598 1
1 935 . 8 1 1 A 77 77 ILE HA H 166 3.838 4.291 -0.453 1
1 945 . 8 1 1 A 77 77 ILE C C 166 175.235 175.776 -0.541 1
1 946 . 8 1 1 A 77 77 ILE CA C 166 62.816 61.191 1.625 1
1 947 . 8 1 1 A 77 77 ILE CB C 166 37.750 36.956 0.794 1
1 951 . 8 1 1 A 77 77 ILE N N 166 123.831 124.164 -0.333 1
1 952 . 8 1 1 A 78 78 THR H H 167 6.625 8.580 -1.955 1
1 953 . 8 1 1 A 78 78 THR HA H 167 4.632 5.069 -0.437 1
1 958 . 8 1 1 A 78 78 THR C C 167 174.143 175.059 -0.916 1
1 959 . 8 1 1 A 78 78 THR CA C 167 58.750 59.860 -1.110 1
1 960 . 8 1 1 A 78 78 THR CB C 167 71.320 71.317 0.003 1
1 962 . 8 1 1 A 78 78 THR N N 167 115.293 119.322 -4.029 1
1 963 . 8 1 1 A 79 79 ALA H H 168 9.088 9.043 0.045 1
1 964 . 8 1 1 A 79 79 ALA HA H 168 3.916 4.108 -0.192 1
1 968 . 8 1 1 A 79 79 ALA C C 168 179.770 179.594 0.176 1
1 969 . 8 1 1 A 79 79 ALA CA C 168 55.480 55.063 0.417 1
1 970 . 8 1 1 A 79 79 ALA CB C 168 17.630 18.369 -0.739 1
1 971 . 8 1 1 A 79 79 ALA N N 168 122.102 127.887 -5.785 1
1 972 . 8 1 1 A 80 80 SER H H 169 7.988 7.827 0.161 1
1 973 . 8 1 1 A 80 80 SER HA H 169 4.091 4.218 -0.127 1
1 976 . 8 1 1 A 80 80 SER C C 169 175.836 176.457 -0.621 1
1 977 . 8 1 1 A 80 80 SER CA C 169 60.750 61.561 -0.811 1
1 978 . 8 1 1 A 80 80 SER CB C 169 62.510 63.009 -0.499 1
1 979 . 8 1 1 A 80 80 SER N N 169 109.660 113.280 -3.620 1
1 980 . 8 1 1 A 81 81 ILE H H 170 7.052 7.693 -0.641 1
1 981 . 8 1 1 A 81 81 ILE HA H 170 4.344 3.972 0.372 1
1 991 . 8 1 1 A 81 81 ILE C C 170 174.236 176.554 -2.318 1
1 992 . 8 1 1 A 81 81 ILE CA C 170 61.760 64.195 -2.435 1
1 993 . 8 1 1 A 81 81 ILE CB C 170 37.950 37.475 0.475 1
1 997 . 8 1 1 A 81 81 ILE N N 170 112.623 114.597 -1.974 1
1 998 . 8 1 1 A 82 82 ILE H H 171 7.345 7.210 0.135 1
1 999 . 8 1 1 A 82 82 ILE HA H 171 4.288 4.018 0.270 1
1 1009 . 8 1 1 A 82 82 ILE C C 171 174.931 175.282 -0.351 1
1 1010 . 8 1 1 A 82 82 ILE CA C 171 61.420 62.117 -0.697 1
1 1011 . 8 1 1 A 82 82 ILE CB C 171 37.230 37.637 -0.407 1
1 1015 . 8 1 1 A 82 82 ILE N N 171 124.260 124.563 -0.303 1
1 1016 . 8 1 1 A 83 83 VAL H H 172 7.843 8.759 -0.916 1
1 1017 . 8 1 1 A 83 83 VAL HA H 172 4.818 5.057 -0.239 1
1 1025 . 8 1 1 A 83 83 VAL C C 172 174.918 175.383 -0.465 1
1 1026 . 8 1 1 A 83 83 VAL CA C 172 58.910 59.075 -0.165 1
1 1027 . 8 1 1 A 83 83 VAL CB C 172 34.570 35.148 -0.578 1
1 1030 . 8 1 1 A 83 83 VAL N N 172 118.856 121.875 -3.019 1
1 1031 . 8 1 1 A 84 84 LYS H H 173 8.347 8.756 -0.409 1
1 1032 . 8 1 1 A 84 84 LYS HA H 173 4.356 4.660 -0.304 1
1 1041 . 8 1 1 A 84 84 LYS C C 173 178.653 178.598 0.055 1
1 1042 . 8 1 1 A 84 84 LYS CA C 173 56.360 55.146 1.214 1
1 1043 . 8 1 1 A 84 84 LYS CB C 173 33.366 33.838 -0.472 1
1 1047 . 8 1 1 A 84 84 LYS N N 173 119.602 121.356 -1.754 1
1 1048 . 8 1 1 A 85 85 HIS H H 174 9.143 9.025 0.118 1
1 1049 . 8 1 1 A 85 85 HIS HA H 174 4.013 4.342 -0.329 1
1 1053 . 8 1 1 A 85 85 HIS C C 174 176.606 176.519 0.087 1
1 1054 . 8 1 1 A 85 85 HIS CA C 174 58.820 60.407 -1.587 1
1 1055 . 8 1 1 A 85 85 HIS CB C 174 28.186 30.057 -1.871 1
1 1057 . 8 1 1 A 85 85 HIS N N 174 120.022 122.794 -2.772 1
1 1058 . 8 1 1 A 86 86 GLU H H 175 8.403 8.323 0.080 1
1 1059 . 8 1 1 A 86 86 GLU HA H 175 3.863 3.709 0.154 1
1 1064 . 8 1 1 A 86 86 GLU C C 175 177.040 179.155 -2.115 1
1 1065 . 8 1 1 A 86 86 GLU CA C 175 57.830 59.740 -1.910 1
1 1066 . 8 1 1 A 86 86 GLU CB C 175 28.690 29.152 -0.462 1
1 1068 . 8 1 1 A 86 86 GLU N N 175 116.124 117.487 -1.363 1
1 1069 . 8 1 1 A 87 87 GLU H H 176 7.669 7.974 -0.305 1
1 1070 . 8 1 1 A 87 87 GLU HA H 176 4.039 4.194 -0.155 1
1 1075 . 8 1 1 A 87 87 GLU C C 176 175.688 177.259 -1.571 1
1 1076 . 8 1 1 A 87 87 GLU CA C 176 57.906 59.276 -1.370 1
1 1077 . 8 1 1 A 87 87 GLU CB C 176 30.430 29.110 1.320 1
1 1079 . 8 1 1 A 87 87 GLU N N 176 116.183 119.304 -3.121 1
1 1080 . 8 1 1 A 88 88 CYS H H 177 6.750 7.632 -0.882 1
1 1081 . 8 1 1 A 88 88 CYS HA H 177 4.991 4.587 0.404 1
1 1084 . 8 1 1 A 88 88 CYS C C 177 172.325 173.354 -1.029 1
1 1085 . 8 1 1 A 88 88 CYS CA C 177 55.030 54.069 0.961 1
1 1086 . 8 1 1 A 88 88 CYS CB C 177 45.610 41.812 3.798 1
1 1087 . 8 1 1 A 88 88 CYS N N 177 114.838 116.516 -1.678 1
1 1088 . 8 1 1 A 89 89 ILE H H 178 9.128 8.861 0.267 1
1 1089 . 8 1 1 A 89 89 ILE HA H 178 4.536 4.914 -0.378 1
1 1099 . 8 1 1 A 89 89 ILE C C 178 174.893 174.392 0.501 1
1 1100 . 8 1 1 A 89 89 ILE CA C 178 59.160 59.441 -0.281 1
1 1101 . 8 1 1 A 89 89 ILE CB C 178 41.840 40.652 1.188 1
1 1105 . 8 1 1 A 89 89 ILE N N 178 120.564 121.889 -1.325 1
1 1106 . 8 1 1 A 90 90 TYR H H 179 9.349 9.073 0.276 1
1 1107 . 8 1 1 A 90 90 TYR HA H 179 3.568 4.235 -0.667 1
1 1112 . 8 1 1 A 90 90 TYR C C 179 173.950 173.798 0.152 1
1 1113 . 8 1 1 A 90 90 TYR CA C 179 61.180 58.329 2.851 1
1 1114 . 8 1 1 A 90 90 TYR CB C 179 37.530 38.259 -0.729 1
1 1116 . 8 1 1 A 90 90 TYR N N 179 129.033 126.841 2.192 1
1 1117 . 8 1 1 A 91 91 ASP H H 180 7.367 8.130 -0.763 1
1 1118 . 8 1 1 A 91 91 ASP HA H 180 4.662 4.678 -0.016 1
1 1121 . 8 1 1 A 91 91 ASP C C 180 175.291 176.031 -0.740 1
1 1122 . 8 1 1 A 91 91 ASP CA C 180 52.230 52.665 -0.435 1
1 1123 . 8 1 1 A 91 91 ASP CB C 180 43.650 42.458 1.192 1
1 1124 . 8 1 1 A 91 91 ASP N N 180 129.305 128.778 0.527 1
1 1125 . 8 1 1 A 92 92 ASP H H 181 8.783 9.009 -0.226 1
1 1126 . 8 1 1 A 92 92 ASP HA H 181 4.114 4.040 0.074 1
1 1129 . 8 1 1 A 92 92 ASP C C 181 177.573 177.584 -0.011 1
1 1130 . 8 1 1 A 92 92 ASP CA C 181 56.390 57.070 -0.680 1
1 1131 . 8 1 1 A 92 92 ASP CB C 181 41.330 40.438 0.892 1
1 1132 . 8 1 1 A 92 92 ASP N N 181 125.665 127.305 -1.640 1
1 1133 . 8 1 1 A 93 93 THR H H 182 8.284 7.873 0.411 1
1 1134 . 8 1 1 A 93 93 THR HA H 182 4.037 3.900 0.137 1
1 1139 . 8 1 1 A 93 93 THR C C 182 176.333 175.973 0.360 1
1 1140 . 8 1 1 A 93 93 THR CA C 182 65.320 66.560 -1.240 1
1 1141 . 8 1 1 A 93 93 THR CB C 182 68.560 68.202 0.358 1
1 1143 . 8 1 1 A 93 93 THR N N 182 114.688 116.203 -1.515 1
1 1144 . 8 1 1 A 94 94 ARG H H 183 7.784 7.431 0.353 1
1 1145 . 8 1 1 A 94 94 ARG HA H 183 4.142 4.249 -0.107 1
1 1152 . 8 1 1 A 94 94 ARG C C 183 177.015 177.135 -0.120 1
1 1153 . 8 1 1 A 94 94 ARG CA C 183 55.350 56.135 -0.785 1
1 1154 . 8 1 1 A 94 94 ARG CB C 183 30.930 31.090 -0.160 1
1 1157 . 8 1 1 A 94 94 ARG N N 183 120.156 118.446 1.710 1
1 1158 . 8 1 1 A 95 95 GLY H H 184 8.144 8.671 -0.527 1
1 1159 . 8 1 1 A 95 95 GLY HA2 H 184 3.839 3.727 0.112 1
1 1160 . 8 1 1 A 95 95 GLY HA3 H 184 3.681 3.886 -0.205 1
1 1161 . 8 1 1 A 95 95 GLY C C 184 173.653 173.179 0.474 1
1 1162 . 8 1 1 A 95 95 GLY CA C 184 46.160 46.226 -0.066 1
1 1163 . 8 1 1 A 95 95 GLY N N 184 107.879 108.546 -0.667 1
1 1164 . 8 1 1 A 96 96 ASN H H 185 6.855 6.970 -0.115 1
1 1165 . 8 1 1 A 96 96 ASN HA H 185 4.909 5.042 -0.133 1
1 1170 . 8 1 1 A 96 96 ASN C C 185 174.223 173.159 1.064 1
1 1171 . 8 1 1 A 96 96 ASN CA C 185 52.720 52.243 0.477 1
1 1172 . 8 1 1 A 96 96 ASN CB C 185 45.620 41.781 3.839 1
1 1173 . 8 1 1 A 96 96 ASN N N 185 113.382 116.204 -2.822 1
1 1175 . 8 1 1 A 97 97 PHE H H 186 9.228 8.677 0.551 1
1 1176 . 8 1 1 A 97 97 PHE HA H 186 4.579 4.829 -0.250 1
1 1183 . 8 1 1 A 97 97 PHE C C 186 174.794 175.490 -0.696 1
1 1184 . 8 1 1 A 97 97 PHE CA C 186 59.384 58.586 0.798 1
1 1185 . 8 1 1 A 97 97 PHE CB C 186 40.450 39.141 1.309 1
1 1188 . 8 1 1 A 97 97 PHE N N 186 118.661 119.626 -0.965 1
1 1189 . 8 1 1 A 98 98 ILE H H 187 8.908 9.158 -0.250 1
1 1190 . 8 1 1 A 98 98 ILE HA H 187 5.440 4.774 0.666 1
1 1200 . 8 1 1 A 98 98 ILE C C 187 176.171 174.639 1.532 1
1 1201 . 8 1 1 A 98 98 ILE CA C 187 57.610 59.582 -1.972 1
1 1202 . 8 1 1 A 98 98 ILE CB C 187 41.280 40.656 0.624 1
1 1206 . 8 1 1 A 98 98 ILE N N 187 120.585 123.283 -2.698 1
1 1207 . 8 1 1 A 99 99 ILE H H 188 8.602 8.350 0.252 1
1 1208 . 8 1 1 A 99 99 ILE HA H 188 4.546 4.863 -0.317 1
1 1218 . 8 1 1 A 99 99 ILE C C 188 176.668 175.197 1.471 1
1 1219 . 8 1 1 A 99 99 ILE CA C 188 58.920 60.200 -1.280 1
1 1220 . 8 1 1 A 99 99 ILE CB C 188 37.960 39.167 -1.207 1
1 1224 . 8 1 1 A 99 99 ILE N N 188 124.500 124.960 -0.460 1
1 1225 . 8 1 1 A 100 100 LYS H H 189 8.449 8.230 0.219 1
1 1226 . 8 1 1 A 100 100 LYS HA H 189 4.108 4.796 -0.688 1
1 1235 . 8 1 1 A 100 100 LYS C C 189 176.866 175.564 1.302 1
1 1236 . 8 1 1 A 100 100 LYS CA C 189 56.800 55.389 1.411 1
1 1237 . 8 1 1 A 100 100 LYS CB C 189 33.400 34.761 -1.361 1
1 1241 . 8 1 1 A 100 100 LYS N N 189 128.581 126.799 1.782 1
1 1242 . 8 1 1 A 101 101 GLY H H 190 8.381 8.428 -0.047 1
1 1243 . 8 1 1 A 101 101 GLY HA2 H 190 3.946 3.990 -0.044 1
1 1244 . 8 1 1 A 101 101 GLY HA3 H 190 3.828 3.992 -0.164 1
1 1245 . 8 1 1 A 101 101 GLY C C 190 172.902 174.111 -1.209 1
1 1246 . 8 1 1 A 101 101 GLY CA C 190 44.920 45.789 -0.869 1
1 1247 . 8 1 1 A 101 101 GLY N N 190 111.183 112.907 -1.724 1
1 7 . 9 1 1 A 2 2 GLN H H 91 8.786 8.664 0.122 1
1 8 . 9 1 1 A 2 2 GLN HA H 91 4.005 3.862 0.143 1
1 15 . 9 1 1 A 2 2 GLN C C 91 177.270 177.417 -0.147 1
1 16 . 9 1 1 A 2 2 GLN CA C 91 58.220 59.292 -1.072 1
1 17 . 9 1 1 A 2 2 GLN CB C 91 28.650 28.578 0.072 1
1 19 . 9 1 1 A 2 2 GLN N N 91 121.993 127.059 -5.066 1
1 21 . 9 1 1 A 3 3 GLU H H 92 8.430 8.359 0.071 1
1 22 . 9 1 1 A 3 3 GLU HA H 92 4.007 4.076 -0.069 1
1 27 . 9 1 1 A 3 3 GLU C C 92 178.287 179.132 -0.845 1
1 28 . 9 1 1 A 3 3 GLU CA C 92 59.490 59.478 0.012 1
1 29 . 9 1 1 A 3 3 GLU CB C 92 29.506 29.311 0.195 1
1 31 . 9 1 1 A 3 3 GLU N N 92 120.195 119.624 0.571 1
1 32 . 9 1 1 A 4 4 SER H H 93 8.209 7.773 0.436 1
1 33 . 9 1 1 A 4 4 SER HA H 93 4.272 4.233 0.039 1
1 36 . 9 1 1 A 4 4 SER C C 93 177.369 176.389 0.980 1
1 37 . 9 1 1 A 4 4 SER CA C 93 61.044 62.242 -1.198 1
1 38 . 9 1 1 A 4 4 SER CB C 93 62.950 62.982 -0.032 1
1 39 . 9 1 1 A 4 4 SER N N 93 115.524 116.826 -1.302 1
1 40 . 9 1 1 A 5 5 ILE H H 94 8.080 7.719 0.361 1
1 41 . 9 1 1 A 5 5 ILE HA H 94 3.530 3.602 -0.072 1
1 51 . 9 1 1 A 5 5 ILE C C 94 177.778 177.759 0.019 1
1 52 . 9 1 1 A 5 5 ILE CA C 94 65.710 65.563 0.147 1
1 53 . 9 1 1 A 5 5 ILE CB C 94 37.800 37.734 0.066 1
1 57 . 9 1 1 A 5 5 ILE N N 94 124.148 121.544 2.604 1
1 58 . 9 1 1 A 6 6 GLN H H 95 8.374 8.009 0.365 1
1 59 . 9 1 1 A 6 6 GLN HA H 95 4.125 3.956 0.169 1
1 66 . 9 1 1 A 6 6 GLN C C 95 179.726 179.262 0.464 1
1 67 . 9 1 1 A 6 6 GLN CA C 95 59.190 58.994 0.196 1
1 68 . 9 1 1 A 6 6 GLN CB C 95 27.060 28.670 -1.610 1
1 70 . 9 1 1 A 6 6 GLN N N 95 118.257 118.092 0.165 1
1 72 . 9 1 1 A 7 7 ASN H H 96 8.456 8.047 0.409 1
1 73 . 9 1 1 A 7 7 ASN HA H 96 4.446 4.449 -0.003 1
1 78 . 9 1 1 A 7 7 ASN C C 96 177.257 178.426 -1.169 1
1 79 . 9 1 1 A 7 7 ASN CA C 96 56.020 56.338 -0.318 1
1 80 . 9 1 1 A 7 7 ASN CB C 96 38.126 37.910 0.216 1
1 81 . 9 1 1 A 7 7 ASN N N 96 118.597 118.240 0.357 1
1 83 . 9 1 1 A 8 8 LYS H H 97 7.732 7.839 -0.107 1
1 84 . 9 1 1 A 8 8 LYS HA H 97 4.129 4.115 0.014 1
1 93 . 9 1 1 A 8 8 LYS C C 97 179.143 179.734 -0.591 1
1 94 . 9 1 1 A 8 8 LYS CA C 97 59.126 59.897 -0.771 1
1 95 . 9 1 1 A 8 8 LYS CB C 97 32.070 32.519 -0.449 1
1 99 . 9 1 1 A 8 8 LYS N N 97 122.381 118.271 4.110 1
1 100 . 9 1 1 A 9 9 ILE H H 98 8.452 8.094 0.358 1
1 101 . 9 1 1 A 9 9 ILE HA H 98 3.480 3.903 -0.423 1
1 111 . 9 1 1 A 9 9 ILE C C 98 177.406 178.899 -1.493 1
1 112 . 9 1 1 A 9 9 ILE CA C 98 66.430 64.534 1.896 1
1 113 . 9 1 1 A 9 9 ILE CB C 98 37.980 36.878 1.102 1
1 117 . 9 1 1 A 9 9 ILE N N 98 119.950 120.847 -0.897 1
1 118 . 9 1 1 A 10 10 SER H H 99 7.924 7.955 -0.031 1
1 119 . 9 1 1 A 10 10 SER HA H 99 3.983 4.308 -0.325 1
1 122 . 9 1 1 A 10 10 SER C C 99 176.327 176.072 0.255 1
1 123 . 9 1 1 A 10 10 SER CA C 99 61.990 61.123 0.867 1
1 124 . 9 1 1 A 10 10 SER CB C 99 62.790 63.454 -0.664 1
1 125 . 9 1 1 A 10 10 SER N N 99 113.568 117.432 -3.864 1
1 126 . 9 1 1 A 11 11 GLN H H 100 7.832 7.815 0.017 1
1 127 . 9 1 1 A 11 11 GLN HA H 100 4.238 4.312 -0.074 1
1 134 . 9 1 1 A 11 11 GLN C C 100 178.088 177.926 0.162 1
1 135 . 9 1 1 A 11 11 GLN CA C 100 57.900 58.501 -0.601 1
1 136 . 9 1 1 A 11 11 GLN CB C 100 29.790 29.333 0.457 1
1 138 . 9 1 1 A 11 11 GLN N N 100 117.487 118.129 -0.642 1
1 140 . 9 1 1 A 12 12 CYS H H 101 7.920 8.426 -0.506 1
1 141 . 9 1 1 A 12 12 CYS HA H 101 4.657 4.514 0.143 1
1 144 . 9 1 1 A 12 12 CYS C C 101 175.439 174.852 0.587 1
1 145 . 9 1 1 A 12 12 CYS CA C 101 60.654 60.441 0.213 1
1 146 . 9 1 1 A 12 12 CYS CB C 101 29.310 26.990 2.320 1
1 147 . 9 1 1 A 12 12 CYS N N 101 114.221 117.878 -3.657 1
1 148 . 9 1 1 A 13 13 LYS H H 102 7.993 7.430 0.563 1
1 149 . 9 1 1 A 13 13 LYS HA H 102 5.038 4.474 0.564 1
1 158 . 9 1 1 A 13 13 LYS C C 102 174.757 176.232 -1.475 1
1 159 . 9 1 1 A 13 13 LYS CA C 102 56.660 56.025 0.635 1
1 160 . 9 1 1 A 13 13 LYS CB C 102 32.970 33.440 -0.470 1
1 164 . 9 1 1 A 13 13 LYS N N 102 123.841 119.814 4.027 1
1 165 . 9 1 1 A 14 14 PHE H H 103 8.822 8.707 0.115 1
1 166 . 9 1 1 A 14 14 PHE HA H 103 5.058 5.136 -0.078 1
1 174 . 9 1 1 A 14 14 PHE C C 103 173.560 173.471 0.089 1
1 175 . 9 1 1 A 14 14 PHE CA C 103 55.470 55.976 -0.506 1
1 176 . 9 1 1 A 14 14 PHE CB C 103 41.760 40.752 1.008 1
1 180 . 9 1 1 A 14 14 PHE N N 103 118.421 116.489 1.932 1
1 181 . 9 1 1 A 15 15 SER H H 104 8.826 8.494 0.332 1
1 182 . 9 1 1 A 15 15 SER HA H 104 4.602 4.887 -0.285 1
1 185 . 9 1 1 A 15 15 SER C C 104 173.851 173.570 0.281 1
1 186 . 9 1 1 A 15 15 SER CA C 104 58.610 57.763 0.847 1
1 187 . 9 1 1 A 15 15 SER CB C 104 62.690 62.497 0.193 1
1 188 . 9 1 1 A 15 15 SER N N 104 117.781 114.828 2.953 1
1 189 . 9 1 1 A 16 16 VAL H H 105 7.839 7.849 -0.010 1
1 190 . 9 1 1 A 16 16 VAL HA H 105 3.390 4.168 -0.778 1
1 198 . 9 1 1 A 16 16 VAL C C 105 174.987 175.087 -0.100 1
1 199 . 9 1 1 A 16 16 VAL CA C 105 63.650 62.573 1.077 1
1 200 . 9 1 1 A 16 16 VAL CB C 105 31.410 30.321 1.089 1
1 203 . 9 1 1 A 16 16 VAL N N 105 129.036 126.340 2.696 1
1 204 . 9 1 1 A 17 17 CYS H H 106 8.536 8.283 0.253 1
1 205 . 9 1 1 A 17 17 CYS HA H 106 5.011 4.941 0.070 1
1 208 . 9 1 1 A 17 17 CYS CA C 106 55.260 56.630 -1.370 1
1 209 . 9 1 1 A 17 17 CYS CB C 106 28.210 29.893 -1.683 1
1 210 . 9 1 1 A 17 17 CYS N N 106 130.045 127.033 3.012 1
1 211 . 9 1 1 A 18 18 PRO HA H 107 3.991 4.360 -0.369 1
1 218 . 9 1 1 A 18 18 PRO C C 107 178.188 178.425 -0.237 1
1 219 . 9 1 1 A 18 18 PRO CA C 107 65.940 64.787 1.153 1
1 220 . 9 1 1 A 18 18 PRO CB C 107 32.000 32.059 -0.059 1
1 223 . 9 1 1 A 19 19 GLU H H 108 9.260 8.986 0.274 1
1 224 . 9 1 1 A 19 19 GLU HA H 108 4.119 4.112 0.007 1
1 229 . 9 1 1 A 19 19 GLU C C 108 178.721 179.229 -0.508 1
1 230 . 9 1 1 A 19 19 GLU CA C 108 59.300 59.123 0.177 1
1 231 . 9 1 1 A 19 19 GLU CB C 108 28.920 28.846 0.074 1
1 233 . 9 1 1 A 19 19 GLU N N 108 118.270 116.624 1.646 1
1 234 . 9 1 1 A 20 20 ARG H H 109 7.672 7.976 -0.304 1
1 235 . 9 1 1 A 20 20 ARG HA H 109 4.331 4.129 0.202 1
1 242 . 9 1 1 A 20 20 ARG C C 109 177.977 178.741 -0.764 1
1 243 . 9 1 1 A 20 20 ARG CA C 109 57.350 59.182 -1.832 1
1 244 . 9 1 1 A 20 20 ARG CB C 109 30.820 30.312 0.508 1
1 247 . 9 1 1 A 20 20 ARG N N 109 118.357 119.690 -1.333 1
1 248 . 9 1 1 A 21 21 LEU H H 110 7.601 7.643 -0.042 1
1 249 . 9 1 1 A 21 21 LEU HA H 110 4.380 4.362 0.018 1
1 259 . 9 1 1 A 21 21 LEU C C 110 176.562 176.572 -0.010 1
1 260 . 9 1 1 A 21 21 LEU CA C 110 56.096 55.998 0.098 1
1 261 . 9 1 1 A 21 21 LEU CB C 110 44.016 42.316 1.700 1
1 265 . 9 1 1 A 21 21 LEU N N 110 118.626 119.054 -0.428 1
1 266 . 9 1 1 A 22 22 GLN H H 111 7.750 7.626 0.124 1
1 267 . 9 1 1 A 22 22 GLN HA H 111 3.870 3.888 -0.018 1
1 274 . 9 1 1 A 22 22 GLN C C 111 173.336 173.955 -0.619 1
1 275 . 9 1 1 A 22 22 GLN CA C 111 56.510 57.039 -0.529 1
1 276 . 9 1 1 A 22 22 GLN CB C 111 26.800 26.413 0.387 1
1 278 . 9 1 1 A 22 22 GLN N N 111 113.926 115.570 -1.644 1
1 280 . 9 1 1 A 23 23 CYS H H 112 7.407 7.585 -0.178 1
1 281 . 9 1 1 A 23 23 CYS HA H 112 4.469 4.712 -0.243 1
1 284 . 9 1 1 A 23 23 CYS CA C 112 52.650 56.393 -3.743 1
1 285 . 9 1 1 A 23 23 CYS CB C 112 29.750 28.931 0.819 1
1 286 . 9 1 1 A 23 23 CYS N N 112 112.681 117.425 -4.744 1
1 287 . 9 1 1 A 24 24 PRO HA H 113 4.408 4.508 -0.100 1
1 294 . 9 1 1 A 24 24 PRO C C 113 178.175 177.703 0.472 1
1 295 . 9 1 1 A 24 24 PRO CA C 113 62.040 62.600 -0.560 1
1 296 . 9 1 1 A 24 24 PRO CB C 113 31.920 32.516 -0.596 1
1 299 . 9 1 1 A 25 25 LEU H H 114 8.593 8.822 -0.229 1
1 300 . 9 1 1 A 25 25 LEU HA H 114 3.765 4.056 -0.291 1
1 310 . 9 1 1 A 25 25 LEU C C 114 179.950 178.632 1.318 1
1 311 . 9 1 1 A 25 25 LEU CA C 114 57.674 58.148 -0.474 1
1 312 . 9 1 1 A 25 25 LEU CB C 114 40.690 41.441 -0.751 1
1 316 . 9 1 1 A 25 25 LEU N N 114 123.729 124.306 -0.577 1
1 317 . 9 1 1 A 26 26 GLU H H 115 9.108 8.217 0.891 1
1 318 . 9 1 1 A 26 26 GLU HA H 115 3.876 4.027 -0.151 1
1 323 . 9 1 1 A 26 26 GLU C C 115 177.505 178.875 -1.370 1
1 324 . 9 1 1 A 26 26 GLU CA C 115 59.410 59.417 -0.007 1
1 325 . 9 1 1 A 26 26 GLU CB C 115 28.460 28.990 -0.530 1
1 327 . 9 1 1 A 26 26 GLU N N 115 116.817 118.154 -1.337 1
1 328 . 9 1 1 A 27 27 ALA H H 116 7.360 7.267 0.093 1
1 329 . 9 1 1 A 27 27 ALA HA H 116 4.408 4.060 0.348 1
1 333 . 9 1 1 A 27 27 ALA C C 116 177.046 178.057 -1.011 1
1 334 . 9 1 1 A 27 27 ALA CA C 116 52.970 54.386 -1.416 1
1 335 . 9 1 1 A 27 27 ALA CB C 116 19.916 17.944 1.972 1
1 336 . 9 1 1 A 27 27 ALA N N 116 118.966 121.088 -2.122 1
1 337 . 9 1 1 A 28 28 ILE H H 117 7.168 7.115 0.053 1
1 338 . 9 1 1 A 28 28 ILE HA H 117 4.432 4.788 -0.356 1
1 348 . 9 1 1 A 28 28 ILE C C 117 172.641 175.422 -2.781 1
1 349 . 9 1 1 A 28 28 ILE CA C 117 59.980 60.196 -0.216 1
1 350 . 9 1 1 A 28 28 ILE CB C 117 37.350 37.948 -0.598 1
1 354 . 9 1 1 A 28 28 ILE N N 117 108.913 108.392 0.521 1
1 355 . 9 1 1 A 29 29 GLN H H 118 6.562 7.355 -0.793 1
1 356 . 9 1 1 A 29 29 GLN HA H 118 3.922 4.251 -0.329 1
1 363 . 9 1 1 A 29 29 GLN C C 118 175.049 175.420 -0.371 1
1 364 . 9 1 1 A 29 29 GLN CA C 118 54.596 55.909 -1.313 1
1 365 . 9 1 1 A 29 29 GLN CB C 118 29.570 29.282 0.288 1
1 367 . 9 1 1 A 29 29 GLN N N 118 116.455 123.112 -6.657 1
1 369 . 9 1 1 A 30 30 CYS H H 119 8.138 8.386 -0.248 1
1 370 . 9 1 1 A 30 30 CYS HA H 119 4.580 4.542 0.038 1
1 373 . 9 1 1 A 30 30 CYS CA C 119 57.810 57.609 0.201 1
1 374 . 9 1 1 A 30 30 CYS CB C 119 30.200 28.752 1.448 1
1 375 . 9 1 1 A 30 30 CYS N N 119 134.136 125.621 8.515 1
1 376 . 9 1 1 A 31 31 PRO HA H 120 4.424 4.339 0.085 1
1 383 . 9 1 1 A 31 31 PRO C C 120 177.431 178.913 -1.482 1
1 384 . 9 1 1 A 31 31 PRO CA C 120 64.060 65.216 -1.156 1
1 385 . 9 1 1 A 31 31 PRO CB C 120 32.776 32.141 0.635 1
1 388 . 9 1 1 A 32 32 ILE H H 121 11.318 7.702 3.616 1
1 389 . 9 1 1 A 32 32 ILE HA H 121 4.038 3.938 0.100 1
1 399 . 9 1 1 A 32 32 ILE C C 121 178.485 177.480 1.005 1
1 400 . 9 1 1 A 32 32 ILE CA C 121 64.060 64.145 -0.085 1
1 401 . 9 1 1 A 32 32 ILE CB C 121 39.340 38.221 1.119 1
1 405 . 9 1 1 A 32 32 ILE N N 121 124.500 116.765 7.735 1
1 406 . 9 1 1 A 33 33 THR H H 122 9.928 7.331 2.597 1
1 407 . 9 1 1 A 33 33 THR HA H 122 4.048 4.470 -0.422 1
1 412 . 9 1 1 A 33 33 THR C C 122 175.793 174.455 1.338 1
1 413 . 9 1 1 A 33 33 THR CA C 122 62.990 61.390 1.600 1
1 414 . 9 1 1 A 33 33 THR CB C 122 70.300 69.051 1.249 1
1 416 . 9 1 1 A 33 33 THR N N 122 115.136 108.519 6.617 1
1 417 . 9 1 1 A 34 34 LEU H H 123 8.439 7.719 0.720 1
1 418 . 9 1 1 A 34 34 LEU HA H 123 3.912 4.001 -0.089 1
1 428 . 9 1 1 A 34 34 LEU C C 123 175.495 175.454 0.041 1
1 429 . 9 1 1 A 34 34 LEU CA C 123 56.290 55.950 0.340 1
1 430 . 9 1 1 A 34 34 LEU CB C 123 38.500 39.731 -1.231 1
1 434 . 9 1 1 A 34 34 LEU N N 123 117.230 121.223 -3.993 1
1 435 . 9 1 1 A 35 35 GLU H H 124 7.816 7.455 0.361 1
1 436 . 9 1 1 A 35 35 GLU HA H 124 4.634 4.597 0.037 1
1 441 . 9 1 1 A 35 35 GLU C C 124 174.838 174.068 0.770 1
1 442 . 9 1 1 A 35 35 GLU CA C 124 53.780 54.789 -1.009 1
1 443 . 9 1 1 A 35 35 GLU CB C 124 33.710 31.840 1.870 1
1 445 . 9 1 1 A 35 35 GLU N N 124 116.577 116.303 0.274 1
1 446 . 9 1 1 A 36 36 GLN H H 125 8.532 8.554 -0.022 1
1 447 . 9 1 1 A 36 36 GLN HA H 125 4.958 4.380 0.578 1
1 454 . 9 1 1 A 36 36 GLN CA C 125 53.350 53.922 -0.572 1
1 455 . 9 1 1 A 36 36 GLN CB C 125 29.950 29.957 -0.007 1
1 457 . 9 1 1 A 36 36 GLN N N 125 123.034 121.488 1.546 1
1 459 . 9 1 1 A 37 37 PRO HA H 126 4.458 4.441 0.017 1
1 466 . 9 1 1 A 37 37 PRO C C 126 176.314 177.254 -0.940 1
1 467 . 9 1 1 A 37 37 PRO CA C 126 62.816 65.934 -3.118 1
1 468 . 9 1 1 A 37 37 PRO CB C 126 33.070 31.539 1.531 1
1 471 . 9 1 1 A 38 38 GLU H H 127 8.626 8.097 0.529 1
1 472 . 9 1 1 A 38 38 GLU HA H 127 4.274 4.608 -0.334 1
1 477 . 9 1 1 A 38 38 GLU C C 127 177.809 174.880 2.929 1
1 478 . 9 1 1 A 38 38 GLU CA C 127 58.730 58.274 0.456 1
1 479 . 9 1 1 A 38 38 GLU CB C 127 30.340 29.423 0.917 1
1 481 . 9 1 1 A 38 38 GLU N N 127 120.691 119.254 1.437 1
1 482 . 9 1 1 A 39 39 LYS H H 128 7.891 7.761 0.130 1
1 483 . 9 1 1 A 39 39 LYS HA H 128 4.870 4.756 0.114 1
1 492 . 9 1 1 A 39 39 LYS C C 128 175.452 175.921 -0.469 1
1 493 . 9 1 1 A 39 39 LYS CA C 128 53.540 54.699 -1.159 1
1 494 . 9 1 1 A 39 39 LYS CB C 128 33.630 34.822 -1.192 1
1 498 . 9 1 1 A 39 39 LYS N N 128 118.149 118.445 -0.296 1
1 499 . 9 1 1 A 40 40 GLY H H 129 8.524 8.060 0.464 1
1 500 . 9 1 1 A 40 40 GLY HA2 H 129 4.973 4.097 0.876 1
1 501 . 9 1 1 A 40 40 GLY HA3 H 129 2.459 4.223 -1.764 1
1 502 . 9 1 1 A 40 40 GLY C C 129 169.943 171.916 -1.973 1
1 503 . 9 1 1 A 40 40 GLY CA C 129 42.910 45.270 -2.360 1
1 504 . 9 1 1 A 40 40 GLY N N 129 112.845 110.588 2.257 1
1 505 . 9 1 1 A 41 41 ILE H H 130 8.659 8.109 0.550 1
1 506 . 9 1 1 A 41 41 ILE HA H 130 4.591 4.838 -0.247 1
1 516 . 9 1 1 A 41 41 ILE C C 130 172.586 174.159 -1.573 1
1 517 . 9 1 1 A 41 41 ILE CA C 130 58.090 58.794 -0.704 1
1 518 . 9 1 1 A 41 41 ILE CB C 130 43.320 41.870 1.450 1
1 522 . 9 1 1 A 41 41 ILE N N 130 114.060 119.218 -5.158 1
1 523 . 9 1 1 A 42 42 PHE H H 131 9.206 8.687 0.519 1
1 524 . 9 1 1 A 42 42 PHE HA H 131 5.159 4.727 0.432 1
1 532 . 9 1 1 A 42 42 PHE C C 131 174.931 175.835 -0.904 1
1 533 . 9 1 1 A 42 42 PHE CA C 131 57.790 58.126 -0.336 1
1 534 . 9 1 1 A 42 42 PHE CB C 131 42.220 38.966 3.254 1
1 538 . 9 1 1 A 42 42 PHE N N 131 126.002 128.452 -2.450 1
1 539 . 9 1 1 A 43 43 VAL H H 132 8.502 8.976 -0.474 1
1 540 . 9 1 1 A 43 43 VAL HA H 132 4.921 4.763 0.158 1
1 548 . 9 1 1 A 43 43 VAL C C 132 178.219 175.491 2.728 1
1 549 . 9 1 1 A 43 43 VAL CA C 132 59.600 60.151 -0.551 1
1 550 . 9 1 1 A 43 43 VAL CB C 132 35.920 35.643 0.277 1
1 553 . 9 1 1 A 43 43 VAL N N 132 119.068 123.072 -4.004 1
1 554 . 9 1 1 A 44 44 LYS H H 133 10.036 8.751 1.285 1
1 555 . 9 1 1 A 44 44 LYS HA H 133 5.070 4.290 0.780 1
1 564 . 9 1 1 A 44 44 LYS C C 133 177.276 177.751 -0.475 1
1 565 . 9 1 1 A 44 44 LYS CA C 133 56.720 57.402 -0.682 1
1 566 . 9 1 1 A 44 44 LYS CB C 133 34.410 32.799 1.611 1
1 570 . 9 1 1 A 44 44 LYS N N 133 130.934 125.460 5.474 1
1 571 . 9 1 1 A 45 45 ASN H H 134 8.093 8.834 -0.741 1
1 572 . 9 1 1 A 45 45 ASN HA H 134 4.152 4.718 -0.566 1
1 577 . 9 1 1 A 45 45 ASN C C 134 174.087 175.153 -1.066 1
1 578 . 9 1 1 A 45 45 ASN CA C 134 55.360 55.911 -0.551 1
1 579 . 9 1 1 A 45 45 ASN CB C 134 37.530 39.188 -1.658 1
1 580 . 9 1 1 A 45 45 ASN N N 134 117.963 123.197 -5.234 1
1 582 . 9 1 1 A 46 46 SER H H 135 7.524 7.847 -0.323 1
1 583 . 9 1 1 A 46 46 SER HA H 135 4.219 4.720 -0.501 1
1 586 . 9 1 1 A 46 46 SER C C 135 174.490 174.349 0.141 1
1 587 . 9 1 1 A 46 46 SER CA C 135 57.090 55.563 1.527 1
1 588 . 9 1 1 A 46 46 SER CB C 135 63.860 66.758 -2.898 1
1 589 . 9 1 1 A 46 46 SER N N 135 105.939 109.119 -3.180 1
1 590 . 9 1 1 A 47 47 ASP H H 136 9.113 9.002 0.111 1
1 591 . 9 1 1 A 47 47 ASP HA H 136 4.220 4.251 -0.031 1
1 594 . 9 1 1 A 47 47 ASP CA C 136 57.610 57.140 0.470 1
1 595 . 9 1 1 A 47 47 ASP CB C 136 40.810 40.694 0.116 1
1 596 . 9 1 1 A 47 47 ASP N N 136 120.995 123.292 -2.297 1
1 597 . 9 1 1 A 48 48 GLY H H 137 8.181 8.064 0.117 1
1 598 . 9 1 1 A 48 48 GLY HA2 H 137 4.120 3.949 0.171 1
1 599 . 9 1 1 A 48 48 GLY HA3 H 137 3.659 3.950 -0.291 1
1 600 . 9 1 1 A 48 48 GLY C C 137 174.062 174.763 -0.701 1
1 601 . 9 1 1 A 48 48 GLY CA C 137 45.130 47.388 -2.258 1
1 602 . 9 1 1 A 48 48 GLY N N 137 106.197 107.427 -1.230 1
1 603 . 9 1 1 A 49 49 SER H H 138 7.179 7.994 -0.815 1
1 604 . 9 1 1 A 49 49 SER HA H 138 4.383 4.544 -0.161 1
1 607 . 9 1 1 A 49 49 SER C C 138 173.864 174.270 -0.406 1
1 608 . 9 1 1 A 49 49 SER CA C 138 57.614 59.028 -1.414 1
1 609 . 9 1 1 A 49 49 SER CB C 138 65.100 64.257 0.843 1
1 610 . 9 1 1 A 49 49 SER N N 138 115.015 116.252 -1.237 1
1 611 . 9 1 1 A 50 50 ASP H H 139 8.078 8.926 -0.848 1
1 612 . 9 1 1 A 50 50 ASP HA H 139 4.642 4.717 -0.075 1
1 615 . 9 1 1 A 50 50 ASP C C 139 174.261 174.495 -0.234 1
1 616 . 9 1 1 A 50 50 ASP CA C 139 52.406 53.923 -1.517 1
1 617 . 9 1 1 A 50 50 ASP CB C 139 40.254 38.907 1.347 1
1 618 . 9 1 1 A 50 50 ASP N N 139 122.400 124.569 -2.169 1
1 619 . 9 1 1 A 51 51 VAL H H 140 8.111 7.835 0.276 1
1 620 . 9 1 1 A 51 51 VAL HA H 140 4.360 4.684 -0.324 1
1 628 . 9 1 1 A 51 51 VAL C C 140 176.147 174.033 2.114 1
1 629 . 9 1 1 A 51 51 VAL CA C 140 62.670 60.546 2.124 1
1 630 . 9 1 1 A 51 51 VAL CB C 140 33.930 33.721 0.209 1
1 632 . 9 1 1 A 51 51 VAL N N 140 120.374 120.275 0.099 1
1 633 . 9 1 1 A 52 52 CYS H H 141 8.358 9.043 -0.685 1
1 634 . 9 1 1 A 52 52 CYS HA H 141 4.957 5.140 -0.183 1
1 637 . 9 1 1 A 52 52 CYS C C 141 173.070 173.451 -0.381 1
1 638 . 9 1 1 A 52 52 CYS CA C 141 53.380 55.456 -2.076 1
1 639 . 9 1 1 A 52 52 CYS CB C 141 46.110 44.056 2.054 1
1 640 . 9 1 1 A 52 52 CYS N N 141 121.305 129.053 -7.748 1
1 641 . 9 1 1 A 53 53 THR H H 142 8.929 8.728 0.201 1
1 642 . 9 1 1 A 53 53 THR HA H 142 4.498 4.759 -0.261 1
1 648 . 9 1 1 A 53 53 THR C C 142 172.151 172.479 -0.328 1
1 649 . 9 1 1 A 53 53 THR CA C 142 62.960 61.387 1.573 1
1 650 . 9 1 1 A 53 53 THR CB C 142 70.540 72.327 -1.787 1
1 652 . 9 1 1 A 53 53 THR N N 142 120.105 119.337 0.768 1
1 653 . 9 1 1 A 54 54 LEU H H 143 8.448 8.701 -0.253 1
1 654 . 9 1 1 A 54 54 LEU HA H 143 4.322 4.792 -0.470 1
1 664 . 9 1 1 A 54 54 LEU C C 143 174.484 174.544 -0.060 1
1 665 . 9 1 1 A 54 54 LEU CA C 143 54.596 53.270 1.326 1
1 666 . 9 1 1 A 54 54 LEU CB C 143 42.396 43.348 -0.952 1
1 670 . 9 1 1 A 54 54 LEU N N 143 128.819 129.226 -0.407 1
1 671 . 9 1 1 A 55 55 PHE H H 144 8.661 8.580 0.081 1
1 672 . 9 1 1 A 55 55 PHE HA H 144 5.459 4.921 0.538 1
1 680 . 9 1 1 A 55 55 PHE C C 144 176.035 174.911 1.124 1
1 681 . 9 1 1 A 55 55 PHE CA C 144 55.020 56.888 -1.868 1
1 682 . 9 1 1 A 55 55 PHE CB C 144 44.100 42.221 1.879 1
1 686 . 9 1 1 A 55 55 PHE N N 144 121.897 126.582 -4.685 1
1 687 . 9 1 1 A 56 56 ASP H H 145 11.616 8.578 3.038 1
1 688 . 9 1 1 A 56 56 ASP HA H 145 4.417 4.706 -0.289 1
1 691 . 9 1 1 A 56 56 ASP C C 145 176.748 177.270 -0.522 1
1 692 . 9 1 1 A 56 56 ASP CA C 145 55.844 54.111 1.733 1
1 693 . 9 1 1 A 56 56 ASP CB C 145 44.390 42.992 1.398 1
1 694 . 9 1 1 A 56 56 ASP N N 145 122.131 121.424 0.707 1
1 695 . 9 1 1 A 57 57 ALA H H 146 8.508 9.122 -0.614 1
1 696 . 9 1 1 A 57 57 ALA HA H 146 3.797 4.061 -0.264 1
1 700 . 9 1 1 A 57 57 ALA C C 146 178.696 180.122 -1.426 1
1 701 . 9 1 1 A 57 57 ALA CA C 146 55.990 55.372 0.618 1
1 702 . 9 1 1 A 57 57 ALA CB C 146 18.840 18.077 0.763 1
1 703 . 9 1 1 A 57 57 ALA N N 146 130.243 128.646 1.597 1
1 704 . 9 1 1 A 58 58 ALA H H 147 8.378 7.788 0.590 1
1 705 . 9 1 1 A 58 58 ALA HA H 147 4.078 4.124 -0.046 1
1 709 . 9 1 1 A 58 58 ALA C C 147 181.091 179.510 1.581 1
1 710 . 9 1 1 A 58 58 ALA CA C 147 54.770 55.137 -0.367 1
1 711 . 9 1 1 A 58 58 ALA CB C 147 17.700 18.716 -1.016 1
1 712 . 9 1 1 A 58 58 ALA N N 147 121.997 119.669 2.328 1
1 713 . 9 1 1 A 59 59 ALA H H 148 9.138 7.951 1.187 1
1 714 . 9 1 1 A 59 59 ALA HA H 148 3.975 4.067 -0.092 1
1 718 . 9 1 1 A 59 59 ALA C C 148 180.508 180.029 0.479 1
1 719 . 9 1 1 A 59 59 ALA CA C 148 54.840 55.038 -0.198 1
1 720 . 9 1 1 A 59 59 ALA CB C 148 18.600 18.591 0.009 1
1 721 . 9 1 1 A 59 59 ALA N N 148 123.595 120.743 2.852 1
1 722 . 9 1 1 A 60 60 PHE H H 149 8.814 8.091 0.723 1
1 723 . 9 1 1 A 60 60 PHE HA H 149 3.722 3.947 -0.225 1
1 731 . 9 1 1 A 60 60 PHE C C 149 176.773 177.502 -0.729 1
1 732 . 9 1 1 A 60 60 PHE CA C 149 62.030 61.430 0.600 1
1 733 . 9 1 1 A 60 60 PHE CB C 149 39.960 38.883 1.077 1
1 737 . 9 1 1 A 60 60 PHE N N 149 120.354 120.027 0.327 1
1 738 . 9 1 1 A 61 61 SER H H 150 8.276 8.144 0.132 1
1 739 . 9 1 1 A 61 61 SER HA H 150 3.880 4.020 -0.140 1
1 742 . 9 1 1 A 61 61 SER C C 150 177.691 176.487 1.204 1
1 743 . 9 1 1 A 61 61 SER CA C 150 62.190 61.492 0.698 1
1 744 . 9 1 1 A 61 61 SER CB C 150 63.016 62.891 0.125 1
1 745 . 9 1 1 A 61 61 SER N N 150 112.086 114.225 -2.139 1
1 746 . 9 1 1 A 62 62 ARG H H 151 7.829 7.860 -0.031 1
1 747 . 9 1 1 A 62 62 ARG HA H 151 3.971 4.028 -0.057 1
1 754 . 9 1 1 A 62 62 ARG C C 151 178.287 178.315 -0.028 1
1 755 . 9 1 1 A 62 62 ARG CA C 151 59.340 58.762 0.578 1
1 756 . 9 1 1 A 62 62 ARG CB C 151 29.760 30.100 -0.340 1
1 759 . 9 1 1 A 62 62 ARG N N 151 121.090 119.210 1.880 1
1 760 . 9 1 1 A 63 63 LEU H H 152 7.390 7.632 -0.242 1
1 761 . 9 1 1 A 63 63 LEU HA H 152 3.791 3.920 -0.129 1
1 771 . 9 1 1 A 63 63 LEU C C 152 179.106 178.113 0.993 1
1 772 . 9 1 1 A 63 63 LEU CA C 152 58.900 58.188 0.712 1
1 773 . 9 1 1 A 63 63 LEU CB C 152 41.140 41.318 -0.178 1
1 777 . 9 1 1 A 63 63 LEU N N 152 121.129 122.123 -0.994 1
1 778 . 9 1 1 A 64 64 VAL H H 153 7.552 7.948 -0.396 1
1 779 . 9 1 1 A 64 64 VAL HA H 153 3.411 3.474 -0.063 1
1 787 . 9 1 1 A 64 64 VAL C C 153 180.595 179.040 1.555 1
1 788 . 9 1 1 A 64 64 VAL CA C 153 65.644 66.055 -0.411 1
1 789 . 9 1 1 A 64 64 VAL CB C 153 31.410 31.292 0.118 1
1 792 . 9 1 1 A 64 64 VAL N N 153 118.280 118.898 -0.618 1
1 793 . 9 1 1 A 65 65 GLY H H 154 8.061 8.282 -0.221 1
1 794 . 9 1 1 A 65 65 GLY HA2 H 154 3.846 3.853 -0.007 1
1 795 . 9 1 1 A 65 65 GLY HA3 H 154 3.809 3.854 -0.045 1
1 796 . 9 1 1 A 65 65 GLY C C 154 175.235 175.028 0.207 1
1 797 . 9 1 1 A 65 65 GLY CA C 154 46.630 46.675 -0.045 1
1 798 . 9 1 1 A 65 65 GLY N N 154 108.622 107.926 0.696 1
1 799 . 9 1 1 A 66 66 GLU H H 155 7.528 7.334 0.194 1
1 800 . 9 1 1 A 66 66 GLU HA H 155 4.228 4.367 -0.139 1
1 805 . 9 1 1 A 66 66 GLU C C 155 176.761 177.104 -0.343 1
1 806 . 9 1 1 A 66 66 GLU CA C 155 56.590 56.162 0.428 1
1 807 . 9 1 1 A 66 66 GLU CB C 155 30.490 30.618 -0.128 1
1 809 . 9 1 1 A 66 66 GLU N N 155 118.361 118.134 0.227 1
1 810 . 9 1 1 A 67 67 GLY H H 156 7.884 7.788 0.096 1
1 811 . 9 1 1 A 67 67 GLY HA2 H 156 3.918 3.900 0.018 1
1 812 . 9 1 1 A 67 67 GLY HA3 H 156 3.747 3.917 -0.170 1
1 813 . 9 1 1 A 67 67 GLY C C 156 174.788 174.688 0.100 1
1 814 . 9 1 1 A 67 67 GLY CA C 156 45.890 46.451 -0.561 1
1 815 . 9 1 1 A 67 67 GLY N N 156 108.465 109.784 -1.319 1
1 816 . 9 1 1 A 68 68 LEU H H 157 7.332 7.681 -0.349 1
1 817 . 9 1 1 A 68 68 LEU HA H 157 4.361 4.652 -0.291 1
1 827 . 9 1 1 A 68 68 LEU CA C 157 53.060 51.731 1.329 1
1 828 . 9 1 1 A 68 68 LEU CB C 157 41.100 41.843 -0.743 1
1 832 . 9 1 1 A 68 68 LEU N N 157 121.920 121.772 0.148 1
1 833 . 9 1 1 A 69 69 PRO HA H 158 4.485 4.606 -0.121 1
1 840 . 9 1 1 A 69 69 PRO C C 158 174.602 176.352 -1.750 1
1 841 . 9 1 1 A 69 69 PRO CA C 158 61.556 62.312 -0.756 1
1 842 . 9 1 1 A 69 69 PRO CB C 158 32.370 32.561 -0.191 1
1 845 . 9 1 1 A 70 70 HIS H H 159 8.734 8.629 0.105 1
1 846 . 9 1 1 A 70 70 HIS HA H 159 3.947 4.652 -0.705 1
1 852 . 9 1 1 A 70 70 HIS CA C 159 56.250 55.195 1.055 1
1 853 . 9 1 1 A 70 70 HIS CB C 159 32.280 31.105 1.175 1
1 856 . 9 1 1 A 70 70 HIS N N 159 119.423 121.792 -2.369 1
1 857 . 9 1 1 A 71 71 PRO HA H 160 4.424 4.258 0.166 1
1 864 . 9 1 1 A 71 71 PRO C C 160 177.567 177.946 -0.379 1
1 865 . 9 1 1 A 71 71 PRO CA C 160 64.574 65.238 -0.664 1
1 866 . 9 1 1 A 71 71 PRO CB C 160 32.340 31.927 0.413 1
1 869 . 9 1 1 A 72 72 LEU H H 161 10.123 7.959 2.164 1
1 870 . 9 1 1 A 72 72 LEU HA H 161 4.778 4.366 0.412 1
1 880 . 9 1 1 A 72 72 LEU C C 161 178.721 177.467 1.254 1
1 881 . 9 1 1 A 72 72 LEU CA C 161 55.800 57.171 -1.371 1
1 882 . 9 1 1 A 72 72 LEU CB C 161 42.440 43.866 -1.426 1
1 886 . 9 1 1 A 72 72 LEU N N 161 117.374 117.054 0.320 1
1 887 . 9 1 1 A 73 73 THR H H 162 7.523 7.835 -0.312 1
1 888 . 9 1 1 A 73 73 THR HA H 162 4.291 4.568 -0.277 1
1 893 . 9 1 1 A 73 73 THR C C 162 175.557 174.434 1.123 1
1 894 . 9 1 1 A 73 73 THR CA C 162 61.440 62.365 -0.925 1
1 895 . 9 1 1 A 73 73 THR CB C 162 70.500 70.147 0.353 1
1 897 . 9 1 1 A 73 73 THR N N 162 107.787 112.294 -4.507 1
1 898 . 9 1 1 A 74 74 ARG H H 163 8.361 8.001 0.360 1
1 899 . 9 1 1 A 74 74 ARG HA H 163 3.836 4.233 -0.397 1
1 906 . 9 1 1 A 74 74 ARG C C 163 174.701 175.160 -0.459 1
1 907 . 9 1 1 A 74 74 ARG CA C 163 57.980 57.627 0.353 1
1 908 . 9 1 1 A 74 74 ARG CB C 163 26.770 26.995 -0.225 1
1 911 . 9 1 1 A 74 74 ARG N N 163 115.130 119.017 -3.887 1
1 912 . 9 1 1 A 75 75 GLU H H 164 7.430 8.095 -0.665 1
1 913 . 9 1 1 A 75 75 GLU HA H 164 4.636 4.500 0.136 1
1 918 . 9 1 1 A 75 75 GLU CA C 164 53.699 54.976 -1.277 1
1 919 . 9 1 1 A 75 75 GLU CB C 164 29.550 28.480 1.070 1
1 921 . 9 1 1 A 75 75 GLU N N 164 120.076 119.028 1.048 1
1 922 . 9 1 1 A 76 76 PRO HA H 165 4.272 4.616 -0.344 1
1 929 . 9 1 1 A 76 76 PRO C C 165 176.649 176.904 -0.255 1
1 930 . 9 1 1 A 76 76 PRO CA C 165 63.204 62.965 0.239 1
1 931 . 9 1 1 A 76 76 PRO CB C 165 31.680 31.563 0.117 1
1 934 . 9 1 1 A 77 77 ILE H H 166 8.812 8.220 0.592 1
1 935 . 9 1 1 A 77 77 ILE HA H 166 3.838 4.313 -0.475 1
1 945 . 9 1 1 A 77 77 ILE C C 166 175.235 175.867 -0.632 1
1 946 . 9 1 1 A 77 77 ILE CA C 166 62.816 61.220 1.596 1
1 947 . 9 1 1 A 77 77 ILE CB C 166 37.750 37.177 0.573 1
1 951 . 9 1 1 A 77 77 ILE N N 166 123.831 124.075 -0.244 1
1 952 . 9 1 1 A 78 78 THR H H 167 6.625 8.588 -1.963 1
1 953 . 9 1 1 A 78 78 THR HA H 167 4.632 5.043 -0.411 1
1 958 . 9 1 1 A 78 78 THR C C 167 174.143 174.655 -0.512 1
1 959 . 9 1 1 A 78 78 THR CA C 167 58.750 59.849 -1.099 1
1 960 . 9 1 1 A 78 78 THR CB C 167 71.320 71.360 -0.040 1
1 962 . 9 1 1 A 78 78 THR N N 167 115.293 118.942 -3.649 1
1 963 . 9 1 1 A 79 79 ALA H H 168 9.088 8.951 0.137 1
1 964 . 9 1 1 A 79 79 ALA HA H 168 3.916 4.145 -0.229 1
1 968 . 9 1 1 A 79 79 ALA C C 168 179.770 179.488 0.282 1
1 969 . 9 1 1 A 79 79 ALA CA C 168 55.480 54.800 0.680 1
1 970 . 9 1 1 A 79 79 ALA CB C 168 17.630 18.321 -0.691 1
1 971 . 9 1 1 A 79 79 ALA N N 168 122.102 127.337 -5.235 1
1 972 . 9 1 1 A 80 80 SER H H 169 7.988 7.608 0.380 1
1 973 . 9 1 1 A 80 80 SER HA H 169 4.091 4.199 -0.108 1
1 976 . 9 1 1 A 80 80 SER C C 169 175.836 176.605 -0.769 1
1 977 . 9 1 1 A 80 80 SER CA C 169 60.750 61.460 -0.710 1
1 978 . 9 1 1 A 80 80 SER CB C 169 62.510 63.102 -0.592 1
1 979 . 9 1 1 A 80 80 SER N N 169 109.660 113.320 -3.660 1
1 980 . 9 1 1 A 81 81 ILE H H 170 7.052 7.634 -0.582 1
1 981 . 9 1 1 A 81 81 ILE HA H 170 4.344 4.081 0.263 1
1 991 . 9 1 1 A 81 81 ILE C C 170 174.236 176.537 -2.301 1
1 992 . 9 1 1 A 81 81 ILE CA C 170 61.760 63.863 -2.103 1
1 993 . 9 1 1 A 81 81 ILE CB C 170 37.950 37.663 0.287 1
1 997 . 9 1 1 A 81 81 ILE N N 170 112.623 113.951 -1.328 1
1 998 . 9 1 1 A 82 82 ILE H H 171 7.345 7.600 -0.255 1
1 999 . 9 1 1 A 82 82 ILE HA H 171 4.288 4.017 0.271 1
1 1009 . 9 1 1 A 82 82 ILE C C 171 174.931 175.255 -0.324 1
1 1010 . 9 1 1 A 82 82 ILE CA C 171 61.420 61.777 -0.357 1
1 1011 . 9 1 1 A 82 82 ILE CB C 171 37.230 37.947 -0.717 1
1 1015 . 9 1 1 A 82 82 ILE N N 171 124.260 125.059 -0.799 1
1 1016 . 9 1 1 A 83 83 VAL H H 172 7.843 8.791 -0.948 1
1 1017 . 9 1 1 A 83 83 VAL HA H 172 4.818 5.084 -0.266 1
1 1025 . 9 1 1 A 83 83 VAL C C 172 174.918 175.526 -0.608 1
1 1026 . 9 1 1 A 83 83 VAL CA C 172 58.910 59.318 -0.408 1
1 1027 . 9 1 1 A 83 83 VAL CB C 172 34.570 34.986 -0.416 1
1 1030 . 9 1 1 A 83 83 VAL N N 172 118.856 121.908 -3.052 1
1 1031 . 9 1 1 A 84 84 LYS H H 173 8.347 8.748 -0.401 1
1 1032 . 9 1 1 A 84 84 LYS HA H 173 4.356 4.633 -0.277 1
1 1041 . 9 1 1 A 84 84 LYS C C 173 178.653 178.461 0.192 1
1 1042 . 9 1 1 A 84 84 LYS CA C 173 56.360 55.218 1.142 1
1 1043 . 9 1 1 A 84 84 LYS CB C 173 33.366 33.823 -0.457 1
1 1047 . 9 1 1 A 84 84 LYS N N 173 119.602 121.543 -1.941 1
1 1048 . 9 1 1 A 85 85 HIS H H 174 9.143 9.008 0.135 1
1 1049 . 9 1 1 A 85 85 HIS HA H 174 4.013 4.293 -0.280 1
1 1053 . 9 1 1 A 85 85 HIS C C 174 176.606 177.210 -0.604 1
1 1054 . 9 1 1 A 85 85 HIS CA C 174 58.820 60.057 -1.237 1
1 1055 . 9 1 1 A 85 85 HIS CB C 174 28.186 29.709 -1.523 1
1 1057 . 9 1 1 A 85 85 HIS N N 174 120.022 122.392 -2.370 1
1 1058 . 9 1 1 A 86 86 GLU H H 175 8.403 8.450 -0.047 1
1 1059 . 9 1 1 A 86 86 GLU HA H 175 3.863 3.929 -0.066 1
1 1064 . 9 1 1 A 86 86 GLU C C 175 177.040 179.071 -2.031 1
1 1065 . 9 1 1 A 86 86 GLU CA C 175 57.830 59.389 -1.559 1
1 1066 . 9 1 1 A 86 86 GLU CB C 175 28.690 28.920 -0.230 1
1 1068 . 9 1 1 A 86 86 GLU N N 175 116.124 118.158 -2.034 1
1 1069 . 9 1 1 A 87 87 GLU H H 176 7.669 7.986 -0.317 1
1 1070 . 9 1 1 A 87 87 GLU HA H 176 4.039 4.676 -0.637 1
1 1075 . 9 1 1 A 87 87 GLU C C 176 175.688 175.671 0.017 1
1 1076 . 9 1 1 A 87 87 GLU CA C 176 57.906 58.115 -0.209 1
1 1077 . 9 1 1 A 87 87 GLU CB C 176 30.430 29.349 1.081 1
1 1079 . 9 1 1 A 87 87 GLU N N 176 116.183 117.112 -0.929 1
1 1080 . 9 1 1 A 88 88 CYS H H 177 6.750 7.091 -0.341 1
1 1081 . 9 1 1 A 88 88 CYS HA H 177 4.991 5.270 -0.279 1
1 1084 . 9 1 1 A 88 88 CYS C C 177 172.325 172.406 -0.081 1
1 1085 . 9 1 1 A 88 88 CYS CA C 177 55.030 54.485 0.545 1
1 1086 . 9 1 1 A 88 88 CYS CB C 177 45.610 44.006 1.604 1
1 1087 . 9 1 1 A 88 88 CYS N N 177 114.838 116.325 -1.487 1
1 1088 . 9 1 1 A 89 89 ILE H H 178 9.128 8.998 0.130 1
1 1089 . 9 1 1 A 89 89 ILE HA H 178 4.536 4.917 -0.381 1
1 1099 . 9 1 1 A 89 89 ILE C C 178 174.893 174.398 0.495 1
1 1100 . 9 1 1 A 89 89 ILE CA C 178 59.160 59.205 -0.045 1
1 1101 . 9 1 1 A 89 89 ILE CB C 178 41.840 40.772 1.068 1
1 1105 . 9 1 1 A 89 89 ILE N N 178 120.564 121.365 -0.801 1
1 1106 . 9 1 1 A 90 90 TYR H H 179 9.349 8.915 0.434 1
1 1107 . 9 1 1 A 90 90 TYR HA H 179 3.568 4.070 -0.502 1
1 1112 . 9 1 1 A 90 90 TYR C C 179 173.950 173.744 0.206 1
1 1113 . 9 1 1 A 90 90 TYR CA C 179 61.180 57.963 3.217 1
1 1114 . 9 1 1 A 90 90 TYR CB C 179 37.530 38.184 -0.654 1
1 1116 . 9 1 1 A 90 90 TYR N N 179 129.033 126.641 2.392 1
1 1117 . 9 1 1 A 91 91 ASP H H 180 7.367 8.163 -0.796 1
1 1118 . 9 1 1 A 91 91 ASP HA H 180 4.662 4.499 0.163 1
1 1121 . 9 1 1 A 91 91 ASP C C 180 175.291 175.337 -0.046 1
1 1122 . 9 1 1 A 91 91 ASP CA C 180 52.230 52.237 -0.007 1
1 1123 . 9 1 1 A 91 91 ASP CB C 180 43.650 41.845 1.805 1
1 1124 . 9 1 1 A 91 91 ASP N N 180 129.305 128.667 0.638 1
1 1125 . 9 1 1 A 92 92 ASP H H 181 8.783 8.543 0.240 1
1 1126 . 9 1 1 A 92 92 ASP HA H 181 4.114 3.748 0.366 1
1 1129 . 9 1 1 A 92 92 ASP C C 181 177.573 177.662 -0.089 1
1 1130 . 9 1 1 A 92 92 ASP CA C 181 56.390 56.953 -0.563 1
1 1131 . 9 1 1 A 92 92 ASP CB C 181 41.330 40.435 0.895 1
1 1132 . 9 1 1 A 92 92 ASP N N 181 125.665 127.509 -1.844 1
1 1133 . 9 1 1 A 93 93 THR H H 182 8.284 7.795 0.489 1
1 1134 . 9 1 1 A 93 93 THR HA H 182 4.037 3.938 0.099 1
1 1139 . 9 1 1 A 93 93 THR C C 182 176.333 176.325 0.008 1
1 1140 . 9 1 1 A 93 93 THR CA C 182 65.320 66.361 -1.041 1
1 1141 . 9 1 1 A 93 93 THR CB C 182 68.560 68.314 0.246 1
1 1143 . 9 1 1 A 93 93 THR N N 182 114.688 116.163 -1.475 1
1 1144 . 9 1 1 A 94 94 ARG H H 183 7.784 7.463 0.321 1
1 1145 . 9 1 1 A 94 94 ARG HA H 183 4.142 4.273 -0.131 1
1 1152 . 9 1 1 A 94 94 ARG C C 183 177.015 177.088 -0.073 1
1 1153 . 9 1 1 A 94 94 ARG CA C 183 55.350 56.197 -0.847 1
1 1154 . 9 1 1 A 94 94 ARG CB C 183 30.930 31.094 -0.164 1
1 1157 . 9 1 1 A 94 94 ARG N N 183 120.156 118.620 1.536 1
1 1158 . 9 1 1 A 95 95 GLY H H 184 8.144 8.947 -0.803 1
1 1159 . 9 1 1 A 95 95 GLY HA2 H 184 3.839 3.906 -0.067 1
1 1160 . 9 1 1 A 95 95 GLY HA3 H 184 3.681 3.954 -0.273 1
1 1161 . 9 1 1 A 95 95 GLY C C 184 173.653 173.395 0.258 1
1 1162 . 9 1 1 A 95 95 GLY CA C 184 46.160 45.943 0.217 1
1 1163 . 9 1 1 A 95 95 GLY N N 184 107.879 108.674 -0.795 1
1 1164 . 9 1 1 A 96 96 ASN H H 185 6.855 7.304 -0.449 1
1 1165 . 9 1 1 A 96 96 ASN HA H 185 4.909 5.201 -0.292 1
1 1170 . 9 1 1 A 96 96 ASN C C 185 174.223 173.369 0.854 1
1 1171 . 9 1 1 A 96 96 ASN CA C 185 52.720 52.394 0.326 1
1 1172 . 9 1 1 A 96 96 ASN CB C 185 45.620 41.947 3.673 1
1 1173 . 9 1 1 A 96 96 ASN N N 185 113.382 116.748 -3.366 1
1 1175 . 9 1 1 A 97 97 PHE H H 186 9.228 8.798 0.430 1
1 1176 . 9 1 1 A 97 97 PHE HA H 186 4.579 4.875 -0.296 1
1 1183 . 9 1 1 A 97 97 PHE C C 186 174.794 175.874 -1.080 1
1 1184 . 9 1 1 A 97 97 PHE CA C 186 59.384 58.681 0.703 1
1 1185 . 9 1 1 A 97 97 PHE CB C 186 40.450 40.053 0.397 1
1 1188 . 9 1 1 A 97 97 PHE N N 186 118.661 119.389 -0.728 1
1 1189 . 9 1 1 A 98 98 ILE H H 187 8.908 9.009 -0.101 1
1 1190 . 9 1 1 A 98 98 ILE HA H 187 5.440 4.853 0.587 1
1 1200 . 9 1 1 A 98 98 ILE C C 187 176.171 174.593 1.578 1
1 1201 . 9 1 1 A 98 98 ILE CA C 187 57.610 59.516 -1.906 1
1 1202 . 9 1 1 A 98 98 ILE CB C 187 41.280 40.976 0.304 1
1 1206 . 9 1 1 A 98 98 ILE N N 187 120.585 122.693 -2.108 1
1 1207 . 9 1 1 A 99 99 ILE H H 188 8.602 8.506 0.096 1
1 1208 . 9 1 1 A 99 99 ILE HA H 188 4.546 4.885 -0.339 1
1 1218 . 9 1 1 A 99 99 ILE C C 188 176.668 175.013 1.655 1
1 1219 . 9 1 1 A 99 99 ILE CA C 188 58.920 61.025 -2.105 1
1 1220 . 9 1 1 A 99 99 ILE CB C 188 37.960 37.982 -0.022 1
1 1224 . 9 1 1 A 99 99 ILE N N 188 124.500 124.615 -0.115 1
1 1225 . 9 1 1 A 100 100 LYS H H 189 8.449 8.525 -0.076 1
1 1226 . 9 1 1 A 100 100 LYS HA H 189 4.108 4.900 -0.792 1
1 1235 . 9 1 1 A 100 100 LYS C C 189 176.866 175.731 1.135 1
1 1236 . 9 1 1 A 100 100 LYS CA C 189 56.800 55.158 1.642 1
1 1237 . 9 1 1 A 100 100 LYS CB C 189 33.400 34.698 -1.298 1
1 1241 . 9 1 1 A 100 100 LYS N N 189 128.581 127.794 0.787 1
1 1242 . 9 1 1 A 101 101 GLY H H 190 8.381 8.403 -0.022 1
1 1243 . 9 1 1 A 101 101 GLY HA2 H 190 3.946 4.112 -0.166 1
1 1244 . 9 1 1 A 101 101 GLY HA3 H 190 3.828 4.114 -0.286 1
1 1245 . 9 1 1 A 101 101 GLY C C 190 172.902 174.429 -1.527 1
1 1246 . 9 1 1 A 101 101 GLY CA C 190 44.920 45.531 -0.611 1
1 1247 . 9 1 1 A 101 101 GLY N N 190 111.183 113.693 -2.510 1
1 7 . 10 1 1 A 2 2 GLN H H 91 8.786 8.912 -0.126 1
1 8 . 10 1 1 A 2 2 GLN HA H 91 4.005 3.949 0.056 1
1 15 . 10 1 1 A 2 2 GLN C C 91 177.270 177.137 0.133 1
1 16 . 10 1 1 A 2 2 GLN CA C 91 58.220 59.427 -1.207 1
1 17 . 10 1 1 A 2 2 GLN CB C 91 28.650 28.336 0.314 1
1 19 . 10 1 1 A 2 2 GLN N N 91 121.993 123.372 -1.379 1
1 21 . 10 1 1 A 3 3 GLU H H 92 8.430 8.171 0.259 1
1 22 . 10 1 1 A 3 3 GLU HA H 92 4.007 4.109 -0.102 1
1 27 . 10 1 1 A 3 3 GLU C C 92 178.287 179.181 -0.894 1
1 28 . 10 1 1 A 3 3 GLU CA C 92 59.490 58.999 0.491 1
1 29 . 10 1 1 A 3 3 GLU CB C 92 29.506 29.194 0.312 1
1 31 . 10 1 1 A 3 3 GLU N N 92 120.195 119.785 0.410 1
1 32 . 10 1 1 A 4 4 SER H H 93 8.209 8.102 0.107 1
1 33 . 10 1 1 A 4 4 SER HA H 93 4.272 4.207 0.065 1
1 36 . 10 1 1 A 4 4 SER C C 93 177.369 176.650 0.719 1
1 37 . 10 1 1 A 4 4 SER CA C 93 61.044 62.266 -1.222 1
1 38 . 10 1 1 A 4 4 SER CB C 93 62.950 62.986 -0.036 1
1 39 . 10 1 1 A 4 4 SER N N 93 115.524 116.907 -1.383 1
1 40 . 10 1 1 A 5 5 ILE H H 94 8.080 7.605 0.475 1
1 41 . 10 1 1 A 5 5 ILE HA H 94 3.530 3.612 -0.082 1
1 51 . 10 1 1 A 5 5 ILE C C 94 177.778 177.773 0.005 1
1 52 . 10 1 1 A 5 5 ILE CA C 94 65.710 65.250 0.460 1
1 53 . 10 1 1 A 5 5 ILE CB C 94 37.800 37.540 0.260 1
1 57 . 10 1 1 A 5 5 ILE N N 94 124.148 121.548 2.600 1
1 58 . 10 1 1 A 6 6 GLN H H 95 8.374 7.974 0.400 1
1 59 . 10 1 1 A 6 6 GLN HA H 95 4.125 4.049 0.076 1
1 66 . 10 1 1 A 6 6 GLN C C 95 179.726 178.983 0.743 1
1 67 . 10 1 1 A 6 6 GLN CA C 95 59.190 59.142 0.048 1
1 68 . 10 1 1 A 6 6 GLN CB C 95 27.060 28.082 -1.022 1
1 70 . 10 1 1 A 6 6 GLN N N 95 118.257 119.077 -0.820 1
1 72 . 10 1 1 A 7 7 ASN H H 96 8.456 8.338 0.118 1
1 73 . 10 1 1 A 7 7 ASN HA H 96 4.446 4.555 -0.109 1
1 78 . 10 1 1 A 7 7 ASN C C 96 177.257 177.490 -0.233 1
1 79 . 10 1 1 A 7 7 ASN CA C 96 56.020 55.940 0.080 1
1 80 . 10 1 1 A 7 7 ASN CB C 96 38.126 37.839 0.287 1
1 81 . 10 1 1 A 7 7 ASN N N 96 118.597 118.463 0.134 1
1 83 . 10 1 1 A 8 8 LYS H H 97 7.732 7.809 -0.077 1
1 84 . 10 1 1 A 8 8 LYS HA H 97 4.129 4.040 0.089 1
1 93 . 10 1 1 A 8 8 LYS C C 97 179.143 179.218 -0.075 1
1 94 . 10 1 1 A 8 8 LYS CA C 97 59.126 59.899 -0.773 1
1 95 . 10 1 1 A 8 8 LYS CB C 97 32.070 32.529 -0.459 1
1 99 . 10 1 1 A 8 8 LYS N N 97 122.381 121.098 1.283 1
1 100 . 10 1 1 A 9 9 ILE H H 98 8.452 7.829 0.623 1
1 101 . 10 1 1 A 9 9 ILE HA H 98 3.480 3.894 -0.414 1
1 111 . 10 1 1 A 9 9 ILE C C 98 177.406 178.389 -0.983 1
1 112 . 10 1 1 A 9 9 ILE CA C 98 66.430 64.721 1.709 1
1 113 . 10 1 1 A 9 9 ILE CB C 98 37.980 37.043 0.937 1
1 117 . 10 1 1 A 9 9 ILE N N 98 119.950 120.444 -0.494 1
1 118 . 10 1 1 A 10 10 SER H H 99 7.924 7.779 0.145 1
1 119 . 10 1 1 A 10 10 SER HA H 99 3.983 4.183 -0.200 1
1 122 . 10 1 1 A 10 10 SER C C 99 176.327 176.426 -0.099 1
1 123 . 10 1 1 A 10 10 SER CA C 99 61.990 61.401 0.589 1
1 124 . 10 1 1 A 10 10 SER CB C 99 62.790 62.900 -0.110 1
1 125 . 10 1 1 A 10 10 SER N N 99 113.568 117.092 -3.524 1
1 126 . 10 1 1 A 11 11 GLN H H 100 7.832 7.858 -0.026 1
1 127 . 10 1 1 A 11 11 GLN HA H 100 4.238 4.372 -0.134 1
1 134 . 10 1 1 A 11 11 GLN C C 100 178.088 178.057 0.031 1
1 135 . 10 1 1 A 11 11 GLN CA C 100 57.900 57.974 -0.074 1
1 136 . 10 1 1 A 11 11 GLN CB C 100 29.790 29.601 0.189 1
1 138 . 10 1 1 A 11 11 GLN N N 100 117.487 118.098 -0.611 1
1 140 . 10 1 1 A 12 12 CYS H H 101 7.920 8.407 -0.487 1
1 141 . 10 1 1 A 12 12 CYS HA H 101 4.657 4.441 0.216 1
1 144 . 10 1 1 A 12 12 CYS C C 101 175.439 174.943 0.496 1
1 145 . 10 1 1 A 12 12 CYS CA C 101 60.654 60.713 -0.059 1
1 146 . 10 1 1 A 12 12 CYS CB C 101 29.310 26.942 2.368 1
1 147 . 10 1 1 A 12 12 CYS N N 101 114.221 117.949 -3.728 1
1 148 . 10 1 1 A 13 13 LYS H H 102 7.993 7.516 0.477 1
1 149 . 10 1 1 A 13 13 LYS HA H 102 5.038 4.525 0.513 1
1 158 . 10 1 1 A 13 13 LYS C C 102 174.757 176.266 -1.509 1
1 159 . 10 1 1 A 13 13 LYS CA C 102 56.660 56.088 0.572 1
1 160 . 10 1 1 A 13 13 LYS CB C 102 32.970 33.665 -0.695 1
1 164 . 10 1 1 A 13 13 LYS N N 102 123.841 119.419 4.422 1
1 165 . 10 1 1 A 14 14 PHE H H 103 8.822 8.623 0.199 1
1 166 . 10 1 1 A 14 14 PHE HA H 103 5.058 5.066 -0.008 1
1 174 . 10 1 1 A 14 14 PHE C C 103 173.560 173.362 0.198 1
1 175 . 10 1 1 A 14 14 PHE CA C 103 55.470 55.979 -0.509 1
1 176 . 10 1 1 A 14 14 PHE CB C 103 41.760 40.355 1.405 1
1 180 . 10 1 1 A 14 14 PHE N N 103 118.421 116.286 2.135 1
1 181 . 10 1 1 A 15 15 SER H H 104 8.826 8.417 0.409 1
1 182 . 10 1 1 A 15 15 SER HA H 104 4.602 4.846 -0.244 1
1 185 . 10 1 1 A 15 15 SER C C 104 173.851 173.595 0.256 1
1 186 . 10 1 1 A 15 15 SER CA C 104 58.610 57.688 0.922 1
1 187 . 10 1 1 A 15 15 SER CB C 104 62.690 62.490 0.200 1
1 188 . 10 1 1 A 15 15 SER N N 104 117.781 114.939 2.842 1
1 189 . 10 1 1 A 16 16 VAL H H 105 7.839 8.002 -0.163 1
1 190 . 10 1 1 A 16 16 VAL HA H 105 3.390 4.213 -0.823 1
1 198 . 10 1 1 A 16 16 VAL C C 105 174.987 175.037 -0.050 1
1 199 . 10 1 1 A 16 16 VAL CA C 105 63.650 62.449 1.201 1
1 200 . 10 1 1 A 16 16 VAL CB C 105 31.410 30.241 1.169 1
1 203 . 10 1 1 A 16 16 VAL N N 105 129.036 126.020 3.016 1
1 204 . 10 1 1 A 17 17 CYS H H 106 8.536 7.909 0.627 1
1 205 . 10 1 1 A 17 17 CYS HA H 106 5.011 4.936 0.075 1
1 208 . 10 1 1 A 17 17 CYS CA C 106 55.260 56.507 -1.247 1
1 209 . 10 1 1 A 17 17 CYS CB C 106 28.210 30.473 -2.263 1
1 210 . 10 1 1 A 17 17 CYS N N 106 130.045 127.551 2.494 1
1 211 . 10 1 1 A 18 18 PRO HA H 107 3.991 4.340 -0.349 1
1 218 . 10 1 1 A 18 18 PRO C C 107 178.188 178.091 0.097 1
1 219 . 10 1 1 A 18 18 PRO CA C 107 65.940 64.609 1.331 1
1 220 . 10 1 1 A 18 18 PRO CB C 107 32.000 32.131 -0.131 1
1 223 . 10 1 1 A 19 19 GLU H H 108 9.260 9.083 0.177 1
1 224 . 10 1 1 A 19 19 GLU HA H 108 4.119 4.059 0.060 1
1 229 . 10 1 1 A 19 19 GLU C C 108 178.721 178.798 -0.077 1
1 230 . 10 1 1 A 19 19 GLU CA C 108 59.300 59.374 -0.074 1
1 231 . 10 1 1 A 19 19 GLU CB C 108 28.920 28.710 0.210 1
1 233 . 10 1 1 A 19 19 GLU N N 108 118.270 116.427 1.843 1
1 234 . 10 1 1 A 20 20 ARG H H 109 7.672 7.735 -0.063 1
1 235 . 10 1 1 A 20 20 ARG HA H 109 4.331 4.338 -0.007 1
1 242 . 10 1 1 A 20 20 ARG C C 109 177.977 178.088 -0.111 1
1 243 . 10 1 1 A 20 20 ARG CA C 109 57.350 57.797 -0.447 1
1 244 . 10 1 1 A 20 20 ARG CB C 109 30.820 31.098 -0.278 1
1 247 . 10 1 1 A 20 20 ARG N N 109 118.357 119.157 -0.800 1
1 248 . 10 1 1 A 21 21 LEU H H 110 7.601 7.776 -0.175 1
1 249 . 10 1 1 A 21 21 LEU HA H 110 4.380 4.300 0.080 1
1 259 . 10 1 1 A 21 21 LEU C C 110 176.562 176.396 0.166 1
1 260 . 10 1 1 A 21 21 LEU CA C 110 56.096 55.476 0.620 1
1 261 . 10 1 1 A 21 21 LEU CB C 110 44.016 42.169 1.847 1
1 265 . 10 1 1 A 21 21 LEU N N 110 118.626 118.479 0.147 1
1 266 . 10 1 1 A 22 22 GLN H H 111 7.750 7.635 0.115 1
1 267 . 10 1 1 A 22 22 GLN HA H 111 3.870 3.892 -0.022 1
1 274 . 10 1 1 A 22 22 GLN C C 111 173.336 174.057 -0.721 1
1 275 . 10 1 1 A 22 22 GLN CA C 111 56.510 57.153 -0.643 1
1 276 . 10 1 1 A 22 22 GLN CB C 111 26.800 26.337 0.463 1
1 278 . 10 1 1 A 22 22 GLN N N 111 113.926 115.847 -1.921 1
1 280 . 10 1 1 A 23 23 CYS H H 112 7.407 7.867 -0.460 1
1 281 . 10 1 1 A 23 23 CYS HA H 112 4.469 4.974 -0.505 1
1 284 . 10 1 1 A 23 23 CYS CA C 112 52.650 56.575 -3.925 1
1 285 . 10 1 1 A 23 23 CYS CB C 112 29.750 30.015 -0.265 1
1 286 . 10 1 1 A 23 23 CYS N N 112 112.681 117.414 -4.733 1
1 287 . 10 1 1 A 24 24 PRO HA H 113 4.408 4.486 -0.078 1
1 294 . 10 1 1 A 24 24 PRO C C 113 178.175 177.370 0.805 1
1 295 . 10 1 1 A 24 24 PRO CA C 113 62.040 62.436 -0.396 1
1 296 . 10 1 1 A 24 24 PRO CB C 113 31.920 32.979 -1.059 1
1 299 . 10 1 1 A 25 25 LEU H H 114 8.593 8.802 -0.209 1
1 300 . 10 1 1 A 25 25 LEU HA H 114 3.765 4.039 -0.274 1
1 310 . 10 1 1 A 25 25 LEU C C 114 179.950 178.617 1.333 1
1 311 . 10 1 1 A 25 25 LEU CA C 114 57.674 57.873 -0.199 1
1 312 . 10 1 1 A 25 25 LEU CB C 114 40.690 41.439 -0.749 1
1 316 . 10 1 1 A 25 25 LEU N N 114 123.729 123.612 0.117 1
1 317 . 10 1 1 A 26 26 GLU H H 115 9.108 8.438 0.670 1
1 318 . 10 1 1 A 26 26 GLU HA H 115 3.876 3.982 -0.106 1
1 323 . 10 1 1 A 26 26 GLU C C 115 177.505 179.097 -1.592 1
1 324 . 10 1 1 A 26 26 GLU CA C 115 59.410 59.644 -0.234 1
1 325 . 10 1 1 A 26 26 GLU CB C 115 28.460 29.278 -0.818 1
1 327 . 10 1 1 A 26 26 GLU N N 115 116.817 118.147 -1.330 1
1 328 . 10 1 1 A 27 27 ALA H H 116 7.360 7.841 -0.481 1
1 329 . 10 1 1 A 27 27 ALA HA H 116 4.408 3.839 0.569 1
1 333 . 10 1 1 A 27 27 ALA C C 116 177.046 178.478 -1.432 1
1 334 . 10 1 1 A 27 27 ALA CA C 116 52.970 54.638 -1.668 1
1 335 . 10 1 1 A 27 27 ALA CB C 116 19.916 17.848 2.068 1
1 336 . 10 1 1 A 27 27 ALA N N 116 118.966 121.772 -2.806 1
1 337 . 10 1 1 A 28 28 ILE H H 117 7.168 7.231 -0.063 1
1 338 . 10 1 1 A 28 28 ILE HA H 117 4.432 4.808 -0.376 1
1 348 . 10 1 1 A 28 28 ILE C C 117 172.641 175.528 -2.887 1
1 349 . 10 1 1 A 28 28 ILE CA C 117 59.980 60.276 -0.296 1
1 350 . 10 1 1 A 28 28 ILE CB C 117 37.350 37.771 -0.421 1
1 354 . 10 1 1 A 28 28 ILE N N 117 108.913 109.200 -0.287 1
1 355 . 10 1 1 A 29 29 GLN H H 118 6.562 7.377 -0.815 1
1 356 . 10 1 1 A 29 29 GLN HA H 118 3.922 4.216 -0.294 1
1 363 . 10 1 1 A 29 29 GLN C C 118 175.049 175.623 -0.574 1
1 364 . 10 1 1 A 29 29 GLN CA C 118 54.596 55.998 -1.402 1
1 365 . 10 1 1 A 29 29 GLN CB C 118 29.570 29.188 0.382 1
1 367 . 10 1 1 A 29 29 GLN N N 118 116.455 123.295 -6.840 1
1 369 . 10 1 1 A 30 30 CYS H H 119 8.138 8.420 -0.282 1
1 370 . 10 1 1 A 30 30 CYS HA H 119 4.580 4.580 0.000 1
1 373 . 10 1 1 A 30 30 CYS CA C 119 57.810 57.332 0.478 1
1 374 . 10 1 1 A 30 30 CYS CB C 119 30.200 28.778 1.422 1
1 375 . 10 1 1 A 30 30 CYS N N 119 134.136 125.545 8.591 1
1 376 . 10 1 1 A 31 31 PRO HA H 120 4.424 4.394 0.030 1
1 383 . 10 1 1 A 31 31 PRO C C 120 177.431 178.504 -1.073 1
1 384 . 10 1 1 A 31 31 PRO CA C 120 64.060 64.524 -0.464 1
1 385 . 10 1 1 A 31 31 PRO CB C 120 32.776 32.250 0.526 1
1 388 . 10 1 1 A 32 32 ILE H H 121 11.318 7.125 4.193 1
1 389 . 10 1 1 A 32 32 ILE HA H 121 4.038 3.945 0.093 1
1 399 . 10 1 1 A 32 32 ILE C C 121 178.485 177.716 0.769 1
1 400 . 10 1 1 A 32 32 ILE CA C 121 64.060 64.193 -0.133 1
1 401 . 10 1 1 A 32 32 ILE CB C 121 39.340 38.291 1.049 1
1 405 . 10 1 1 A 32 32 ILE N N 121 124.500 116.792 7.708 1
1 406 . 10 1 1 A 33 33 THR H H 122 9.928 7.336 2.592 1
1 407 . 10 1 1 A 33 33 THR HA H 122 4.048 4.463 -0.415 1
1 412 . 10 1 1 A 33 33 THR C C 122 175.793 174.467 1.326 1
1 413 . 10 1 1 A 33 33 THR CA C 122 62.990 61.378 1.612 1
1 414 . 10 1 1 A 33 33 THR CB C 122 70.300 69.140 1.160 1
1 416 . 10 1 1 A 33 33 THR N N 122 115.136 108.619 6.517 1
1 417 . 10 1 1 A 34 34 LEU H H 123 8.439 7.795 0.644 1
1 418 . 10 1 1 A 34 34 LEU HA H 123 3.912 4.006 -0.094 1
1 428 . 10 1 1 A 34 34 LEU C C 123 175.495 175.451 0.044 1
1 429 . 10 1 1 A 34 34 LEU CA C 123 56.290 55.956 0.334 1
1 430 . 10 1 1 A 34 34 LEU CB C 123 38.500 39.738 -1.238 1
1 434 . 10 1 1 A 34 34 LEU N N 123 117.230 121.194 -3.964 1
1 435 . 10 1 1 A 35 35 GLU H H 124 7.816 7.550 0.266 1
1 436 . 10 1 1 A 35 35 GLU HA H 124 4.634 4.730 -0.096 1
1 441 . 10 1 1 A 35 35 GLU C C 124 174.838 174.121 0.717 1
1 442 . 10 1 1 A 35 35 GLU CA C 124 53.780 54.608 -0.828 1
1 443 . 10 1 1 A 35 35 GLU CB C 124 33.710 32.491 1.219 1
1 445 . 10 1 1 A 35 35 GLU N N 124 116.577 116.460 0.117 1
1 446 . 10 1 1 A 36 36 GLN H H 125 8.532 8.554 -0.022 1
1 447 . 10 1 1 A 36 36 GLN HA H 125 4.958 4.394 0.564 1
1 454 . 10 1 1 A 36 36 GLN CA C 125 53.350 53.745 -0.395 1
1 455 . 10 1 1 A 36 36 GLN CB C 125 29.950 29.861 0.089 1
1 457 . 10 1 1 A 36 36 GLN N N 125 123.034 121.481 1.553 1
1 459 . 10 1 1 A 37 37 PRO HA H 126 4.458 4.262 0.196 1
1 466 . 10 1 1 A 37 37 PRO C C 126 176.314 177.323 -1.009 1
1 467 . 10 1 1 A 37 37 PRO CA C 126 62.816 65.712 -2.896 1
1 468 . 10 1 1 A 37 37 PRO CB C 126 33.070 31.552 1.518 1
1 471 . 10 1 1 A 38 38 GLU H H 127 8.626 8.042 0.584 1
1 472 . 10 1 1 A 38 38 GLU HA H 127 4.274 4.525 -0.251 1
1 477 . 10 1 1 A 38 38 GLU C C 127 177.809 174.971 2.838 1
1 478 . 10 1 1 A 38 38 GLU CA C 127 58.730 58.294 0.436 1
1 479 . 10 1 1 A 38 38 GLU CB C 127 30.340 29.441 0.899 1
1 481 . 10 1 1 A 38 38 GLU N N 127 120.691 119.259 1.432 1
1 482 . 10 1 1 A 39 39 LYS H H 128 7.891 7.900 -0.009 1
1 483 . 10 1 1 A 39 39 LYS HA H 128 4.870 4.708 0.162 1
1 492 . 10 1 1 A 39 39 LYS C C 128 175.452 175.593 -0.141 1
1 493 . 10 1 1 A 39 39 LYS CA C 128 53.540 54.639 -1.099 1
1 494 . 10 1 1 A 39 39 LYS CB C 128 33.630 33.895 -0.265 1
1 498 . 10 1 1 A 39 39 LYS N N 128 118.149 117.660 0.489 1
1 499 . 10 1 1 A 40 40 GLY H H 129 8.524 8.061 0.463 1
1 500 . 10 1 1 A 40 40 GLY HA2 H 129 4.973 4.033 0.940 1
1 501 . 10 1 1 A 40 40 GLY HA3 H 129 2.459 4.166 -1.707 1
1 502 . 10 1 1 A 40 40 GLY C C 129 169.943 171.961 -2.018 1
1 503 . 10 1 1 A 40 40 GLY CA C 129 42.910 44.713 -1.803 1
1 504 . 10 1 1 A 40 40 GLY N N 129 112.845 110.701 2.144 1
1 505 . 10 1 1 A 41 41 ILE H H 130 8.659 8.232 0.427 1
1 506 . 10 1 1 A 41 41 ILE HA H 130 4.591 4.857 -0.266 1
1 516 . 10 1 1 A 41 41 ILE C C 130 172.586 174.016 -1.430 1
1 517 . 10 1 1 A 41 41 ILE CA C 130 58.090 58.969 -0.879 1
1 518 . 10 1 1 A 41 41 ILE CB C 130 43.320 41.798 1.522 1
1 522 . 10 1 1 A 41 41 ILE N N 130 114.060 119.390 -5.330 1
1 523 . 10 1 1 A 42 42 PHE H H 131 9.206 8.735 0.471 1
1 524 . 10 1 1 A 42 42 PHE HA H 131 5.159 4.702 0.457 1
1 532 . 10 1 1 A 42 42 PHE C C 131 174.931 175.870 -0.939 1
1 533 . 10 1 1 A 42 42 PHE CA C 131 57.790 58.172 -0.382 1
1 534 . 10 1 1 A 42 42 PHE CB C 131 42.220 39.151 3.069 1
1 538 . 10 1 1 A 42 42 PHE N N 131 126.002 128.404 -2.402 1
1 539 . 10 1 1 A 43 43 VAL H H 132 8.502 8.974 -0.472 1
1 540 . 10 1 1 A 43 43 VAL HA H 132 4.921 4.715 0.206 1
1 548 . 10 1 1 A 43 43 VAL C C 132 178.219 175.546 2.673 1
1 549 . 10 1 1 A 43 43 VAL CA C 132 59.600 60.134 -0.534 1
1 550 . 10 1 1 A 43 43 VAL CB C 132 35.920 35.544 0.376 1
1 553 . 10 1 1 A 43 43 VAL N N 132 119.068 122.877 -3.809 1
1 554 . 10 1 1 A 44 44 LYS H H 133 10.036 8.800 1.236 1
1 555 . 10 1 1 A 44 44 LYS HA H 133 5.070 4.383 0.687 1
1 564 . 10 1 1 A 44 44 LYS C C 133 177.276 177.966 -0.690 1
1 565 . 10 1 1 A 44 44 LYS CA C 133 56.720 56.538 0.182 1
1 566 . 10 1 1 A 44 44 LYS CB C 133 34.410 33.058 1.352 1
1 570 . 10 1 1 A 44 44 LYS N N 133 130.934 125.208 5.726 1
1 571 . 10 1 1 A 45 45 ASN H H 134 8.093 8.767 -0.674 1
1 572 . 10 1 1 A 45 45 ASN HA H 134 4.152 4.625 -0.473 1
1 577 . 10 1 1 A 45 45 ASN C C 134 174.087 175.101 -1.014 1
1 578 . 10 1 1 A 45 45 ASN CA C 134 55.360 55.711 -0.351 1
1 579 . 10 1 1 A 45 45 ASN CB C 134 37.530 39.212 -1.682 1
1 580 . 10 1 1 A 45 45 ASN N N 134 117.963 121.425 -3.462 1
1 582 . 10 1 1 A 46 46 SER H H 135 7.524 7.991 -0.467 1
1 583 . 10 1 1 A 46 46 SER HA H 135 4.219 4.611 -0.392 1
1 586 . 10 1 1 A 46 46 SER C C 135 174.490 174.129 0.361 1
1 587 . 10 1 1 A 46 46 SER CA C 135 57.090 56.745 0.345 1
1 588 . 10 1 1 A 46 46 SER CB C 135 63.860 65.676 -1.816 1
1 589 . 10 1 1 A 46 46 SER N N 135 105.939 108.273 -2.334 1
1 590 . 10 1 1 A 47 47 ASP H H 136 9.113 8.920 0.193 1
1 591 . 10 1 1 A 47 47 ASP HA H 136 4.220 4.276 -0.056 1
1 594 . 10 1 1 A 47 47 ASP CA C 136 57.610 57.124 0.486 1
1 595 . 10 1 1 A 47 47 ASP CB C 136 40.810 40.629 0.181 1
1 596 . 10 1 1 A 47 47 ASP N N 136 120.995 122.537 -1.542 1
1 597 . 10 1 1 A 48 48 GLY H H 137 8.181 8.176 0.005 1
1 598 . 10 1 1 A 48 48 GLY HA2 H 137 4.120 3.954 0.166 1
1 599 . 10 1 1 A 48 48 GLY HA3 H 137 3.659 3.954 -0.295 1
1 600 . 10 1 1 A 48 48 GLY C C 137 174.062 175.091 -1.029 1
1 601 . 10 1 1 A 48 48 GLY CA C 137 45.130 47.336 -2.206 1
1 602 . 10 1 1 A 48 48 GLY N N 137 106.197 108.192 -1.995 1
1 603 . 10 1 1 A 49 49 SER H H 138 7.179 7.926 -0.747 1
1 604 . 10 1 1 A 49 49 SER HA H 138 4.383 4.428 -0.045 1
1 607 . 10 1 1 A 49 49 SER C C 138 173.864 174.268 -0.404 1
1 608 . 10 1 1 A 49 49 SER CA C 138 57.614 59.350 -1.736 1
1 609 . 10 1 1 A 49 49 SER CB C 138 65.100 63.882 1.218 1
1 610 . 10 1 1 A 49 49 SER N N 138 115.015 116.399 -1.384 1
1 611 . 10 1 1 A 50 50 ASP H H 139 8.078 9.148 -1.070 1
1 612 . 10 1 1 A 50 50 ASP HA H 139 4.642 4.864 -0.222 1
1 615 . 10 1 1 A 50 50 ASP C C 139 174.261 174.847 -0.586 1
1 616 . 10 1 1 A 50 50 ASP CA C 139 52.406 54.097 -1.691 1
1 617 . 10 1 1 A 50 50 ASP CB C 139 40.254 41.105 -0.851 1
1 618 . 10 1 1 A 50 50 ASP N N 139 122.400 124.430 -2.030 1
1 619 . 10 1 1 A 51 51 VAL H H 140 8.111 7.460 0.651 1
1 620 . 10 1 1 A 51 51 VAL HA H 140 4.360 4.712 -0.352 1
1 628 . 10 1 1 A 51 51 VAL C C 140 176.147 173.625 2.522 1
1 629 . 10 1 1 A 51 51 VAL CA C 140 62.670 60.194 2.476 1
1 630 . 10 1 1 A 51 51 VAL CB C 140 33.930 33.901 0.029 1
1 632 . 10 1 1 A 51 51 VAL N N 140 120.374 119.642 0.732 1
1 633 . 10 1 1 A 52 52 CYS H H 141 8.358 9.114 -0.756 1
1 634 . 10 1 1 A 52 52 CYS HA H 141 4.957 5.483 -0.526 1
1 637 . 10 1 1 A 52 52 CYS C C 141 173.070 172.851 0.219 1
1 638 . 10 1 1 A 52 52 CYS CA C 141 53.380 54.463 -1.083 1
1 639 . 10 1 1 A 52 52 CYS CB C 141 46.110 45.956 0.154 1
1 640 . 10 1 1 A 52 52 CYS N N 141 121.305 129.153 -7.848 1
1 641 . 10 1 1 A 53 53 THR H H 142 8.929 8.747 0.182 1
1 642 . 10 1 1 A 53 53 THR HA H 142 4.498 4.938 -0.440 1
1 648 . 10 1 1 A 53 53 THR C C 142 172.151 172.245 -0.094 1
1 649 . 10 1 1 A 53 53 THR CA C 142 62.960 61.177 1.783 1
1 650 . 10 1 1 A 53 53 THR CB C 142 70.540 72.808 -2.268 1
1 652 . 10 1 1 A 53 53 THR N N 142 120.105 118.398 1.707 1
1 653 . 10 1 1 A 54 54 LEU H H 143 8.448 8.843 -0.395 1
1 654 . 10 1 1 A 54 54 LEU HA H 143 4.322 4.801 -0.479 1
1 664 . 10 1 1 A 54 54 LEU C C 143 174.484 174.377 0.107 1
1 665 . 10 1 1 A 54 54 LEU CA C 143 54.596 53.298 1.298 1
1 666 . 10 1 1 A 54 54 LEU CB C 143 42.396 43.754 -1.358 1
1 670 . 10 1 1 A 54 54 LEU N N 143 128.819 128.471 0.348 1
1 671 . 10 1 1 A 55 55 PHE H H 144 8.661 8.815 -0.154 1
1 672 . 10 1 1 A 55 55 PHE HA H 144 5.459 5.015 0.444 1
1 680 . 10 1 1 A 55 55 PHE C C 144 176.035 174.742 1.293 1
1 681 . 10 1 1 A 55 55 PHE CA C 144 55.020 56.687 -1.667 1
1 682 . 10 1 1 A 55 55 PHE CB C 144 44.100 42.781 1.319 1
1 686 . 10 1 1 A 55 55 PHE N N 144 121.897 125.980 -4.083 1
1 687 . 10 1 1 A 56 56 ASP H H 145 11.616 8.605 3.011 1
1 688 . 10 1 1 A 56 56 ASP HA H 145 4.417 4.695 -0.278 1
1 691 . 10 1 1 A 56 56 ASP C C 145 176.748 177.291 -0.543 1
1 692 . 10 1 1 A 56 56 ASP CA C 145 55.844 54.272 1.572 1
1 693 . 10 1 1 A 56 56 ASP CB C 145 44.390 43.041 1.349 1
1 694 . 10 1 1 A 56 56 ASP N N 145 122.131 121.298 0.833 1
1 695 . 10 1 1 A 57 57 ALA H H 146 8.508 8.949 -0.441 1
1 696 . 10 1 1 A 57 57 ALA HA H 146 3.797 4.051 -0.254 1
1 700 . 10 1 1 A 57 57 ALA C C 146 178.696 180.112 -1.416 1
1 701 . 10 1 1 A 57 57 ALA CA C 146 55.990 55.271 0.719 1
1 702 . 10 1 1 A 57 57 ALA CB C 146 18.840 18.149 0.691 1
1 703 . 10 1 1 A 57 57 ALA N N 146 130.243 128.557 1.686 1
1 704 . 10 1 1 A 58 58 ALA H H 147 8.378 7.625 0.753 1
1 705 . 10 1 1 A 58 58 ALA HA H 147 4.078 4.228 -0.150 1
1 709 . 10 1 1 A 58 58 ALA C C 147 181.091 179.460 1.631 1
1 710 . 10 1 1 A 58 58 ALA CA C 147 54.770 54.969 -0.199 1
1 711 . 10 1 1 A 58 58 ALA CB C 147 17.700 18.480 -0.780 1
1 712 . 10 1 1 A 58 58 ALA N N 147 121.997 119.636 2.361 1
1 713 . 10 1 1 A 59 59 ALA H H 148 9.138 8.087 1.051 1
1 714 . 10 1 1 A 59 59 ALA HA H 148 3.975 4.061 -0.086 1
1 718 . 10 1 1 A 59 59 ALA C C 148 180.508 180.000 0.508 1
1 719 . 10 1 1 A 59 59 ALA CA C 148 54.840 55.039 -0.199 1
1 720 . 10 1 1 A 59 59 ALA CB C 148 18.600 18.580 0.020 1
1 721 . 10 1 1 A 59 59 ALA N N 148 123.595 120.700 2.895 1
1 722 . 10 1 1 A 60 60 PHE H H 149 8.814 8.017 0.797 1
1 723 . 10 1 1 A 60 60 PHE HA H 149 3.722 3.971 -0.249 1
1 731 . 10 1 1 A 60 60 PHE C C 149 176.773 177.516 -0.743 1
1 732 . 10 1 1 A 60 60 PHE CA C 149 62.030 61.475 0.555 1
1 733 . 10 1 1 A 60 60 PHE CB C 149 39.960 38.751 1.209 1
1 737 . 10 1 1 A 60 60 PHE N N 149 120.354 120.040 0.314 1
1 738 . 10 1 1 A 61 61 SER H H 150 8.276 8.198 0.078 1
1 739 . 10 1 1 A 61 61 SER HA H 150 3.880 4.080 -0.200 1
1 742 . 10 1 1 A 61 61 SER C C 150 177.691 176.583 1.108 1
1 743 . 10 1 1 A 61 61 SER CA C 150 62.190 61.517 0.673 1
1 744 . 10 1 1 A 61 61 SER CB C 150 63.016 62.914 0.102 1
1 745 . 10 1 1 A 61 61 SER N N 150 112.086 114.275 -2.189 1
1 746 . 10 1 1 A 62 62 ARG H H 151 7.829 7.938 -0.109 1
1 747 . 10 1 1 A 62 62 ARG HA H 151 3.971 4.033 -0.062 1
1 754 . 10 1 1 A 62 62 ARG C C 151 178.287 178.393 -0.106 1
1 755 . 10 1 1 A 62 62 ARG CA C 151 59.340 58.796 0.544 1
1 756 . 10 1 1 A 62 62 ARG CB C 151 29.760 29.846 -0.086 1
1 759 . 10 1 1 A 62 62 ARG N N 151 121.090 119.229 1.861 1
1 760 . 10 1 1 A 63 63 LEU H H 152 7.390 7.430 -0.040 1
1 761 . 10 1 1 A 63 63 LEU HA H 152 3.791 3.934 -0.143 1
1 771 . 10 1 1 A 63 63 LEU C C 152 179.106 178.402 0.704 1
1 772 . 10 1 1 A 63 63 LEU CA C 152 58.900 58.233 0.667 1
1 773 . 10 1 1 A 63 63 LEU CB C 152 41.140 41.433 -0.293 1
1 777 . 10 1 1 A 63 63 LEU N N 152 121.129 122.046 -0.917 1
1 778 . 10 1 1 A 64 64 VAL H H 153 7.552 7.989 -0.437 1
1 779 . 10 1 1 A 64 64 VAL HA H 153 3.411 3.462 -0.051 1
1 787 . 10 1 1 A 64 64 VAL C C 153 180.595 177.935 2.660 1
1 788 . 10 1 1 A 64 64 VAL CA C 153 65.644 66.424 -0.780 1
1 789 . 10 1 1 A 64 64 VAL CB C 153 31.410 31.356 0.054 1
1 792 . 10 1 1 A 64 64 VAL N N 153 118.280 119.000 -0.720 1
1 793 . 10 1 1 A 65 65 GLY H H 154 8.061 8.085 -0.024 1
1 794 . 10 1 1 A 65 65 GLY HA2 H 154 3.846 3.722 0.124 1
1 795 . 10 1 1 A 65 65 GLY HA3 H 154 3.809 3.723 0.086 1
1 796 . 10 1 1 A 65 65 GLY C C 154 175.235 176.113 -0.878 1
1 797 . 10 1 1 A 65 65 GLY CA C 154 46.630 47.180 -0.550 1
1 798 . 10 1 1 A 65 65 GLY N N 154 108.622 107.702 0.920 1
1 799 . 10 1 1 A 66 66 GLU H H 155 7.528 7.727 -0.199 1
1 800 . 10 1 1 A 66 66 GLU HA H 155 4.228 4.271 -0.043 1
1 805 . 10 1 1 A 66 66 GLU C C 155 176.761 176.661 0.100 1
1 806 . 10 1 1 A 66 66 GLU CA C 155 56.590 56.544 0.046 1
1 807 . 10 1 1 A 66 66 GLU CB C 155 30.490 29.894 0.596 1
1 809 . 10 1 1 A 66 66 GLU N N 155 118.361 119.707 -1.346 1
1 810 . 10 1 1 A 67 67 GLY H H 156 7.884 7.924 -0.040 1
1 811 . 10 1 1 A 67 67 GLY HA2 H 156 3.918 3.920 -0.002 1
1 812 . 10 1 1 A 67 67 GLY HA3 H 156 3.747 3.932 -0.185 1
1 813 . 10 1 1 A 67 67 GLY C C 156 174.788 174.246 0.542 1
1 814 . 10 1 1 A 67 67 GLY CA C 156 45.890 45.480 0.410 1
1 815 . 10 1 1 A 67 67 GLY N N 156 108.465 108.336 0.129 1
1 816 . 10 1 1 A 68 68 LEU H H 157 7.332 7.860 -0.528 1
1 817 . 10 1 1 A 68 68 LEU HA H 157 4.361 4.574 -0.213 1
1 827 . 10 1 1 A 68 68 LEU CA C 157 53.060 52.168 0.892 1
1 828 . 10 1 1 A 68 68 LEU CB C 157 41.100 41.756 -0.656 1
1 832 . 10 1 1 A 68 68 LEU N N 157 121.920 121.851 0.069 1
1 833 . 10 1 1 A 69 69 PRO HA H 158 4.485 4.536 -0.051 1
1 840 . 10 1 1 A 69 69 PRO C C 158 174.602 176.188 -1.586 1
1 841 . 10 1 1 A 69 69 PRO CA C 158 61.556 62.274 -0.718 1
1 842 . 10 1 1 A 69 69 PRO CB C 158 32.370 32.461 -0.091 1
1 845 . 10 1 1 A 70 70 HIS H H 159 8.734 8.532 0.202 1
1 846 . 10 1 1 A 70 70 HIS HA H 159 3.947 4.433 -0.486 1
1 852 . 10 1 1 A 70 70 HIS CA C 159 56.250 55.228 1.022 1
1 853 . 10 1 1 A 70 70 HIS CB C 159 32.280 30.972 1.308 1
1 856 . 10 1 1 A 70 70 HIS N N 159 119.423 121.766 -2.343 1
1 857 . 10 1 1 A 71 71 PRO HA H 160 4.424 4.272 0.152 1
1 864 . 10 1 1 A 71 71 PRO C C 160 177.567 178.342 -0.775 1
1 865 . 10 1 1 A 71 71 PRO CA C 160 64.574 64.836 -0.262 1
1 866 . 10 1 1 A 71 71 PRO CB C 160 32.340 31.823 0.517 1
1 869 . 10 1 1 A 72 72 LEU H H 161 10.123 7.453 2.670 1
1 870 . 10 1 1 A 72 72 LEU HA H 161 4.778 4.343 0.435 1
1 880 . 10 1 1 A 72 72 LEU C C 161 178.721 178.180 0.541 1
1 881 . 10 1 1 A 72 72 LEU CA C 161 55.800 56.706 -0.906 1
1 882 . 10 1 1 A 72 72 LEU CB C 161 42.440 42.500 -0.060 1
1 886 . 10 1 1 A 72 72 LEU N N 161 117.374 117.194 0.180 1
1 887 . 10 1 1 A 73 73 THR H H 162 7.523 7.902 -0.379 1
1 888 . 10 1 1 A 73 73 THR HA H 162 4.291 4.549 -0.258 1
1 893 . 10 1 1 A 73 73 THR C C 162 175.557 174.343 1.214 1
1 894 . 10 1 1 A 73 73 THR CA C 162 61.440 62.889 -1.449 1
1 895 . 10 1 1 A 73 73 THR CB C 162 70.500 69.740 0.760 1
1 897 . 10 1 1 A 73 73 THR N N 162 107.787 111.760 -3.973 1
1 898 . 10 1 1 A 74 74 ARG H H 163 8.361 7.920 0.441 1
1 899 . 10 1 1 A 74 74 ARG HA H 163 3.836 4.164 -0.328 1
1 906 . 10 1 1 A 74 74 ARG C C 163 174.701 175.261 -0.560 1
1 907 . 10 1 1 A 74 74 ARG CA C 163 57.980 57.654 0.326 1
1 908 . 10 1 1 A 74 74 ARG CB C 163 26.770 27.009 -0.239 1
1 911 . 10 1 1 A 74 74 ARG N N 163 115.130 118.415 -3.285 1
1 912 . 10 1 1 A 75 75 GLU H H 164 7.430 8.110 -0.680 1
1 913 . 10 1 1 A 75 75 GLU HA H 164 4.636 4.475 0.161 1
1 918 . 10 1 1 A 75 75 GLU CA C 164 53.699 55.118 -1.419 1
1 919 . 10 1 1 A 75 75 GLU CB C 164 29.550 28.710 0.840 1
1 921 . 10 1 1 A 75 75 GLU N N 164 120.076 119.106 0.970 1
1 922 . 10 1 1 A 76 76 PRO HA H 165 4.272 4.607 -0.335 1
1 929 . 10 1 1 A 76 76 PRO C C 165 176.649 176.888 -0.239 1
1 930 . 10 1 1 A 76 76 PRO CA C 165 63.204 62.934 0.270 1
1 931 . 10 1 1 A 76 76 PRO CB C 165 31.680 31.554 0.126 1
1 934 . 10 1 1 A 77 77 ILE H H 166 8.812 8.108 0.704 1
1 935 . 10 1 1 A 77 77 ILE HA H 166 3.838 4.310 -0.472 1
1 945 . 10 1 1 A 77 77 ILE C C 166 175.235 175.944 -0.709 1
1 946 . 10 1 1 A 77 77 ILE CA C 166 62.816 61.234 1.582 1
1 947 . 10 1 1 A 77 77 ILE CB C 166 37.750 37.390 0.360 1
1 951 . 10 1 1 A 77 77 ILE N N 166 123.831 124.083 -0.252 1
1 952 . 10 1 1 A 78 78 THR H H 167 6.625 8.545 -1.920 1
1 953 . 10 1 1 A 78 78 THR HA H 167 4.632 5.069 -0.437 1
1 958 . 10 1 1 A 78 78 THR C C 167 174.143 174.869 -0.726 1
1 959 . 10 1 1 A 78 78 THR CA C 167 58.750 59.993 -1.243 1
1 960 . 10 1 1 A 78 78 THR CB C 167 71.320 71.292 0.028 1
1 962 . 10 1 1 A 78 78 THR N N 167 115.293 118.583 -3.290 1
1 963 . 10 1 1 A 79 79 ALA H H 168 9.088 9.060 0.028 1
1 964 . 10 1 1 A 79 79 ALA HA H 168 3.916 4.050 -0.134 1
1 968 . 10 1 1 A 79 79 ALA C C 168 179.770 179.462 0.308 1
1 969 . 10 1 1 A 79 79 ALA CA C 168 55.480 55.251 0.229 1
1 970 . 10 1 1 A 79 79 ALA CB C 168 17.630 18.437 -0.807 1
1 971 . 10 1 1 A 79 79 ALA N N 168 122.102 128.533 -6.431 1
1 972 . 10 1 1 A 80 80 SER H H 169 7.988 7.771 0.217 1
1 973 . 10 1 1 A 80 80 SER HA H 169 4.091 4.204 -0.113 1
1 976 . 10 1 1 A 80 80 SER C C 169 175.836 176.344 -0.508 1
1 977 . 10 1 1 A 80 80 SER CA C 169 60.750 61.428 -0.678 1
1 978 . 10 1 1 A 80 80 SER CB C 169 62.510 63.048 -0.538 1
1 979 . 10 1 1 A 80 80 SER N N 169 109.660 113.292 -3.632 1
1 980 . 10 1 1 A 81 81 ILE H H 170 7.052 7.305 -0.253 1
1 981 . 10 1 1 A 81 81 ILE HA H 170 4.344 4.281 0.063 1
1 991 . 10 1 1 A 81 81 ILE C C 170 174.236 176.208 -1.972 1
1 992 . 10 1 1 A 81 81 ILE CA C 170 61.760 62.844 -1.084 1
1 993 . 10 1 1 A 81 81 ILE CB C 170 37.950 38.299 -0.349 1
1 997 . 10 1 1 A 81 81 ILE N N 170 112.623 113.225 -0.602 1
1 998 . 10 1 1 A 82 82 ILE H H 171 7.345 7.141 0.204 1
1 999 . 10 1 1 A 82 82 ILE HA H 171 4.288 4.041 0.247 1
1 1009 . 10 1 1 A 82 82 ILE C C 171 174.931 175.318 -0.387 1
1 1010 . 10 1 1 A 82 82 ILE CA C 171 61.420 61.994 -0.574 1
1 1011 . 10 1 1 A 82 82 ILE CB C 171 37.230 37.839 -0.609 1
1 1015 . 10 1 1 A 82 82 ILE N N 171 124.260 124.903 -0.643 1
1 1016 . 10 1 1 A 83 83 VAL H H 172 7.843 8.707 -0.864 1
1 1017 . 10 1 1 A 83 83 VAL HA H 172 4.818 5.043 -0.225 1
1 1025 . 10 1 1 A 83 83 VAL C C 172 174.918 175.576 -0.658 1
1 1026 . 10 1 1 A 83 83 VAL CA C 172 58.910 59.148 -0.238 1
1 1027 . 10 1 1 A 83 83 VAL CB C 172 34.570 35.112 -0.542 1
1 1030 . 10 1 1 A 83 83 VAL N N 172 118.856 121.980 -3.124 1
1 1031 . 10 1 1 A 84 84 LYS H H 173 8.347 8.687 -0.340 1
1 1032 . 10 1 1 A 84 84 LYS HA H 173 4.356 4.495 -0.139 1
1 1041 . 10 1 1 A 84 84 LYS C C 173 178.653 178.037 0.616 1
1 1042 . 10 1 1 A 84 84 LYS CA C 173 56.360 55.281 1.079 1
1 1043 . 10 1 1 A 84 84 LYS CB C 173 33.366 33.753 -0.387 1
1 1047 . 10 1 1 A 84 84 LYS N N 173 119.602 121.660 -2.058 1
1 1048 . 10 1 1 A 85 85 HIS H H 174 9.143 8.381 0.762 1
1 1049 . 10 1 1 A 85 85 HIS HA H 174 4.013 4.405 -0.392 1
1 1053 . 10 1 1 A 85 85 HIS C C 174 176.606 177.899 -1.293 1
1 1054 . 10 1 1 A 85 85 HIS CA C 174 58.820 59.681 -0.861 1
1 1055 . 10 1 1 A 85 85 HIS CB C 174 28.186 30.043 -1.857 1
1 1057 . 10 1 1 A 85 85 HIS N N 174 120.022 121.113 -1.091 1
1 1058 . 10 1 1 A 86 86 GLU H H 175 8.403 8.021 0.382 1
1 1059 . 10 1 1 A 86 86 GLU HA H 175 3.863 4.049 -0.186 1
1 1064 . 10 1 1 A 86 86 GLU C C 175 177.040 179.204 -2.164 1
1 1065 . 10 1 1 A 86 86 GLU CA C 175 57.830 59.759 -1.929 1
1 1066 . 10 1 1 A 86 86 GLU CB C 175 28.690 29.151 -0.461 1
1 1068 . 10 1 1 A 86 86 GLU N N 175 116.124 120.215 -4.091 1
1 1069 . 10 1 1 A 87 87 GLU H H 176 7.669 8.119 -0.450 1
1 1070 . 10 1 1 A 87 87 GLU HA H 176 4.039 4.284 -0.245 1
1 1075 . 10 1 1 A 87 87 GLU C C 176 175.688 177.386 -1.698 1
1 1076 . 10 1 1 A 87 87 GLU CA C 176 57.906 59.034 -1.128 1
1 1077 . 10 1 1 A 87 87 GLU CB C 176 30.430 29.013 1.417 1
1 1079 . 10 1 1 A 87 87 GLU N N 176 116.183 119.122 -2.939 1
1 1080 . 10 1 1 A 88 88 CYS H H 177 6.750 7.527 -0.777 1
1 1081 . 10 1 1 A 88 88 CYS HA H 177 4.991 4.842 0.149 1
1 1084 . 10 1 1 A 88 88 CYS C C 177 172.325 173.291 -0.966 1
1 1085 . 10 1 1 A 88 88 CYS CA C 177 55.030 54.177 0.853 1
1 1086 . 10 1 1 A 88 88 CYS CB C 177 45.610 42.651 2.959 1
1 1087 . 10 1 1 A 88 88 CYS N N 177 114.838 116.683 -1.845 1
1 1088 . 10 1 1 A 89 89 ILE H H 178 9.128 8.894 0.234 1
1 1089 . 10 1 1 A 89 89 ILE HA H 178 4.536 4.954 -0.418 1
1 1099 . 10 1 1 A 89 89 ILE C C 178 174.893 174.539 0.354 1
1 1100 . 10 1 1 A 89 89 ILE CA C 178 59.160 59.360 -0.200 1
1 1101 . 10 1 1 A 89 89 ILE CB C 178 41.840 40.857 0.983 1
1 1105 . 10 1 1 A 89 89 ILE N N 178 120.564 121.210 -0.646 1
1 1106 . 10 1 1 A 90 90 TYR H H 179 9.349 9.125 0.224 1
1 1107 . 10 1 1 A 90 90 TYR HA H 179 3.568 4.262 -0.694 1
1 1112 . 10 1 1 A 90 90 TYR C C 179 173.950 173.974 -0.024 1
1 1113 . 10 1 1 A 90 90 TYR CA C 179 61.180 58.380 2.800 1
1 1114 . 10 1 1 A 90 90 TYR CB C 179 37.530 38.503 -0.973 1
1 1116 . 10 1 1 A 90 90 TYR N N 179 129.033 126.869 2.164 1
1 1117 . 10 1 1 A 91 91 ASP H H 180 7.367 8.197 -0.830 1
1 1118 . 10 1 1 A 91 91 ASP HA H 180 4.662 4.596 0.066 1
1 1121 . 10 1 1 A 91 91 ASP C C 180 175.291 175.568 -0.277 1
1 1122 . 10 1 1 A 91 91 ASP CA C 180 52.230 52.242 -0.012 1
1 1123 . 10 1 1 A 91 91 ASP CB C 180 43.650 42.242 1.408 1
1 1124 . 10 1 1 A 91 91 ASP N N 180 129.305 128.872 0.433 1
1 1125 . 10 1 1 A 92 92 ASP H H 181 8.783 8.626 0.157 1
1 1126 . 10 1 1 A 92 92 ASP HA H 181 4.114 3.944 0.170 1
1 1129 . 10 1 1 A 92 92 ASP C C 181 177.573 178.206 -0.633 1
1 1130 . 10 1 1 A 92 92 ASP CA C 181 56.390 57.425 -1.035 1
1 1131 . 10 1 1 A 92 92 ASP CB C 181 41.330 40.250 1.080 1
1 1132 . 10 1 1 A 92 92 ASP N N 181 125.665 125.398 0.267 1
1 1133 . 10 1 1 A 93 93 THR H H 182 8.284 7.640 0.644 1
1 1134 . 10 1 1 A 93 93 THR HA H 182 4.037 3.849 0.188 1
1 1139 . 10 1 1 A 93 93 THR C C 182 176.333 176.162 0.171 1
1 1140 . 10 1 1 A 93 93 THR CA C 182 65.320 66.800 -1.480 1
1 1141 . 10 1 1 A 93 93 THR CB C 182 68.560 68.296 0.264 1
1 1143 . 10 1 1 A 93 93 THR N N 182 114.688 116.888 -2.200 1
1 1144 . 10 1 1 A 94 94 ARG H H 183 7.784 7.396 0.388 1
1 1145 . 10 1 1 A 94 94 ARG HA H 183 4.142 4.259 -0.117 1
1 1152 . 10 1 1 A 94 94 ARG C C 183 177.015 177.037 -0.022 1
1 1153 . 10 1 1 A 94 94 ARG CA C 183 55.350 56.184 -0.834 1
1 1154 . 10 1 1 A 94 94 ARG CB C 183 30.930 30.924 0.006 1
1 1157 . 10 1 1 A 94 94 ARG N N 183 120.156 118.532 1.624 1
1 1158 . 10 1 1 A 95 95 GLY H H 184 8.144 8.917 -0.773 1
1 1159 . 10 1 1 A 95 95 GLY HA2 H 184 3.839 3.863 -0.024 1
1 1160 . 10 1 1 A 95 95 GLY HA3 H 184 3.681 3.870 -0.189 1
1 1161 . 10 1 1 A 95 95 GLY C C 184 173.653 173.381 0.272 1
1 1162 . 10 1 1 A 95 95 GLY CA C 184 46.160 45.636 0.524 1
1 1163 . 10 1 1 A 95 95 GLY N N 184 107.879 108.918 -1.039 1
1 1164 . 10 1 1 A 96 96 ASN H H 185 6.855 7.294 -0.439 1
1 1165 . 10 1 1 A 96 96 ASN HA H 185 4.909 5.027 -0.118 1
1 1170 . 10 1 1 A 96 96 ASN C C 185 174.223 173.367 0.856 1
1 1171 . 10 1 1 A 96 96 ASN CA C 185 52.720 52.184 0.536 1
1 1172 . 10 1 1 A 96 96 ASN CB C 185 45.620 41.769 3.851 1
1 1173 . 10 1 1 A 96 96 ASN N N 185 113.382 117.253 -3.871 1
1 1175 . 10 1 1 A 97 97 PHE H H 186 9.228 8.574 0.654 1
1 1176 . 10 1 1 A 97 97 PHE HA H 186 4.579 4.933 -0.354 1
1 1183 . 10 1 1 A 97 97 PHE C C 186 174.794 175.782 -0.988 1
1 1184 . 10 1 1 A 97 97 PHE CA C 186 59.384 59.105 0.279 1
1 1185 . 10 1 1 A 97 97 PHE CB C 186 40.450 39.394 1.056 1
1 1188 . 10 1 1 A 97 97 PHE N N 186 118.661 119.355 -0.694 1
1 1189 . 10 1 1 A 98 98 ILE H H 187 8.908 8.961 -0.053 1
1 1190 . 10 1 1 A 98 98 ILE HA H 187 5.440 4.839 0.601 1
1 1200 . 10 1 1 A 98 98 ILE C C 187 176.171 174.604 1.567 1
1 1201 . 10 1 1 A 98 98 ILE CA C 187 57.610 59.585 -1.975 1
1 1202 . 10 1 1 A 98 98 ILE CB C 187 41.280 40.903 0.377 1
1 1206 . 10 1 1 A 98 98 ILE N N 187 120.585 123.072 -2.487 1
1 1207 . 10 1 1 A 99 99 ILE H H 188 8.602 8.513 0.089 1
1 1208 . 10 1 1 A 99 99 ILE HA H 188 4.546 4.714 -0.168 1
1 1218 . 10 1 1 A 99 99 ILE C C 188 176.668 175.164 1.504 1
1 1219 . 10 1 1 A 99 99 ILE CA C 188 58.920 60.591 -1.671 1
1 1220 . 10 1 1 A 99 99 ILE CB C 188 37.960 38.244 -0.284 1
1 1224 . 10 1 1 A 99 99 ILE N N 188 124.500 124.704 -0.204 1
1 1225 . 10 1 1 A 100 100 LYS H H 189 8.449 8.288 0.161 1
1 1226 . 10 1 1 A 100 100 LYS HA H 189 4.108 4.671 -0.563 1
1 1235 . 10 1 1 A 100 100 LYS C C 189 176.866 176.546 0.320 1
1 1236 . 10 1 1 A 100 100 LYS CA C 189 56.800 55.477 1.323 1
1 1237 . 10 1 1 A 100 100 LYS CB C 189 33.400 32.751 0.649 1
1 1241 . 10 1 1 A 100 100 LYS N N 189 128.581 126.988 1.593 1
1 1242 . 10 1 1 A 101 101 GLY H H 190 8.381 8.580 -0.199 1
1 1243 . 10 1 1 A 101 101 GLY HA2 H 190 3.946 3.801 0.145 1
1 1244 . 10 1 1 A 101 101 GLY HA3 H 190 3.828 3.805 0.023 1
1 1245 . 10 1 1 A 101 101 GLY C C 190 172.902 174.061 -1.159 1
1 1246 . 10 1 1 A 101 101 GLY CA C 190 44.920 46.561 -1.641 1
1 1247 . 10 1 1 A 101 101 GLY N N 190 111.183 113.164 -1.981 1
1 7 . 11 1 1 A 2 2 GLN H H 91 8.786 8.189 0.597 1
1 8 . 11 1 1 A 2 2 GLN HA H 91 4.005 3.928 0.077 1
1 15 . 11 1 1 A 2 2 GLN C C 91 177.270 178.359 -1.089 1
1 16 . 11 1 1 A 2 2 GLN CA C 91 58.220 58.998 -0.778 1
1 17 . 11 1 1 A 2 2 GLN CB C 91 28.650 27.941 0.709 1
1 19 . 11 1 1 A 2 2 GLN N N 91 121.993 121.445 0.548 1
1 21 . 11 1 1 A 3 3 GLU H H 92 8.430 8.406 0.024 1
1 22 . 11 1 1 A 3 3 GLU HA H 92 4.007 4.058 -0.051 1
1 27 . 11 1 1 A 3 3 GLU C C 92 178.287 178.638 -0.351 1
1 28 . 11 1 1 A 3 3 GLU CA C 92 59.490 59.693 -0.203 1
1 29 . 11 1 1 A 3 3 GLU CB C 92 29.506 29.462 0.044 1
1 31 . 11 1 1 A 3 3 GLU N N 92 120.195 119.570 0.625 1
1 32 . 11 1 1 A 4 4 SER H H 93 8.209 7.393 0.816 1
1 33 . 11 1 1 A 4 4 SER HA H 93 4.272 4.256 0.016 1
1 36 . 11 1 1 A 4 4 SER C C 93 177.369 177.503 -0.134 1
1 37 . 11 1 1 A 4 4 SER CA C 93 61.044 61.355 -0.311 1
1 38 . 11 1 1 A 4 4 SER CB C 93 62.950 62.898 0.052 1
1 39 . 11 1 1 A 4 4 SER N N 93 115.524 114.220 1.304 1
1 40 . 11 1 1 A 5 5 ILE H H 94 8.080 7.694 0.386 1
1 41 . 11 1 1 A 5 5 ILE HA H 94 3.530 3.612 -0.082 1
1 51 . 11 1 1 A 5 5 ILE C C 94 177.778 177.589 0.189 1
1 52 . 11 1 1 A 5 5 ILE CA C 94 65.710 65.299 0.411 1
1 53 . 11 1 1 A 5 5 ILE CB C 94 37.800 37.449 0.351 1
1 57 . 11 1 1 A 5 5 ILE N N 94 124.148 122.050 2.098 1
1 58 . 11 1 1 A 6 6 GLN H H 95 8.374 8.289 0.085 1
1 59 . 11 1 1 A 6 6 GLN HA H 95 4.125 3.924 0.201 1
1 66 . 11 1 1 A 6 6 GLN C C 95 179.726 179.334 0.392 1
1 67 . 11 1 1 A 6 6 GLN CA C 95 59.190 58.813 0.377 1
1 68 . 11 1 1 A 6 6 GLN CB C 95 27.060 28.444 -1.384 1
1 70 . 11 1 1 A 6 6 GLN N N 95 118.257 118.751 -0.494 1
1 72 . 11 1 1 A 7 7 ASN H H 96 8.456 8.085 0.371 1
1 73 . 11 1 1 A 7 7 ASN HA H 96 4.446 4.540 -0.094 1
1 78 . 11 1 1 A 7 7 ASN C C 96 177.257 177.764 -0.507 1
1 79 . 11 1 1 A 7 7 ASN CA C 96 56.020 56.252 -0.232 1
1 80 . 11 1 1 A 7 7 ASN CB C 96 38.126 37.705 0.421 1
1 81 . 11 1 1 A 7 7 ASN N N 96 118.597 118.576 0.021 1
1 83 . 11 1 1 A 8 8 LYS H H 97 7.732 7.971 -0.239 1
1 84 . 11 1 1 A 8 8 LYS HA H 97 4.129 4.022 0.107 1
1 93 . 11 1 1 A 8 8 LYS C C 97 179.143 179.370 -0.227 1
1 94 . 11 1 1 A 8 8 LYS CA C 97 59.126 59.875 -0.749 1
1 95 . 11 1 1 A 8 8 LYS CB C 97 32.070 32.427 -0.357 1
1 99 . 11 1 1 A 8 8 LYS N N 97 122.381 120.561 1.820 1
1 100 . 11 1 1 A 9 9 ILE H H 98 8.452 8.154 0.298 1
1 101 . 11 1 1 A 9 9 ILE HA H 98 3.480 3.875 -0.395 1
1 111 . 11 1 1 A 9 9 ILE C C 98 177.406 178.950 -1.544 1
1 112 . 11 1 1 A 9 9 ILE CA C 98 66.430 64.704 1.726 1
1 113 . 11 1 1 A 9 9 ILE CB C 98 37.980 37.068 0.912 1
1 117 . 11 1 1 A 9 9 ILE N N 98 119.950 120.404 -0.454 1
1 118 . 11 1 1 A 10 10 SER H H 99 7.924 7.884 0.040 1
1 119 . 11 1 1 A 10 10 SER HA H 99 3.983 4.315 -0.332 1
1 122 . 11 1 1 A 10 10 SER C C 99 176.327 176.085 0.242 1
1 123 . 11 1 1 A 10 10 SER CA C 99 61.990 61.062 0.928 1
1 124 . 11 1 1 A 10 10 SER CB C 99 62.790 63.434 -0.644 1
1 125 . 11 1 1 A 10 10 SER N N 99 113.568 117.258 -3.690 1
1 126 . 11 1 1 A 11 11 GLN H H 100 7.832 7.824 0.008 1
1 127 . 11 1 1 A 11 11 GLN HA H 100 4.238 4.449 -0.211 1
1 134 . 11 1 1 A 11 11 GLN C C 100 178.088 177.878 0.210 1
1 135 . 11 1 1 A 11 11 GLN CA C 100 57.900 57.837 0.063 1
1 136 . 11 1 1 A 11 11 GLN CB C 100 29.790 29.920 -0.130 1
1 138 . 11 1 1 A 11 11 GLN N N 100 117.487 117.681 -0.194 1
1 140 . 11 1 1 A 12 12 CYS H H 101 7.920 8.408 -0.488 1
1 141 . 11 1 1 A 12 12 CYS HA H 101 4.657 4.523 0.134 1
1 144 . 11 1 1 A 12 12 CYS C C 101 175.439 174.855 0.584 1
1 145 . 11 1 1 A 12 12 CYS CA C 101 60.654 60.055 0.599 1
1 146 . 11 1 1 A 12 12 CYS CB C 101 29.310 27.050 2.260 1
1 147 . 11 1 1 A 12 12 CYS N N 101 114.221 117.104 -2.883 1
1 148 . 11 1 1 A 13 13 LYS H H 102 7.993 7.426 0.567 1
1 149 . 11 1 1 A 13 13 LYS HA H 102 5.038 4.453 0.585 1
1 158 . 11 1 1 A 13 13 LYS C C 102 174.757 176.232 -1.475 1
1 159 . 11 1 1 A 13 13 LYS CA C 102 56.660 56.012 0.648 1
1 160 . 11 1 1 A 13 13 LYS CB C 102 32.970 33.429 -0.459 1
1 164 . 11 1 1 A 13 13 LYS N N 102 123.841 119.744 4.097 1
1 165 . 11 1 1 A 14 14 PHE H H 103 8.822 8.602 0.220 1
1 166 . 11 1 1 A 14 14 PHE HA H 103 5.058 5.123 -0.065 1
1 174 . 11 1 1 A 14 14 PHE C C 103 173.560 173.558 0.002 1
1 175 . 11 1 1 A 14 14 PHE CA C 103 55.470 55.994 -0.524 1
1 176 . 11 1 1 A 14 14 PHE CB C 103 41.760 40.707 1.053 1
1 180 . 11 1 1 A 14 14 PHE N N 103 118.421 116.302 2.119 1
1 181 . 11 1 1 A 15 15 SER H H 104 8.826 8.508 0.318 1
1 182 . 11 1 1 A 15 15 SER HA H 104 4.602 4.778 -0.176 1
1 185 . 11 1 1 A 15 15 SER C C 104 173.851 173.790 0.061 1
1 186 . 11 1 1 A 15 15 SER CA C 104 58.610 57.899 0.711 1
1 187 . 11 1 1 A 15 15 SER CB C 104 62.690 62.472 0.218 1
1 188 . 11 1 1 A 15 15 SER N N 104 117.781 115.107 2.674 1
1 189 . 11 1 1 A 16 16 VAL H H 105 7.839 8.315 -0.476 1
1 190 . 11 1 1 A 16 16 VAL HA H 105 3.390 4.374 -0.984 1
1 198 . 11 1 1 A 16 16 VAL C C 105 174.987 175.106 -0.119 1
1 199 . 11 1 1 A 16 16 VAL CA C 105 63.650 62.489 1.161 1
1 200 . 11 1 1 A 16 16 VAL CB C 105 31.410 30.269 1.141 1
1 203 . 11 1 1 A 16 16 VAL N N 105 129.036 126.188 2.848 1
1 204 . 11 1 1 A 17 17 CYS H H 106 8.536 8.245 0.291 1
1 205 . 11 1 1 A 17 17 CYS HA H 106 5.011 4.961 0.050 1
1 208 . 11 1 1 A 17 17 CYS CA C 106 55.260 56.240 -0.980 1
1 209 . 11 1 1 A 17 17 CYS CB C 106 28.210 30.298 -2.088 1
1 210 . 11 1 1 A 17 17 CYS N N 106 130.045 127.507 2.538 1
1 211 . 11 1 1 A 18 18 PRO HA H 107 3.991 4.362 -0.371 1
1 218 . 11 1 1 A 18 18 PRO C C 107 178.188 178.248 -0.060 1
1 219 . 11 1 1 A 18 18 PRO CA C 107 65.940 64.784 1.156 1
1 220 . 11 1 1 A 18 18 PRO CB C 107 32.000 32.124 -0.124 1
1 223 . 11 1 1 A 19 19 GLU H H 108 9.260 9.002 0.258 1
1 224 . 11 1 1 A 19 19 GLU HA H 108 4.119 4.074 0.045 1
1 229 . 11 1 1 A 19 19 GLU C C 108 178.721 179.307 -0.586 1
1 230 . 11 1 1 A 19 19 GLU CA C 108 59.300 59.561 -0.261 1
1 231 . 11 1 1 A 19 19 GLU CB C 108 28.920 28.886 0.034 1
1 233 . 11 1 1 A 19 19 GLU N N 108 118.270 116.269 2.001 1
1 234 . 11 1 1 A 20 20 ARG H H 109 7.672 7.930 -0.258 1
1 235 . 11 1 1 A 20 20 ARG HA H 109 4.331 4.130 0.201 1
1 242 . 11 1 1 A 20 20 ARG C C 109 177.977 178.611 -0.634 1
1 243 . 11 1 1 A 20 20 ARG CA C 109 57.350 59.192 -1.842 1
1 244 . 11 1 1 A 20 20 ARG CB C 109 30.820 30.320 0.500 1
1 247 . 11 1 1 A 20 20 ARG N N 109 118.357 120.069 -1.712 1
1 248 . 11 1 1 A 21 21 LEU H H 110 7.601 7.969 -0.368 1
1 249 . 11 1 1 A 21 21 LEU HA H 110 4.380 4.379 0.001 1
1 259 . 11 1 1 A 21 21 LEU C C 110 176.562 176.486 0.076 1
1 260 . 11 1 1 A 21 21 LEU CA C 110 56.096 55.814 0.282 1
1 261 . 11 1 1 A 21 21 LEU CB C 110 44.016 42.251 1.765 1
1 265 . 11 1 1 A 21 21 LEU N N 110 118.626 119.299 -0.673 1
1 266 . 11 1 1 A 22 22 GLN H H 111 7.750 7.566 0.184 1
1 267 . 11 1 1 A 22 22 GLN HA H 111 3.870 3.914 -0.044 1
1 274 . 11 1 1 A 22 22 GLN C C 111 173.336 174.080 -0.744 1
1 275 . 11 1 1 A 22 22 GLN CA C 111 56.510 57.206 -0.696 1
1 276 . 11 1 1 A 22 22 GLN CB C 111 26.800 26.562 0.238 1
1 278 . 11 1 1 A 22 22 GLN N N 111 113.926 115.581 -1.655 1
1 280 . 11 1 1 A 23 23 CYS H H 112 7.407 7.927 -0.520 1
1 281 . 11 1 1 A 23 23 CYS HA H 112 4.469 4.953 -0.484 1
1 284 . 11 1 1 A 23 23 CYS CA C 112 52.650 56.585 -3.935 1
1 285 . 11 1 1 A 23 23 CYS CB C 112 29.750 28.599 1.151 1
1 286 . 11 1 1 A 23 23 CYS N N 112 112.681 117.557 -4.876 1
1 287 . 11 1 1 A 24 24 PRO HA H 113 4.408 4.519 -0.111 1
1 294 . 11 1 1 A 24 24 PRO C C 113 178.175 177.632 0.543 1
1 295 . 11 1 1 A 24 24 PRO CA C 113 62.040 62.591 -0.551 1
1 296 . 11 1 1 A 24 24 PRO CB C 113 31.920 32.537 -0.617 1
1 299 . 11 1 1 A 25 25 LEU H H 114 8.593 8.850 -0.257 1
1 300 . 11 1 1 A 25 25 LEU HA H 114 3.765 4.044 -0.279 1
1 310 . 11 1 1 A 25 25 LEU C C 114 179.950 178.748 1.202 1
1 311 . 11 1 1 A 25 25 LEU CA C 114 57.674 57.959 -0.285 1
1 312 . 11 1 1 A 25 25 LEU CB C 114 40.690 41.384 -0.694 1
1 316 . 11 1 1 A 25 25 LEU N N 114 123.729 124.092 -0.363 1
1 317 . 11 1 1 A 26 26 GLU H H 115 9.108 8.456 0.652 1
1 318 . 11 1 1 A 26 26 GLU HA H 115 3.876 3.972 -0.096 1
1 323 . 11 1 1 A 26 26 GLU C C 115 177.505 178.868 -1.363 1
1 324 . 11 1 1 A 26 26 GLU CA C 115 59.410 59.620 -0.210 1
1 325 . 11 1 1 A 26 26 GLU CB C 115 28.460 29.171 -0.711 1
1 327 . 11 1 1 A 26 26 GLU N N 115 116.817 118.361 -1.544 1
1 328 . 11 1 1 A 27 27 ALA H H 116 7.360 7.817 -0.457 1
1 329 . 11 1 1 A 27 27 ALA HA H 116 4.408 3.860 0.548 1
1 333 . 11 1 1 A 27 27 ALA C C 116 177.046 178.607 -1.561 1
1 334 . 11 1 1 A 27 27 ALA CA C 116 52.970 54.701 -1.731 1
1 335 . 11 1 1 A 27 27 ALA CB C 116 19.916 17.794 2.122 1
1 336 . 11 1 1 A 27 27 ALA N N 116 118.966 121.462 -2.496 1
1 337 . 11 1 1 A 28 28 ILE H H 117 7.168 7.121 0.047 1
1 338 . 11 1 1 A 28 28 ILE HA H 117 4.432 4.620 -0.188 1
1 348 . 11 1 1 A 28 28 ILE C C 117 172.641 175.634 -2.993 1
1 349 . 11 1 1 A 28 28 ILE CA C 117 59.980 60.671 -0.691 1
1 350 . 11 1 1 A 28 28 ILE CB C 117 37.350 38.014 -0.664 1
1 354 . 11 1 1 A 28 28 ILE N N 117 108.913 109.160 -0.247 1
1 355 . 11 1 1 A 29 29 GLN H H 118 6.562 7.373 -0.811 1
1 356 . 11 1 1 A 29 29 GLN HA H 118 3.922 4.192 -0.270 1
1 363 . 11 1 1 A 29 29 GLN C C 118 175.049 175.606 -0.557 1
1 364 . 11 1 1 A 29 29 GLN CA C 118 54.596 56.081 -1.485 1
1 365 . 11 1 1 A 29 29 GLN CB C 118 29.570 29.261 0.309 1
1 367 . 11 1 1 A 29 29 GLN N N 118 116.455 123.218 -6.763 1
1 369 . 11 1 1 A 30 30 CYS H H 119 8.138 8.565 -0.427 1
1 370 . 11 1 1 A 30 30 CYS HA H 119 4.580 4.462 0.118 1
1 373 . 11 1 1 A 30 30 CYS CA C 119 57.810 57.670 0.140 1
1 374 . 11 1 1 A 30 30 CYS CB C 119 30.200 28.737 1.463 1
1 375 . 11 1 1 A 30 30 CYS N N 119 134.136 125.614 8.522 1
1 376 . 11 1 1 A 31 31 PRO HA H 120 4.424 4.345 0.079 1
1 383 . 11 1 1 A 31 31 PRO C C 120 177.431 178.719 -1.288 1
1 384 . 11 1 1 A 31 31 PRO CA C 120 64.060 65.158 -1.098 1
1 385 . 11 1 1 A 31 31 PRO CB C 120 32.776 32.037 0.739 1
1 388 . 11 1 1 A 32 32 ILE H H 121 11.318 7.157 4.161 1
1 389 . 11 1 1 A 32 32 ILE HA H 121 4.038 3.970 0.068 1
1 399 . 11 1 1 A 32 32 ILE C C 121 178.485 177.774 0.711 1
1 400 . 11 1 1 A 32 32 ILE CA C 121 64.060 63.955 0.105 1
1 401 . 11 1 1 A 32 32 ILE CB C 121 39.340 38.735 0.605 1
1 405 . 11 1 1 A 32 32 ILE N N 121 124.500 116.723 7.777 1
1 406 . 11 1 1 A 33 33 THR H H 122 9.928 7.365 2.563 1
1 407 . 11 1 1 A 33 33 THR HA H 122 4.048 4.445 -0.397 1
1 412 . 11 1 1 A 33 33 THR C C 122 175.793 174.432 1.361 1
1 413 . 11 1 1 A 33 33 THR CA C 122 62.990 61.476 1.514 1
1 414 . 11 1 1 A 33 33 THR CB C 122 70.300 69.111 1.189 1
1 416 . 11 1 1 A 33 33 THR N N 122 115.136 108.566 6.570 1
1 417 . 11 1 1 A 34 34 LEU H H 123 8.439 7.838 0.601 1
1 418 . 11 1 1 A 34 34 LEU HA H 123 3.912 3.993 -0.081 1
1 428 . 11 1 1 A 34 34 LEU C C 123 175.495 175.595 -0.100 1
1 429 . 11 1 1 A 34 34 LEU CA C 123 56.290 55.725 0.565 1
1 430 . 11 1 1 A 34 34 LEU CB C 123 38.500 39.725 -1.225 1
1 434 . 11 1 1 A 34 34 LEU N N 123 117.230 121.162 -3.932 1
1 435 . 11 1 1 A 35 35 GLU H H 124 7.816 7.475 0.341 1
1 436 . 11 1 1 A 35 35 GLU HA H 124 4.634 4.625 0.009 1
1 441 . 11 1 1 A 35 35 GLU C C 124 174.838 174.097 0.741 1
1 442 . 11 1 1 A 35 35 GLU CA C 124 53.780 54.819 -1.039 1
1 443 . 11 1 1 A 35 35 GLU CB C 124 33.710 31.829 1.881 1
1 445 . 11 1 1 A 35 35 GLU N N 124 116.577 116.347 0.230 1
1 446 . 11 1 1 A 36 36 GLN H H 125 8.532 8.564 -0.032 1
1 447 . 11 1 1 A 36 36 GLN HA H 125 4.958 4.391 0.567 1
1 454 . 11 1 1 A 36 36 GLN CA C 125 53.350 53.740 -0.390 1
1 455 . 11 1 1 A 36 36 GLN CB C 125 29.950 29.740 0.210 1
1 457 . 11 1 1 A 36 36 GLN N N 125 123.034 121.424 1.610 1
1 459 . 11 1 1 A 37 37 PRO HA H 126 4.458 4.273 0.185 1
1 466 . 11 1 1 A 37 37 PRO C C 126 176.314 177.295 -0.981 1
1 467 . 11 1 1 A 37 37 PRO CA C 126 62.816 65.576 -2.760 1
1 468 . 11 1 1 A 37 37 PRO CB C 126 33.070 31.589 1.481 1
1 471 . 11 1 1 A 38 38 GLU H H 127 8.626 7.644 0.982 1
1 472 . 11 1 1 A 38 38 GLU HA H 127 4.274 4.449 -0.175 1
1 477 . 11 1 1 A 38 38 GLU C C 127 177.809 175.107 2.702 1
1 478 . 11 1 1 A 38 38 GLU CA C 127 58.730 58.367 0.363 1
1 479 . 11 1 1 A 38 38 GLU CB C 127 30.340 29.463 0.877 1
1 481 . 11 1 1 A 38 38 GLU N N 127 120.691 118.920 1.771 1
1 482 . 11 1 1 A 39 39 LYS H H 128 7.891 7.961 -0.070 1
1 483 . 11 1 1 A 39 39 LYS HA H 128 4.870 4.830 0.040 1
1 492 . 11 1 1 A 39 39 LYS C C 128 175.452 175.917 -0.465 1
1 493 . 11 1 1 A 39 39 LYS CA C 128 53.540 54.707 -1.167 1
1 494 . 11 1 1 A 39 39 LYS CB C 128 33.630 34.679 -1.049 1
1 498 . 11 1 1 A 39 39 LYS N N 128 118.149 118.041 0.108 1
1 499 . 11 1 1 A 40 40 GLY H H 129 8.524 8.044 0.480 1
1 500 . 11 1 1 A 40 40 GLY HA2 H 129 4.973 4.089 0.884 1
1 501 . 11 1 1 A 40 40 GLY HA3 H 129 2.459 4.217 -1.758 1
1 502 . 11 1 1 A 40 40 GLY C C 129 169.943 171.840 -1.897 1
1 503 . 11 1 1 A 40 40 GLY CA C 129 42.910 45.122 -2.212 1
1 504 . 11 1 1 A 40 40 GLY N N 129 112.845 110.357 2.488 1
1 505 . 11 1 1 A 41 41 ILE H H 130 8.659 8.033 0.626 1
1 506 . 11 1 1 A 41 41 ILE HA H 130 4.591 4.759 -0.168 1
1 516 . 11 1 1 A 41 41 ILE C C 130 172.586 173.990 -1.404 1
1 517 . 11 1 1 A 41 41 ILE CA C 130 58.090 59.176 -1.086 1
1 518 . 11 1 1 A 41 41 ILE CB C 130 43.320 42.004 1.316 1
1 522 . 11 1 1 A 41 41 ILE N N 130 114.060 119.442 -5.382 1
1 523 . 11 1 1 A 42 42 PHE H H 131 9.206 8.799 0.407 1
1 524 . 11 1 1 A 42 42 PHE HA H 131 5.159 4.708 0.451 1
1 532 . 11 1 1 A 42 42 PHE C C 131 174.931 175.803 -0.872 1
1 533 . 11 1 1 A 42 42 PHE CA C 131 57.790 58.251 -0.461 1
1 534 . 11 1 1 A 42 42 PHE CB C 131 42.220 39.140 3.080 1
1 538 . 11 1 1 A 42 42 PHE N N 131 126.002 128.255 -2.253 1
1 539 . 11 1 1 A 43 43 VAL H H 132 8.502 8.836 -0.334 1
1 540 . 11 1 1 A 43 43 VAL HA H 132 4.921 4.681 0.240 1
1 548 . 11 1 1 A 43 43 VAL C C 132 178.219 175.337 2.882 1
1 549 . 11 1 1 A 43 43 VAL CA C 132 59.600 60.179 -0.579 1
1 550 . 11 1 1 A 43 43 VAL CB C 132 35.920 35.486 0.434 1
1 553 . 11 1 1 A 43 43 VAL N N 132 119.068 122.753 -3.685 1
1 554 . 11 1 1 A 44 44 LYS H H 133 10.036 8.808 1.228 1
1 555 . 11 1 1 A 44 44 LYS HA H 133 5.070 4.324 0.746 1
1 564 . 11 1 1 A 44 44 LYS C C 133 177.276 177.802 -0.526 1
1 565 . 11 1 1 A 44 44 LYS CA C 133 56.720 57.037 -0.317 1
1 566 . 11 1 1 A 44 44 LYS CB C 133 34.410 32.835 1.575 1
1 570 . 11 1 1 A 44 44 LYS N N 133 130.934 125.766 5.168 1
1 571 . 11 1 1 A 45 45 ASN H H 134 8.093 8.740 -0.647 1
1 572 . 11 1 1 A 45 45 ASN HA H 134 4.152 4.600 -0.448 1
1 577 . 11 1 1 A 45 45 ASN C C 134 174.087 175.142 -1.055 1
1 578 . 11 1 1 A 45 45 ASN CA C 134 55.360 55.782 -0.422 1
1 579 . 11 1 1 A 45 45 ASN CB C 134 37.530 39.230 -1.700 1
1 580 . 11 1 1 A 45 45 ASN N N 134 117.963 122.164 -4.201 1
1 582 . 11 1 1 A 46 46 SER H H 135 7.524 7.848 -0.324 1
1 583 . 11 1 1 A 46 46 SER HA H 135 4.219 4.716 -0.497 1
1 586 . 11 1 1 A 46 46 SER C C 135 174.490 174.351 0.139 1
1 587 . 11 1 1 A 46 46 SER CA C 135 57.090 55.534 1.556 1
1 588 . 11 1 1 A 46 46 SER CB C 135 63.860 66.581 -2.721 1
1 589 . 11 1 1 A 46 46 SER N N 135 105.939 108.817 -2.878 1
1 590 . 11 1 1 A 47 47 ASP H H 136 9.113 9.057 0.056 1
1 591 . 11 1 1 A 47 47 ASP HA H 136 4.220 4.240 -0.020 1
1 594 . 11 1 1 A 47 47 ASP CA C 136 57.610 57.146 0.464 1
1 595 . 11 1 1 A 47 47 ASP CB C 136 40.810 40.684 0.126 1
1 596 . 11 1 1 A 47 47 ASP N N 136 120.995 122.983 -1.988 1
1 597 . 11 1 1 A 48 48 GLY H H 137 8.181 8.083 0.098 1
1 598 . 11 1 1 A 48 48 GLY HA2 H 137 4.120 3.882 0.238 1
1 599 . 11 1 1 A 48 48 GLY HA3 H 137 3.659 3.883 -0.224 1
1 600 . 11 1 1 A 48 48 GLY C C 137 174.062 173.240 0.822 1
1 601 . 11 1 1 A 48 48 GLY CA C 137 45.130 45.682 -0.552 1
1 602 . 11 1 1 A 48 48 GLY N N 137 106.197 106.440 -0.243 1
1 603 . 11 1 1 A 49 49 SER H H 138 7.179 7.501 -0.322 1
1 604 . 11 1 1 A 49 49 SER HA H 138 4.383 4.953 -0.570 1
1 607 . 11 1 1 A 49 49 SER C C 138 173.864 173.028 0.836 1
1 608 . 11 1 1 A 49 49 SER CA C 138 57.614 57.472 0.142 1
1 609 . 11 1 1 A 49 49 SER CB C 138 65.100 67.185 -2.085 1
1 610 . 11 1 1 A 49 49 SER N N 138 115.015 114.271 0.744 1
1 611 . 11 1 1 A 50 50 ASP H H 139 8.078 8.395 -0.317 1
1 612 . 11 1 1 A 50 50 ASP HA H 139 4.642 4.777 -0.135 1
1 615 . 11 1 1 A 50 50 ASP C C 139 174.261 174.804 -0.543 1
1 616 . 11 1 1 A 50 50 ASP CA C 139 52.406 54.022 -1.616 1
1 617 . 11 1 1 A 50 50 ASP CB C 139 40.254 39.825 0.429 1
1 618 . 11 1 1 A 50 50 ASP N N 139 122.400 122.290 0.110 1
1 619 . 11 1 1 A 51 51 VAL H H 140 8.111 7.399 0.712 1
1 620 . 11 1 1 A 51 51 VAL HA H 140 4.360 4.832 -0.472 1
1 628 . 11 1 1 A 51 51 VAL C C 140 176.147 173.691 2.456 1
1 629 . 11 1 1 A 51 51 VAL CA C 140 62.670 60.249 2.421 1
1 630 . 11 1 1 A 51 51 VAL CB C 140 33.930 33.728 0.202 1
1 632 . 11 1 1 A 51 51 VAL N N 140 120.374 119.642 0.732 1
1 633 . 11 1 1 A 52 52 CYS H H 141 8.358 9.130 -0.772 1
1 634 . 11 1 1 A 52 52 CYS HA H 141 4.957 5.499 -0.542 1
1 637 . 11 1 1 A 52 52 CYS C C 141 173.070 172.766 0.304 1
1 638 . 11 1 1 A 52 52 CYS CA C 141 53.380 54.481 -1.101 1
1 639 . 11 1 1 A 52 52 CYS CB C 141 46.110 45.998 0.112 1
1 640 . 11 1 1 A 52 52 CYS N N 141 121.305 129.143 -7.838 1
1 641 . 11 1 1 A 53 53 THR H H 142 8.929 8.759 0.170 1
1 642 . 11 1 1 A 53 53 THR HA H 142 4.498 4.885 -0.387 1
1 648 . 11 1 1 A 53 53 THR C C 142 172.151 172.366 -0.215 1
1 649 . 11 1 1 A 53 53 THR CA C 142 62.960 61.163 1.797 1
1 650 . 11 1 1 A 53 53 THR CB C 142 70.540 72.864 -2.324 1
1 652 . 11 1 1 A 53 53 THR N N 142 120.105 118.937 1.168 1
1 653 . 11 1 1 A 54 54 LEU H H 143 8.448 8.595 -0.147 1
1 654 . 11 1 1 A 54 54 LEU HA H 143 4.322 4.726 -0.404 1
1 664 . 11 1 1 A 54 54 LEU C C 143 174.484 174.483 0.001 1
1 665 . 11 1 1 A 54 54 LEU CA C 143 54.596 53.403 1.193 1
1 666 . 11 1 1 A 54 54 LEU CB C 143 42.396 43.736 -1.340 1
1 670 . 11 1 1 A 54 54 LEU N N 143 128.819 128.827 -0.008 1
1 671 . 11 1 1 A 55 55 PHE H H 144 8.661 8.645 0.016 1
1 672 . 11 1 1 A 55 55 PHE HA H 144 5.459 4.968 0.491 1
1 680 . 11 1 1 A 55 55 PHE C C 144 176.035 174.678 1.357 1
1 681 . 11 1 1 A 55 55 PHE CA C 144 55.020 56.746 -1.726 1
1 682 . 11 1 1 A 55 55 PHE CB C 144 44.100 42.652 1.448 1
1 686 . 11 1 1 A 55 55 PHE N N 144 121.897 125.928 -4.031 1
1 687 . 11 1 1 A 56 56 ASP H H 145 11.616 8.555 3.061 1
1 688 . 11 1 1 A 56 56 ASP HA H 145 4.417 4.704 -0.287 1
1 691 . 11 1 1 A 56 56 ASP C C 145 176.748 177.078 -0.330 1
1 692 . 11 1 1 A 56 56 ASP CA C 145 55.844 54.154 1.690 1
1 693 . 11 1 1 A 56 56 ASP CB C 145 44.390 43.211 1.179 1
1 694 . 11 1 1 A 56 56 ASP N N 145 122.131 121.236 0.895 1
1 695 . 11 1 1 A 57 57 ALA H H 146 8.508 9.039 -0.531 1
1 696 . 11 1 1 A 57 57 ALA HA H 146 3.797 4.076 -0.279 1
1 700 . 11 1 1 A 57 57 ALA C C 146 178.696 180.029 -1.333 1
1 701 . 11 1 1 A 57 57 ALA CA C 146 55.990 55.329 0.661 1
1 702 . 11 1 1 A 57 57 ALA CB C 146 18.840 18.172 0.668 1
1 703 . 11 1 1 A 57 57 ALA N N 146 130.243 128.281 1.962 1
1 704 . 11 1 1 A 58 58 ALA H H 147 8.378 7.674 0.704 1
1 705 . 11 1 1 A 58 58 ALA HA H 147 4.078 4.212 -0.134 1
1 709 . 11 1 1 A 58 58 ALA C C 147 181.091 179.760 1.331 1
1 710 . 11 1 1 A 58 58 ALA CA C 147 54.770 54.963 -0.193 1
1 711 . 11 1 1 A 58 58 ALA CB C 147 17.700 18.483 -0.783 1
1 712 . 11 1 1 A 58 58 ALA N N 147 121.997 120.068 1.929 1
1 713 . 11 1 1 A 59 59 ALA H H 148 9.138 7.999 1.139 1
1 714 . 11 1 1 A 59 59 ALA HA H 148 3.975 4.077 -0.102 1
1 718 . 11 1 1 A 59 59 ALA C C 148 180.508 179.773 0.735 1
1 719 . 11 1 1 A 59 59 ALA CA C 148 54.840 55.047 -0.207 1
1 720 . 11 1 1 A 59 59 ALA CB C 148 18.600 18.682 -0.082 1
1 721 . 11 1 1 A 59 59 ALA N N 148 123.595 120.409 3.186 1
1 722 . 11 1 1 A 60 60 PHE H H 149 8.814 7.976 0.838 1
1 723 . 11 1 1 A 60 60 PHE HA H 149 3.722 3.966 -0.244 1
1 731 . 11 1 1 A 60 60 PHE C C 149 176.773 177.414 -0.641 1
1 732 . 11 1 1 A 60 60 PHE CA C 149 62.030 61.437 0.593 1
1 733 . 11 1 1 A 60 60 PHE CB C 149 39.960 38.690 1.270 1
1 737 . 11 1 1 A 60 60 PHE N N 149 120.354 119.956 0.398 1
1 738 . 11 1 1 A 61 61 SER H H 150 8.276 8.256 0.020 1
1 739 . 11 1 1 A 61 61 SER HA H 150 3.880 3.996 -0.116 1
1 742 . 11 1 1 A 61 61 SER C C 150 177.691 176.433 1.258 1
1 743 . 11 1 1 A 61 61 SER CA C 150 62.190 61.532 0.658 1
1 744 . 11 1 1 A 61 61 SER CB C 150 63.016 62.879 0.137 1
1 745 . 11 1 1 A 61 61 SER N N 150 112.086 114.103 -2.017 1
1 746 . 11 1 1 A 62 62 ARG H H 151 7.829 7.794 0.035 1
1 747 . 11 1 1 A 62 62 ARG HA H 151 3.971 4.043 -0.072 1
1 754 . 11 1 1 A 62 62 ARG C C 151 178.287 178.364 -0.077 1
1 755 . 11 1 1 A 62 62 ARG CA C 151 59.340 58.896 0.444 1
1 756 . 11 1 1 A 62 62 ARG CB C 151 29.760 29.744 0.016 1
1 759 . 11 1 1 A 62 62 ARG N N 151 121.090 119.207 1.883 1
1 760 . 11 1 1 A 63 63 LEU H H 152 7.390 7.526 -0.136 1
1 761 . 11 1 1 A 63 63 LEU HA H 152 3.791 3.949 -0.158 1
1 771 . 11 1 1 A 63 63 LEU C C 152 179.106 178.216 0.890 1
1 772 . 11 1 1 A 63 63 LEU CA C 152 58.900 58.175 0.725 1
1 773 . 11 1 1 A 63 63 LEU CB C 152 41.140 41.138 0.002 1
1 777 . 11 1 1 A 63 63 LEU N N 152 121.129 122.038 -0.909 1
1 778 . 11 1 1 A 64 64 VAL H H 153 7.552 7.843 -0.291 1
1 779 . 11 1 1 A 64 64 VAL HA H 153 3.411 3.461 -0.050 1
1 787 . 11 1 1 A 64 64 VAL C C 153 180.595 178.925 1.670 1
1 788 . 11 1 1 A 64 64 VAL CA C 153 65.644 66.176 -0.532 1
1 789 . 11 1 1 A 64 64 VAL CB C 153 31.410 31.429 -0.019 1
1 792 . 11 1 1 A 64 64 VAL N N 153 118.280 118.887 -0.607 1
1 793 . 11 1 1 A 65 65 GLY H H 154 8.061 8.174 -0.113 1
1 794 . 11 1 1 A 65 65 GLY HA2 H 154 3.846 3.808 0.038 1
1 795 . 11 1 1 A 65 65 GLY HA3 H 154 3.809 3.809 0.000 1
1 796 . 11 1 1 A 65 65 GLY C C 154 175.235 176.246 -1.011 1
1 797 . 11 1 1 A 65 65 GLY CA C 154 46.630 46.724 -0.094 1
1 798 . 11 1 1 A 65 65 GLY N N 154 108.622 107.606 1.016 1
1 799 . 11 1 1 A 66 66 GLU H H 155 7.528 7.657 -0.129 1
1 800 . 11 1 1 A 66 66 GLU HA H 155 4.228 4.246 -0.018 1
1 805 . 11 1 1 A 66 66 GLU C C 155 176.761 177.306 -0.545 1
1 806 . 11 1 1 A 66 66 GLU CA C 155 56.590 56.817 -0.227 1
1 807 . 11 1 1 A 66 66 GLU CB C 155 30.490 29.869 0.621 1
1 809 . 11 1 1 A 66 66 GLU N N 155 118.361 119.122 -0.761 1
1 810 . 11 1 1 A 67 67 GLY H H 156 7.884 8.191 -0.307 1
1 811 . 11 1 1 A 67 67 GLY HA2 H 156 3.918 3.890 0.028 1
1 812 . 11 1 1 A 67 67 GLY HA3 H 156 3.747 3.901 -0.154 1
1 813 . 11 1 1 A 67 67 GLY C C 156 174.788 174.309 0.479 1
1 814 . 11 1 1 A 67 67 GLY CA C 156 45.890 46.405 -0.515 1
1 815 . 11 1 1 A 67 67 GLY N N 156 108.465 108.787 -0.322 1
1 816 . 11 1 1 A 68 68 LEU H H 157 7.332 7.377 -0.045 1
1 817 . 11 1 1 A 68 68 LEU HA H 157 4.361 4.767 -0.406 1
1 827 . 11 1 1 A 68 68 LEU CA C 157 53.060 51.649 1.411 1
1 828 . 11 1 1 A 68 68 LEU CB C 157 41.100 43.957 -2.857 1
1 832 . 11 1 1 A 68 68 LEU N N 157 121.920 120.782 1.138 1
1 833 . 11 1 1 A 69 69 PRO HA H 158 4.485 4.618 -0.133 1
1 840 . 11 1 1 A 69 69 PRO C C 158 174.602 176.309 -1.707 1
1 841 . 11 1 1 A 69 69 PRO CA C 158 61.556 62.184 -0.628 1
1 842 . 11 1 1 A 69 69 PRO CB C 158 32.370 32.806 -0.436 1
1 845 . 11 1 1 A 70 70 HIS H H 159 8.734 8.731 0.003 1
1 846 . 11 1 1 A 70 70 HIS HA H 159 3.947 4.480 -0.533 1
1 852 . 11 1 1 A 70 70 HIS CA C 159 56.250 55.243 1.007 1
1 853 . 11 1 1 A 70 70 HIS CB C 159 32.280 30.971 1.309 1
1 856 . 11 1 1 A 70 70 HIS N N 159 119.423 121.712 -2.289 1
1 857 . 11 1 1 A 71 71 PRO HA H 160 4.424 4.169 0.255 1
1 864 . 11 1 1 A 71 71 PRO C C 160 177.567 179.167 -1.600 1
1 865 . 11 1 1 A 71 71 PRO CA C 160 64.574 65.978 -1.404 1
1 866 . 11 1 1 A 71 71 PRO CB C 160 32.340 31.824 0.516 1
1 869 . 11 1 1 A 72 72 LEU H H 161 10.123 7.436 2.687 1
1 870 . 11 1 1 A 72 72 LEU HA H 161 4.778 4.189 0.589 1
1 880 . 11 1 1 A 72 72 LEU C C 161 178.721 177.975 0.746 1
1 881 . 11 1 1 A 72 72 LEU CA C 161 55.800 57.694 -1.894 1
1 882 . 11 1 1 A 72 72 LEU CB C 161 42.440 41.921 0.519 1
1 886 . 11 1 1 A 72 72 LEU N N 161 117.374 117.681 -0.307 1
1 887 . 11 1 1 A 73 73 THR H H 162 7.523 7.732 -0.209 1
1 888 . 11 1 1 A 73 73 THR HA H 162 4.291 4.538 -0.247 1
1 893 . 11 1 1 A 73 73 THR C C 162 175.557 174.308 1.249 1
1 894 . 11 1 1 A 73 73 THR CA C 162 61.440 62.771 -1.331 1
1 895 . 11 1 1 A 73 73 THR CB C 162 70.500 69.721 0.779 1
1 897 . 11 1 1 A 73 73 THR N N 162 107.787 111.738 -3.951 1
1 898 . 11 1 1 A 74 74 ARG H H 163 8.361 7.751 0.610 1
1 899 . 11 1 1 A 74 74 ARG HA H 163 3.836 4.330 -0.494 1
1 906 . 11 1 1 A 74 74 ARG C C 163 174.701 175.071 -0.370 1
1 907 . 11 1 1 A 74 74 ARG CA C 163 57.980 57.529 0.451 1
1 908 . 11 1 1 A 74 74 ARG CB C 163 26.770 26.787 -0.017 1
1 911 . 11 1 1 A 74 74 ARG N N 163 115.130 118.444 -3.314 1
1 912 . 11 1 1 A 75 75 GLU H H 164 7.430 8.042 -0.612 1
1 913 . 11 1 1 A 75 75 GLU HA H 164 4.636 4.514 0.122 1
1 918 . 11 1 1 A 75 75 GLU CA C 164 53.699 54.898 -1.199 1
1 919 . 11 1 1 A 75 75 GLU CB C 164 29.550 28.569 0.981 1
1 921 . 11 1 1 A 75 75 GLU N N 164 120.076 119.046 1.030 1
1 922 . 11 1 1 A 76 76 PRO HA H 165 4.272 4.498 -0.226 1
1 929 . 11 1 1 A 76 76 PRO C C 165 176.649 177.091 -0.442 1
1 930 . 11 1 1 A 76 76 PRO CA C 165 63.204 63.014 0.190 1
1 931 . 11 1 1 A 76 76 PRO CB C 165 31.680 31.549 0.131 1
1 934 . 11 1 1 A 77 77 ILE H H 166 8.812 8.224 0.588 1
1 935 . 11 1 1 A 77 77 ILE HA H 166 3.838 4.317 -0.479 1
1 945 . 11 1 1 A 77 77 ILE C C 166 175.235 176.031 -0.796 1
1 946 . 11 1 1 A 77 77 ILE CA C 166 62.816 61.246 1.570 1
1 947 . 11 1 1 A 77 77 ILE CB C 166 37.750 37.193 0.557 1
1 951 . 11 1 1 A 77 77 ILE N N 166 123.831 124.069 -0.238 1
1 952 . 11 1 1 A 78 78 THR H H 167 6.625 8.548 -1.923 1
1 953 . 11 1 1 A 78 78 THR HA H 167 4.632 5.038 -0.406 1
1 958 . 11 1 1 A 78 78 THR C C 167 174.143 174.577 -0.434 1
1 959 . 11 1 1 A 78 78 THR CA C 167 58.750 59.886 -1.136 1
1 960 . 11 1 1 A 78 78 THR CB C 167 71.320 71.328 -0.008 1
1 962 . 11 1 1 A 78 78 THR N N 167 115.293 118.622 -3.329 1
1 963 . 11 1 1 A 79 79 ALA H H 168 9.088 9.030 0.058 1
1 964 . 11 1 1 A 79 79 ALA HA H 168 3.916 4.087 -0.171 1
1 968 . 11 1 1 A 79 79 ALA C C 168 179.770 179.493 0.277 1
1 969 . 11 1 1 A 79 79 ALA CA C 168 55.480 55.245 0.235 1
1 970 . 11 1 1 A 79 79 ALA CB C 168 17.630 18.329 -0.699 1
1 971 . 11 1 1 A 79 79 ALA N N 168 122.102 127.408 -5.306 1
1 972 . 11 1 1 A 80 80 SER H H 169 7.988 7.445 0.543 1
1 973 . 11 1 1 A 80 80 SER HA H 169 4.091 4.214 -0.123 1
1 976 . 11 1 1 A 80 80 SER C C 169 175.836 176.434 -0.598 1
1 977 . 11 1 1 A 80 80 SER CA C 169 60.750 61.538 -0.788 1
1 978 . 11 1 1 A 80 80 SER CB C 169 62.510 63.035 -0.525 1
1 979 . 11 1 1 A 80 80 SER N N 169 109.660 113.703 -4.043 1
1 980 . 11 1 1 A 81 81 ILE H H 170 7.052 7.719 -0.667 1
1 981 . 11 1 1 A 81 81 ILE HA H 170 4.344 4.007 0.337 1
1 991 . 11 1 1 A 81 81 ILE C C 170 174.236 176.550 -2.314 1
1 992 . 11 1 1 A 81 81 ILE CA C 170 61.760 64.143 -2.383 1
1 993 . 11 1 1 A 81 81 ILE CB C 170 37.950 37.293 0.657 1
1 997 . 11 1 1 A 81 81 ILE N N 170 112.623 114.716 -2.093 1
1 998 . 11 1 1 A 82 82 ILE H H 171 7.345 7.118 0.227 1
1 999 . 11 1 1 A 82 82 ILE HA H 171 4.288 4.016 0.272 1
1 1009 . 11 1 1 A 82 82 ILE C C 171 174.931 175.260 -0.329 1
1 1010 . 11 1 1 A 82 82 ILE CA C 171 61.420 61.779 -0.359 1
1 1011 . 11 1 1 A 82 82 ILE CB C 171 37.230 37.800 -0.570 1
1 1015 . 11 1 1 A 82 82 ILE N N 171 124.260 124.930 -0.670 1
1 1016 . 11 1 1 A 83 83 VAL H H 172 7.843 8.753 -0.910 1
1 1017 . 11 1 1 A 83 83 VAL HA H 172 4.818 5.058 -0.240 1
1 1025 . 11 1 1 A 83 83 VAL C C 172 174.918 175.640 -0.722 1
1 1026 . 11 1 1 A 83 83 VAL CA C 172 58.910 59.159 -0.249 1
1 1027 . 11 1 1 A 83 83 VAL CB C 172 34.570 35.142 -0.572 1
1 1030 . 11 1 1 A 83 83 VAL N N 172 118.856 121.867 -3.011 1
1 1031 . 11 1 1 A 84 84 LYS H H 173 8.347 8.780 -0.433 1
1 1032 . 11 1 1 A 84 84 LYS HA H 173 4.356 4.569 -0.213 1
1 1041 . 11 1 1 A 84 84 LYS C C 173 178.653 178.564 0.089 1
1 1042 . 11 1 1 A 84 84 LYS CA C 173 56.360 55.540 0.820 1
1 1043 . 11 1 1 A 84 84 LYS CB C 173 33.366 33.404 -0.038 1
1 1047 . 11 1 1 A 84 84 LYS N N 173 119.602 121.850 -2.248 1
1 1048 . 11 1 1 A 85 85 HIS H H 174 9.143 9.006 0.137 1
1 1049 . 11 1 1 A 85 85 HIS HA H 174 4.013 4.313 -0.300 1
1 1053 . 11 1 1 A 85 85 HIS C C 174 176.606 176.774 -0.168 1
1 1054 . 11 1 1 A 85 85 HIS CA C 174 58.820 60.530 -1.710 1
1 1055 . 11 1 1 A 85 85 HIS CB C 174 28.186 29.834 -1.648 1
1 1057 . 11 1 1 A 85 85 HIS N N 174 120.022 122.598 -2.576 1
1 1058 . 11 1 1 A 86 86 GLU H H 175 8.403 8.333 0.070 1
1 1059 . 11 1 1 A 86 86 GLU HA H 175 3.863 3.777 0.086 1
1 1064 . 11 1 1 A 86 86 GLU C C 175 177.040 179.029 -1.989 1
1 1065 . 11 1 1 A 86 86 GLU CA C 175 57.830 60.025 -2.195 1
1 1066 . 11 1 1 A 86 86 GLU CB C 175 28.690 29.290 -0.600 1
1 1068 . 11 1 1 A 86 86 GLU N N 175 116.124 118.041 -1.917 1
1 1069 . 11 1 1 A 87 87 GLU H H 176 7.669 7.964 -0.295 1
1 1070 . 11 1 1 A 87 87 GLU HA H 176 4.039 3.978 0.061 1
1 1075 . 11 1 1 A 87 87 GLU C C 176 175.688 177.389 -1.701 1
1 1076 . 11 1 1 A 87 87 GLU CA C 176 57.906 59.127 -1.221 1
1 1077 . 11 1 1 A 87 87 GLU CB C 176 30.430 28.924 1.506 1
1 1079 . 11 1 1 A 87 87 GLU N N 176 116.183 119.493 -3.310 1
1 1080 . 11 1 1 A 88 88 CYS H H 177 6.750 7.139 -0.389 1
1 1081 . 11 1 1 A 88 88 CYS HA H 177 4.991 4.553 0.438 1
1 1084 . 11 1 1 A 88 88 CYS C C 177 172.325 173.434 -1.109 1
1 1085 . 11 1 1 A 88 88 CYS CA C 177 55.030 54.174 0.856 1
1 1086 . 11 1 1 A 88 88 CYS CB C 177 45.610 42.157 3.453 1
1 1087 . 11 1 1 A 88 88 CYS N N 177 114.838 116.980 -2.142 1
1 1088 . 11 1 1 A 89 89 ILE H H 178 9.128 8.703 0.425 1
1 1089 . 11 1 1 A 89 89 ILE HA H 178 4.536 4.921 -0.385 1
1 1099 . 11 1 1 A 89 89 ILE C C 178 174.893 174.385 0.508 1
1 1100 . 11 1 1 A 89 89 ILE CA C 178 59.160 59.467 -0.307 1
1 1101 . 11 1 1 A 89 89 ILE CB C 178 41.840 40.612 1.228 1
1 1105 . 11 1 1 A 89 89 ILE N N 178 120.564 121.579 -1.015 1
1 1106 . 11 1 1 A 90 90 TYR H H 179 9.349 9.024 0.325 1
1 1107 . 11 1 1 A 90 90 TYR HA H 179 3.568 4.097 -0.529 1
1 1112 . 11 1 1 A 90 90 TYR C C 179 173.950 174.030 -0.080 1
1 1113 . 11 1 1 A 90 90 TYR CA C 179 61.180 57.384 3.796 1
1 1114 . 11 1 1 A 90 90 TYR CB C 179 37.530 38.195 -0.665 1
1 1116 . 11 1 1 A 90 90 TYR N N 179 129.033 127.149 1.884 1
1 1117 . 11 1 1 A 91 91 ASP H H 180 7.367 8.362 -0.995 1
1 1118 . 11 1 1 A 91 91 ASP HA H 180 4.662 4.582 0.080 1
1 1121 . 11 1 1 A 91 91 ASP C C 180 175.291 176.012 -0.721 1
1 1122 . 11 1 1 A 91 91 ASP CA C 180 52.230 53.140 -0.910 1
1 1123 . 11 1 1 A 91 91 ASP CB C 180 43.650 41.782 1.868 1
1 1124 . 11 1 1 A 91 91 ASP N N 180 129.305 128.896 0.409 1
1 1125 . 11 1 1 A 92 92 ASP H H 181 8.783 8.644 0.139 1
1 1126 . 11 1 1 A 92 92 ASP HA H 181 4.114 3.857 0.257 1
1 1129 . 11 1 1 A 92 92 ASP C C 181 177.573 178.183 -0.610 1
1 1130 . 11 1 1 A 92 92 ASP CA C 181 56.390 56.659 -0.269 1
1 1131 . 11 1 1 A 92 92 ASP CB C 181 41.330 40.273 1.057 1
1 1132 . 11 1 1 A 92 92 ASP N N 181 125.665 125.572 0.093 1
1 1133 . 11 1 1 A 93 93 THR H H 182 8.284 7.466 0.818 1
1 1134 . 11 1 1 A 93 93 THR HA H 182 4.037 3.913 0.124 1
1 1139 . 11 1 1 A 93 93 THR C C 182 176.333 175.998 0.335 1
1 1140 . 11 1 1 A 93 93 THR CA C 182 65.320 66.522 -1.202 1
1 1141 . 11 1 1 A 93 93 THR CB C 182 68.560 68.247 0.313 1
1 1143 . 11 1 1 A 93 93 THR N N 182 114.688 117.150 -2.462 1
1 1144 . 11 1 1 A 94 94 ARG H H 183 7.784 7.519 0.265 1
1 1145 . 11 1 1 A 94 94 ARG HA H 183 4.142 4.251 -0.109 1
1 1152 . 11 1 1 A 94 94 ARG C C 183 177.015 177.049 -0.034 1
1 1153 . 11 1 1 A 94 94 ARG CA C 183 55.350 56.123 -0.773 1
1 1154 . 11 1 1 A 94 94 ARG CB C 183 30.930 30.986 -0.056 1
1 1157 . 11 1 1 A 94 94 ARG N N 183 120.156 118.261 1.895 1
1 1158 . 11 1 1 A 95 95 GLY H H 184 8.144 8.923 -0.779 1
1 1159 . 11 1 1 A 95 95 GLY HA2 H 184 3.839 3.891 -0.052 1
1 1160 . 11 1 1 A 95 95 GLY HA3 H 184 3.681 3.946 -0.265 1
1 1161 . 11 1 1 A 95 95 GLY C C 184 173.653 173.316 0.337 1
1 1162 . 11 1 1 A 95 95 GLY CA C 184 46.160 46.337 -0.177 1
1 1163 . 11 1 1 A 95 95 GLY N N 184 107.879 108.980 -1.101 1
1 1164 . 11 1 1 A 96 96 ASN H H 185 6.855 7.241 -0.386 1
1 1165 . 11 1 1 A 96 96 ASN HA H 185 4.909 5.129 -0.220 1
1 1170 . 11 1 1 A 96 96 ASN C C 185 174.223 173.301 0.922 1
1 1171 . 11 1 1 A 96 96 ASN CA C 185 52.720 52.379 0.341 1
1 1172 . 11 1 1 A 96 96 ASN CB C 185 45.620 41.961 3.659 1
1 1173 . 11 1 1 A 96 96 ASN N N 185 113.382 116.395 -3.013 1
1 1175 . 11 1 1 A 97 97 PHE H H 186 9.228 8.727 0.501 1
1 1176 . 11 1 1 A 97 97 PHE HA H 186 4.579 4.967 -0.388 1
1 1183 . 11 1 1 A 97 97 PHE C C 186 174.794 175.512 -0.718 1
1 1184 . 11 1 1 A 97 97 PHE CA C 186 59.384 58.786 0.598 1
1 1185 . 11 1 1 A 97 97 PHE CB C 186 40.450 39.212 1.238 1
1 1188 . 11 1 1 A 97 97 PHE N N 186 118.661 119.695 -1.034 1
1 1189 . 11 1 1 A 98 98 ILE H H 187 8.908 9.061 -0.153 1
1 1190 . 11 1 1 A 98 98 ILE HA H 187 5.440 4.877 0.563 1
1 1200 . 11 1 1 A 98 98 ILE C C 187 176.171 174.962 1.209 1
1 1201 . 11 1 1 A 98 98 ILE CA C 187 57.610 59.761 -2.151 1
1 1202 . 11 1 1 A 98 98 ILE CB C 187 41.280 41.145 0.135 1
1 1206 . 11 1 1 A 98 98 ILE N N 187 120.585 123.485 -2.900 1
1 1207 . 11 1 1 A 99 99 ILE H H 188 8.602 8.608 -0.006 1
1 1208 . 11 1 1 A 99 99 ILE HA H 188 4.546 4.643 -0.097 1
1 1218 . 11 1 1 A 99 99 ILE C C 188 176.668 174.423 2.245 1
1 1219 . 11 1 1 A 99 99 ILE CA C 188 58.920 61.078 -2.158 1
1 1220 . 11 1 1 A 99 99 ILE CB C 188 37.960 37.218 0.742 1
1 1224 . 11 1 1 A 99 99 ILE N N 188 124.500 126.574 -2.074 1
1 1225 . 11 1 1 A 100 100 LYS H H 189 8.449 8.927 -0.478 1
1 1226 . 11 1 1 A 100 100 LYS HA H 189 4.108 4.732 -0.624 1
1 1235 . 11 1 1 A 100 100 LYS C C 189 176.866 176.174 0.692 1
1 1236 . 11 1 1 A 100 100 LYS CA C 189 56.800 54.893 1.907 1
1 1237 . 11 1 1 A 100 100 LYS CB C 189 33.400 33.521 -0.121 1
1 1241 . 11 1 1 A 100 100 LYS N N 189 128.581 129.161 -0.580 1
1 1242 . 11 1 1 A 101 101 GLY H H 190 8.381 8.291 0.090 1
1 1243 . 11 1 1 A 101 101 GLY HA2 H 190 3.946 4.061 -0.115 1
1 1244 . 11 1 1 A 101 101 GLY HA3 H 190 3.828 4.063 -0.235 1
1 1245 . 11 1 1 A 101 101 GLY C C 190 172.902 173.409 -0.507 1
1 1246 . 11 1 1 A 101 101 GLY CA C 190 44.920 45.075 -0.155 1
1 1247 . 11 1 1 A 101 101 GLY N N 190 111.183 113.478 -2.295 1
1 7 . 12 1 1 A 2 2 GLN H H 91 8.786 7.736 1.050 1
1 8 . 12 1 1 A 2 2 GLN HA H 91 4.005 4.087 -0.082 1
1 15 . 12 1 1 A 2 2 GLN C C 91 177.270 178.730 -1.460 1
1 16 . 12 1 1 A 2 2 GLN CA C 91 58.220 58.647 -0.427 1
1 17 . 12 1 1 A 2 2 GLN CB C 91 28.650 28.205 0.445 1
1 19 . 12 1 1 A 2 2 GLN N N 91 121.993 121.389 0.604 1
1 21 . 12 1 1 A 3 3 GLU H H 92 8.430 8.401 0.029 1
1 22 . 12 1 1 A 3 3 GLU HA H 92 4.007 4.051 -0.044 1
1 27 . 12 1 1 A 3 3 GLU C C 92 178.287 178.560 -0.273 1
1 28 . 12 1 1 A 3 3 GLU CA C 92 59.490 59.547 -0.057 1
1 29 . 12 1 1 A 3 3 GLU CB C 92 29.506 29.267 0.239 1
1 31 . 12 1 1 A 3 3 GLU N N 92 120.195 120.180 0.015 1
1 32 . 12 1 1 A 4 4 SER H H 93 8.209 7.494 0.715 1
1 33 . 12 1 1 A 4 4 SER HA H 93 4.272 4.273 -0.001 1
1 36 . 12 1 1 A 4 4 SER C C 93 177.369 177.441 -0.072 1
1 37 . 12 1 1 A 4 4 SER CA C 93 61.044 61.241 -0.197 1
1 38 . 12 1 1 A 4 4 SER CB C 93 62.950 62.819 0.131 1
1 39 . 12 1 1 A 4 4 SER N N 93 115.524 114.291 1.233 1
1 40 . 12 1 1 A 5 5 ILE H H 94 8.080 7.613 0.467 1
1 41 . 12 1 1 A 5 5 ILE HA H 94 3.530 3.622 -0.092 1
1 51 . 12 1 1 A 5 5 ILE C C 94 177.778 177.383 0.395 1
1 52 . 12 1 1 A 5 5 ILE CA C 94 65.710 65.262 0.448 1
1 53 . 12 1 1 A 5 5 ILE CB C 94 37.800 37.539 0.261 1
1 57 . 12 1 1 A 5 5 ILE N N 94 124.148 122.072 2.076 1
1 58 . 12 1 1 A 6 6 GLN H H 95 8.374 8.342 0.032 1
1 59 . 12 1 1 A 6 6 GLN HA H 95 4.125 3.988 0.137 1
1 66 . 12 1 1 A 6 6 GLN C C 95 179.726 179.296 0.430 1
1 67 . 12 1 1 A 6 6 GLN CA C 95 59.190 59.117 0.073 1
1 68 . 12 1 1 A 6 6 GLN CB C 95 27.060 28.406 -1.346 1
1 70 . 12 1 1 A 6 6 GLN N N 95 118.257 118.309 -0.052 1
1 72 . 12 1 1 A 7 7 ASN H H 96 8.456 8.056 0.400 1
1 73 . 12 1 1 A 7 7 ASN HA H 96 4.446 4.501 -0.055 1
1 78 . 12 1 1 A 7 7 ASN C C 96 177.257 178.357 -1.100 1
1 79 . 12 1 1 A 7 7 ASN CA C 96 56.020 56.244 -0.224 1
1 80 . 12 1 1 A 7 7 ASN CB C 96 38.126 37.913 0.213 1
1 81 . 12 1 1 A 7 7 ASN N N 96 118.597 118.277 0.320 1
1 83 . 12 1 1 A 8 8 LYS H H 97 7.732 7.570 0.162 1
1 84 . 12 1 1 A 8 8 LYS HA H 97 4.129 4.127 0.002 1
1 93 . 12 1 1 A 8 8 LYS C C 97 179.143 179.215 -0.072 1
1 94 . 12 1 1 A 8 8 LYS CA C 97 59.126 59.312 -0.186 1
1 95 . 12 1 1 A 8 8 LYS CB C 97 32.070 32.158 -0.088 1
1 99 . 12 1 1 A 8 8 LYS N N 97 122.381 118.801 3.580 1
1 100 . 12 1 1 A 9 9 ILE H H 98 8.452 7.969 0.483 1
1 101 . 12 1 1 A 9 9 ILE HA H 98 3.480 3.957 -0.477 1
1 111 . 12 1 1 A 9 9 ILE C C 98 177.406 178.264 -0.858 1
1 112 . 12 1 1 A 9 9 ILE CA C 98 66.430 64.078 2.352 1
1 113 . 12 1 1 A 9 9 ILE CB C 98 37.980 37.050 0.930 1
1 117 . 12 1 1 A 9 9 ILE N N 98 119.950 120.074 -0.124 1
1 118 . 12 1 1 A 10 10 SER H H 99 7.924 7.728 0.196 1
1 119 . 12 1 1 A 10 10 SER HA H 99 3.983 4.239 -0.256 1
1 122 . 12 1 1 A 10 10 SER C C 99 176.327 176.283 0.044 1
1 123 . 12 1 1 A 10 10 SER CA C 99 61.990 61.288 0.702 1
1 124 . 12 1 1 A 10 10 SER CB C 99 62.790 62.898 -0.108 1
1 125 . 12 1 1 A 10 10 SER N N 99 113.568 117.504 -3.936 1
1 126 . 12 1 1 A 11 11 GLN H H 100 7.832 7.852 -0.020 1
1 127 . 12 1 1 A 11 11 GLN HA H 100 4.238 4.357 -0.119 1
1 134 . 12 1 1 A 11 11 GLN C C 100 178.088 178.106 -0.018 1
1 135 . 12 1 1 A 11 11 GLN CA C 100 57.900 58.261 -0.361 1
1 136 . 12 1 1 A 11 11 GLN CB C 100 29.790 29.447 0.343 1
1 138 . 12 1 1 A 11 11 GLN N N 100 117.487 118.128 -0.641 1
1 140 . 12 1 1 A 12 12 CYS H H 101 7.920 8.310 -0.390 1
1 141 . 12 1 1 A 12 12 CYS HA H 101 4.657 4.532 0.125 1
1 144 . 12 1 1 A 12 12 CYS C C 101 175.439 174.867 0.572 1
1 145 . 12 1 1 A 12 12 CYS CA C 101 60.654 60.753 -0.099 1
1 146 . 12 1 1 A 12 12 CYS CB C 101 29.310 26.997 2.313 1
1 147 . 12 1 1 A 12 12 CYS N N 101 114.221 117.061 -2.840 1
1 148 . 12 1 1 A 13 13 LYS H H 102 7.993 7.459 0.534 1
1 149 . 12 1 1 A 13 13 LYS HA H 102 5.038 4.455 0.583 1
1 158 . 12 1 1 A 13 13 LYS C C 102 174.757 176.243 -1.486 1
1 159 . 12 1 1 A 13 13 LYS CA C 102 56.660 56.181 0.479 1
1 160 . 12 1 1 A 13 13 LYS CB C 102 32.970 33.302 -0.332 1
1 164 . 12 1 1 A 13 13 LYS N N 102 123.841 119.725 4.116 1
1 165 . 12 1 1 A 14 14 PHE H H 103 8.822 8.438 0.384 1
1 166 . 12 1 1 A 14 14 PHE HA H 103 5.058 5.073 -0.015 1
1 174 . 12 1 1 A 14 14 PHE C C 103 173.560 172.127 1.433 1
1 175 . 12 1 1 A 14 14 PHE CA C 103 55.470 55.975 -0.505 1
1 176 . 12 1 1 A 14 14 PHE CB C 103 41.760 40.610 1.150 1
1 180 . 12 1 1 A 14 14 PHE N N 103 118.421 116.520 1.901 1
1 181 . 12 1 1 A 15 15 SER H H 104 8.826 8.615 0.211 1
1 182 . 12 1 1 A 15 15 SER HA H 104 4.602 4.746 -0.144 1
1 185 . 12 1 1 A 15 15 SER C C 104 173.851 172.800 1.051 1
1 186 . 12 1 1 A 15 15 SER CA C 104 58.610 57.920 0.690 1
1 187 . 12 1 1 A 15 15 SER CB C 104 62.690 63.026 -0.336 1
1 188 . 12 1 1 A 15 15 SER N N 104 117.781 115.559 2.222 1
1 189 . 12 1 1 A 16 16 VAL H H 105 7.839 8.328 -0.489 1
1 190 . 12 1 1 A 16 16 VAL HA H 105 3.390 4.441 -1.051 1
1 198 . 12 1 1 A 16 16 VAL C C 105 174.987 175.451 -0.464 1
1 199 . 12 1 1 A 16 16 VAL CA C 105 63.650 62.415 1.235 1
1 200 . 12 1 1 A 16 16 VAL CB C 105 31.410 30.732 0.678 1
1 203 . 12 1 1 A 16 16 VAL N N 105 129.036 127.888 1.148 1
1 204 . 12 1 1 A 17 17 CYS H H 106 8.536 8.501 0.035 1
1 205 . 12 1 1 A 17 17 CYS HA H 106 5.011 4.945 0.066 1
1 208 . 12 1 1 A 17 17 CYS CA C 106 55.260 57.047 -1.787 1
1 209 . 12 1 1 A 17 17 CYS CB C 106 28.210 30.924 -2.714 1
1 210 . 12 1 1 A 17 17 CYS N N 106 130.045 126.869 3.176 1
1 211 . 12 1 1 A 18 18 PRO HA H 107 3.991 4.420 -0.429 1
1 218 . 12 1 1 A 18 18 PRO C C 107 178.188 177.994 0.194 1
1 219 . 12 1 1 A 18 18 PRO CA C 107 65.940 64.537 1.403 1
1 220 . 12 1 1 A 18 18 PRO CB C 107 32.000 32.074 -0.074 1
1 223 . 12 1 1 A 19 19 GLU H H 108 9.260 9.082 0.178 1
1 224 . 12 1 1 A 19 19 GLU HA H 108 4.119 4.124 -0.005 1
1 229 . 12 1 1 A 19 19 GLU C C 108 178.721 178.858 -0.137 1
1 230 . 12 1 1 A 19 19 GLU CA C 108 59.300 59.131 0.169 1
1 231 . 12 1 1 A 19 19 GLU CB C 108 28.920 28.229 0.691 1
1 233 . 12 1 1 A 19 19 GLU N N 108 118.270 116.344 1.926 1
1 234 . 12 1 1 A 20 20 ARG H H 109 7.672 7.858 -0.186 1
1 235 . 12 1 1 A 20 20 ARG HA H 109 4.331 4.335 -0.004 1
1 242 . 12 1 1 A 20 20 ARG C C 109 177.977 177.975 0.002 1
1 243 . 12 1 1 A 20 20 ARG CA C 109 57.350 58.182 -0.832 1
1 244 . 12 1 1 A 20 20 ARG CB C 109 30.820 31.148 -0.328 1
1 247 . 12 1 1 A 20 20 ARG N N 109 118.357 119.325 -0.968 1
1 248 . 12 1 1 A 21 21 LEU H H 110 7.601 7.900 -0.299 1
1 249 . 12 1 1 A 21 21 LEU HA H 110 4.380 4.349 0.031 1
1 259 . 12 1 1 A 21 21 LEU C C 110 176.562 176.346 0.216 1
1 260 . 12 1 1 A 21 21 LEU CA C 110 56.096 55.345 0.751 1
1 261 . 12 1 1 A 21 21 LEU CB C 110 44.016 42.315 1.701 1
1 265 . 12 1 1 A 21 21 LEU N N 110 118.626 118.592 0.034 1
1 266 . 12 1 1 A 22 22 GLN H H 111 7.750 7.613 0.137 1
1 267 . 12 1 1 A 22 22 GLN HA H 111 3.870 3.972 -0.102 1
1 274 . 12 1 1 A 22 22 GLN C C 111 173.336 174.516 -1.180 1
1 275 . 12 1 1 A 22 22 GLN CA C 111 56.510 57.409 -0.899 1
1 276 . 12 1 1 A 22 22 GLN CB C 111 26.800 26.806 -0.006 1
1 278 . 12 1 1 A 22 22 GLN N N 111 113.926 115.713 -1.787 1
1 280 . 12 1 1 A 23 23 CYS H H 112 7.407 7.839 -0.432 1
1 281 . 12 1 1 A 23 23 CYS HA H 112 4.469 4.882 -0.413 1
1 284 . 12 1 1 A 23 23 CYS CA C 112 52.650 56.605 -3.955 1
1 285 . 12 1 1 A 23 23 CYS CB C 112 29.750 28.502 1.248 1
1 286 . 12 1 1 A 23 23 CYS N N 112 112.681 117.706 -5.025 1
1 287 . 12 1 1 A 24 24 PRO HA H 113 4.408 4.469 -0.061 1
1 294 . 12 1 1 A 24 24 PRO C C 113 178.175 177.617 0.558 1
1 295 . 12 1 1 A 24 24 PRO CA C 113 62.040 62.556 -0.516 1
1 296 . 12 1 1 A 24 24 PRO CB C 113 31.920 32.524 -0.604 1
1 299 . 12 1 1 A 25 25 LEU H H 114 8.593 8.816 -0.223 1
1 300 . 12 1 1 A 25 25 LEU HA H 114 3.765 4.059 -0.294 1
1 310 . 12 1 1 A 25 25 LEU C C 114 179.950 178.631 1.319 1
1 311 . 12 1 1 A 25 25 LEU CA C 114 57.674 57.980 -0.306 1
1 312 . 12 1 1 A 25 25 LEU CB C 114 40.690 41.423 -0.733 1
1 316 . 12 1 1 A 25 25 LEU N N 114 123.729 124.117 -0.388 1
1 317 . 12 1 1 A 26 26 GLU H H 115 9.108 8.241 0.867 1
1 318 . 12 1 1 A 26 26 GLU HA H 115 3.876 3.985 -0.109 1
1 323 . 12 1 1 A 26 26 GLU C C 115 177.505 179.032 -1.527 1
1 324 . 12 1 1 A 26 26 GLU CA C 115 59.410 59.549 -0.139 1
1 325 . 12 1 1 A 26 26 GLU CB C 115 28.460 29.267 -0.807 1
1 327 . 12 1 1 A 26 26 GLU N N 115 116.817 117.972 -1.155 1
1 328 . 12 1 1 A 27 27 ALA H H 116 7.360 7.730 -0.370 1
1 329 . 12 1 1 A 27 27 ALA HA H 116 4.408 3.923 0.485 1
1 333 . 12 1 1 A 27 27 ALA C C 116 177.046 179.088 -2.042 1
1 334 . 12 1 1 A 27 27 ALA CA C 116 52.970 54.711 -1.741 1
1 335 . 12 1 1 A 27 27 ALA CB C 116 19.916 18.111 1.805 1
1 336 . 12 1 1 A 27 27 ALA N N 116 118.966 121.980 -3.014 1
1 337 . 12 1 1 A 28 28 ILE H H 117 7.168 7.190 -0.022 1
1 338 . 12 1 1 A 28 28 ILE HA H 117 4.432 4.711 -0.279 1
1 348 . 12 1 1 A 28 28 ILE C C 117 172.641 175.572 -2.931 1
1 349 . 12 1 1 A 28 28 ILE CA C 117 59.980 60.904 -0.924 1
1 350 . 12 1 1 A 28 28 ILE CB C 117 37.350 37.846 -0.496 1
1 354 . 12 1 1 A 28 28 ILE N N 117 108.913 109.668 -0.755 1
1 355 . 12 1 1 A 29 29 GLN H H 118 6.562 7.793 -1.231 1
1 356 . 12 1 1 A 29 29 GLN HA H 118 3.922 4.269 -0.347 1
1 363 . 12 1 1 A 29 29 GLN C C 118 175.049 175.744 -0.695 1
1 364 . 12 1 1 A 29 29 GLN CA C 118 54.596 55.966 -1.370 1
1 365 . 12 1 1 A 29 29 GLN CB C 118 29.570 29.343 0.227 1
1 367 . 12 1 1 A 29 29 GLN N N 118 116.455 123.293 -6.838 1
1 369 . 12 1 1 A 30 30 CYS H H 119 8.138 8.356 -0.218 1
1 370 . 12 1 1 A 30 30 CYS HA H 119 4.580 4.449 0.131 1
1 373 . 12 1 1 A 30 30 CYS CA C 119 57.810 57.494 0.316 1
1 374 . 12 1 1 A 30 30 CYS CB C 119 30.200 28.722 1.478 1
1 375 . 12 1 1 A 30 30 CYS N N 119 134.136 125.438 8.698 1
1 376 . 12 1 1 A 31 31 PRO HA H 120 4.424 4.485 -0.061 1
1 383 . 12 1 1 A 31 31 PRO C C 120 177.431 177.333 0.098 1
1 384 . 12 1 1 A 31 31 PRO CA C 120 64.060 64.026 0.034 1
1 385 . 12 1 1 A 31 31 PRO CB C 120 32.776 31.665 1.111 1
1 388 . 12 1 1 A 32 32 ILE H H 121 11.318 7.563 3.755 1
1 389 . 12 1 1 A 32 32 ILE HA H 121 4.038 4.068 -0.030 1
1 399 . 12 1 1 A 32 32 ILE C C 121 178.485 177.749 0.736 1
1 400 . 12 1 1 A 32 32 ILE CA C 121 64.060 63.407 0.653 1
1 401 . 12 1 1 A 32 32 ILE CB C 121 39.340 39.112 0.228 1
1 405 . 12 1 1 A 32 32 ILE N N 121 124.500 116.739 7.761 1
1 406 . 12 1 1 A 33 33 THR H H 122 9.928 7.514 2.414 1
1 407 . 12 1 1 A 33 33 THR HA H 122 4.048 4.501 -0.453 1
1 412 . 12 1 1 A 33 33 THR C C 122 175.793 174.366 1.427 1
1 413 . 12 1 1 A 33 33 THR CA C 122 62.990 61.319 1.671 1
1 414 . 12 1 1 A 33 33 THR CB C 122 70.300 69.303 0.997 1
1 416 . 12 1 1 A 33 33 THR N N 122 115.136 108.791 6.345 1
1 417 . 12 1 1 A 34 34 LEU H H 123 8.439 7.825 0.614 1
1 418 . 12 1 1 A 34 34 LEU HA H 123 3.912 3.988 -0.076 1
1 428 . 12 1 1 A 34 34 LEU C C 123 175.495 175.532 -0.037 1
1 429 . 12 1 1 A 34 34 LEU CA C 123 56.290 55.958 0.332 1
1 430 . 12 1 1 A 34 34 LEU CB C 123 38.500 39.717 -1.217 1
1 434 . 12 1 1 A 34 34 LEU N N 123 117.230 121.133 -3.903 1
1 435 . 12 1 1 A 35 35 GLU H H 124 7.816 7.567 0.249 1
1 436 . 12 1 1 A 35 35 GLU HA H 124 4.634 4.754 -0.120 1
1 441 . 12 1 1 A 35 35 GLU C C 124 174.838 174.226 0.612 1
1 442 . 12 1 1 A 35 35 GLU CA C 124 53.780 54.590 -0.810 1
1 443 . 12 1 1 A 35 35 GLU CB C 124 33.710 32.401 1.309 1
1 445 . 12 1 1 A 35 35 GLU N N 124 116.577 116.675 -0.098 1
1 446 . 12 1 1 A 36 36 GLN H H 125 8.532 8.474 0.058 1
1 447 . 12 1 1 A 36 36 GLN HA H 125 4.958 4.428 0.530 1
1 454 . 12 1 1 A 36 36 GLN CA C 125 53.350 53.590 -0.240 1
1 455 . 12 1 1 A 36 36 GLN CB C 125 29.950 29.794 0.156 1
1 457 . 12 1 1 A 36 36 GLN N N 125 123.034 121.489 1.545 1
1 459 . 12 1 1 A 37 37 PRO HA H 126 4.458 4.259 0.199 1
1 466 . 12 1 1 A 37 37 PRO C C 126 176.314 177.290 -0.976 1
1 467 . 12 1 1 A 37 37 PRO CA C 126 62.816 65.595 -2.779 1
1 468 . 12 1 1 A 37 37 PRO CB C 126 33.070 31.589 1.481 1
1 471 . 12 1 1 A 38 38 GLU H H 127 8.626 7.695 0.931 1
1 472 . 12 1 1 A 38 38 GLU HA H 127 4.274 4.474 -0.200 1
1 477 . 12 1 1 A 38 38 GLU C C 127 177.809 174.944 2.865 1
1 478 . 12 1 1 A 38 38 GLU CA C 127 58.730 58.370 0.360 1
1 479 . 12 1 1 A 38 38 GLU CB C 127 30.340 29.476 0.864 1
1 481 . 12 1 1 A 38 38 GLU N N 127 120.691 118.867 1.824 1
1 482 . 12 1 1 A 39 39 LYS H H 128 7.891 7.942 -0.051 1
1 483 . 12 1 1 A 39 39 LYS HA H 128 4.870 4.839 0.031 1
1 492 . 12 1 1 A 39 39 LYS C C 128 175.452 175.678 -0.226 1
1 493 . 12 1 1 A 39 39 LYS CA C 128 53.540 54.823 -1.283 1
1 494 . 12 1 1 A 39 39 LYS CB C 128 33.630 34.452 -0.822 1
1 498 . 12 1 1 A 39 39 LYS N N 128 118.149 118.035 0.114 1
1 499 . 12 1 1 A 40 40 GLY H H 129 8.524 8.231 0.293 1
1 500 . 12 1 1 A 40 40 GLY HA2 H 129 4.973 4.021 0.952 1
1 501 . 12 1 1 A 40 40 GLY HA3 H 129 2.459 4.124 -1.665 1
1 502 . 12 1 1 A 40 40 GLY C C 129 169.943 171.765 -1.822 1
1 503 . 12 1 1 A 40 40 GLY CA C 129 42.910 44.667 -1.757 1
1 504 . 12 1 1 A 40 40 GLY N N 129 112.845 110.486 2.359 1
1 505 . 12 1 1 A 41 41 ILE H H 130 8.659 7.991 0.668 1
1 506 . 12 1 1 A 41 41 ILE HA H 130 4.591 4.532 0.059 1
1 516 . 12 1 1 A 41 41 ILE C C 130 172.586 174.036 -1.450 1
1 517 . 12 1 1 A 41 41 ILE CA C 130 58.090 58.993 -0.903 1
1 518 . 12 1 1 A 41 41 ILE CB C 130 43.320 41.769 1.551 1
1 522 . 12 1 1 A 41 41 ILE N N 130 114.060 119.266 -5.206 1
1 523 . 12 1 1 A 42 42 PHE H H 131 9.206 8.881 0.325 1
1 524 . 12 1 1 A 42 42 PHE HA H 131 5.159 4.783 0.376 1
1 532 . 12 1 1 A 42 42 PHE C C 131 174.931 175.960 -1.029 1
1 533 . 12 1 1 A 42 42 PHE CA C 131 57.790 58.248 -0.458 1
1 534 . 12 1 1 A 42 42 PHE CB C 131 42.220 39.149 3.071 1
1 538 . 12 1 1 A 42 42 PHE N N 131 126.002 128.495 -2.493 1
1 539 . 12 1 1 A 43 43 VAL H H 132 8.502 8.927 -0.425 1
1 540 . 12 1 1 A 43 43 VAL HA H 132 4.921 4.689 0.232 1
1 548 . 12 1 1 A 43 43 VAL C C 132 178.219 175.616 2.603 1
1 549 . 12 1 1 A 43 43 VAL CA C 132 59.600 60.042 -0.442 1
1 550 . 12 1 1 A 43 43 VAL CB C 132 35.920 35.668 0.252 1
1 553 . 12 1 1 A 43 43 VAL N N 132 119.068 123.006 -3.938 1
1 554 . 12 1 1 A 44 44 LYS H H 133 10.036 8.689 1.347 1
1 555 . 12 1 1 A 44 44 LYS HA H 133 5.070 4.313 0.757 1
1 564 . 12 1 1 A 44 44 LYS C C 133 177.276 177.900 -0.624 1
1 565 . 12 1 1 A 44 44 LYS CA C 133 56.720 57.463 -0.743 1
1 566 . 12 1 1 A 44 44 LYS CB C 133 34.410 32.581 1.829 1
1 570 . 12 1 1 A 44 44 LYS N N 133 130.934 124.688 6.246 1
1 571 . 12 1 1 A 45 45 ASN H H 134 8.093 8.684 -0.591 1
1 572 . 12 1 1 A 45 45 ASN HA H 134 4.152 4.810 -0.658 1
1 577 . 12 1 1 A 45 45 ASN C C 134 174.087 175.256 -1.169 1
1 578 . 12 1 1 A 45 45 ASN CA C 134 55.360 55.749 -0.389 1
1 579 . 12 1 1 A 45 45 ASN CB C 134 37.530 39.125 -1.595 1
1 580 . 12 1 1 A 45 45 ASN N N 134 117.963 123.307 -5.344 1
1 582 . 12 1 1 A 46 46 SER H H 135 7.524 7.788 -0.264 1
1 583 . 12 1 1 A 46 46 SER HA H 135 4.219 4.580 -0.361 1
1 586 . 12 1 1 A 46 46 SER C C 135 174.490 174.104 0.386 1
1 587 . 12 1 1 A 46 46 SER CA C 135 57.090 56.479 0.611 1
1 588 . 12 1 1 A 46 46 SER CB C 135 63.860 65.865 -2.005 1
1 589 . 12 1 1 A 46 46 SER N N 135 105.939 108.702 -2.763 1
1 590 . 12 1 1 A 47 47 ASP H H 136 9.113 8.857 0.256 1
1 591 . 12 1 1 A 47 47 ASP HA H 136 4.220 4.214 0.006 1
1 594 . 12 1 1 A 47 47 ASP CA C 136 57.610 57.187 0.423 1
1 595 . 12 1 1 A 47 47 ASP CB C 136 40.810 40.757 0.053 1
1 596 . 12 1 1 A 47 47 ASP N N 136 120.995 122.897 -1.902 1
1 597 . 12 1 1 A 48 48 GLY H H 137 8.181 8.108 0.073 1
1 598 . 12 1 1 A 48 48 GLY HA2 H 137 4.120 3.885 0.235 1
1 599 . 12 1 1 A 48 48 GLY HA3 H 137 3.659 3.885 -0.226 1
1 600 . 12 1 1 A 48 48 GLY C C 137 174.062 173.579 0.483 1
1 601 . 12 1 1 A 48 48 GLY CA C 137 45.130 46.475 -1.345 1
1 602 . 12 1 1 A 48 48 GLY N N 137 106.197 107.183 -0.986 1
1 603 . 12 1 1 A 49 49 SER H H 138 7.179 7.361 -0.182 1
1 604 . 12 1 1 A 49 49 SER HA H 138 4.383 4.970 -0.587 1
1 607 . 12 1 1 A 49 49 SER C C 138 173.864 173.250 0.614 1
1 608 . 12 1 1 A 49 49 SER CA C 138 57.614 57.549 0.065 1
1 609 . 12 1 1 A 49 49 SER CB C 138 65.100 67.654 -2.554 1
1 610 . 12 1 1 A 49 49 SER N N 138 115.015 113.945 1.070 1
1 611 . 12 1 1 A 50 50 ASP H H 139 8.078 8.532 -0.454 1
1 612 . 12 1 1 A 50 50 ASP HA H 139 4.642 4.943 -0.301 1
1 615 . 12 1 1 A 50 50 ASP C C 139 174.261 175.374 -1.113 1
1 616 . 12 1 1 A 50 50 ASP CA C 139 52.406 54.111 -1.705 1
1 617 . 12 1 1 A 50 50 ASP CB C 139 40.254 41.587 -1.333 1
1 618 . 12 1 1 A 50 50 ASP N N 139 122.400 120.394 2.006 1
1 619 . 12 1 1 A 51 51 VAL H H 140 8.111 7.510 0.601 1
1 620 . 12 1 1 A 51 51 VAL HA H 140 4.360 4.488 -0.128 1
1 628 . 12 1 1 A 51 51 VAL C C 140 176.147 174.210 1.937 1
1 629 . 12 1 1 A 51 51 VAL CA C 140 62.670 60.749 1.921 1
1 630 . 12 1 1 A 51 51 VAL CB C 140 33.930 33.095 0.835 1
1 632 . 12 1 1 A 51 51 VAL N N 140 120.374 120.223 0.151 1
1 633 . 12 1 1 A 52 52 CYS H H 141 8.358 9.209 -0.851 1
1 634 . 12 1 1 A 52 52 CYS HA H 141 4.957 5.433 -0.476 1
1 637 . 12 1 1 A 52 52 CYS C C 141 173.070 173.133 -0.063 1
1 638 . 12 1 1 A 52 52 CYS CA C 141 53.380 54.721 -1.341 1
1 639 . 12 1 1 A 52 52 CYS CB C 141 46.110 45.221 0.889 1
1 640 . 12 1 1 A 52 52 CYS N N 141 121.305 128.963 -7.658 1
1 641 . 12 1 1 A 53 53 THR H H 142 8.929 8.791 0.138 1
1 642 . 12 1 1 A 53 53 THR HA H 142 4.498 4.997 -0.499 1
1 648 . 12 1 1 A 53 53 THR C C 142 172.151 172.489 -0.338 1
1 649 . 12 1 1 A 53 53 THR CA C 142 62.960 61.316 1.644 1
1 650 . 12 1 1 A 53 53 THR CB C 142 70.540 72.910 -2.370 1
1 652 . 12 1 1 A 53 53 THR N N 142 120.105 118.588 1.517 1
1 653 . 12 1 1 A 54 54 LEU H H 143 8.448 8.823 -0.375 1
1 654 . 12 1 1 A 54 54 LEU HA H 143 4.322 4.915 -0.593 1
1 664 . 12 1 1 A 54 54 LEU C C 143 174.484 174.563 -0.079 1
1 665 . 12 1 1 A 54 54 LEU CA C 143 54.596 53.573 1.023 1
1 666 . 12 1 1 A 54 54 LEU CB C 143 42.396 43.942 -1.546 1
1 670 . 12 1 1 A 54 54 LEU N N 143 128.819 128.775 0.044 1
1 671 . 12 1 1 A 55 55 PHE H H 144 8.661 8.758 -0.097 1
1 672 . 12 1 1 A 55 55 PHE HA H 144 5.459 4.976 0.483 1
1 680 . 12 1 1 A 55 55 PHE C C 144 176.035 174.875 1.160 1
1 681 . 12 1 1 A 55 55 PHE CA C 144 55.020 56.815 -1.795 1
1 682 . 12 1 1 A 55 55 PHE CB C 144 44.100 42.526 1.574 1
1 686 . 12 1 1 A 55 55 PHE N N 144 121.897 126.015 -4.118 1
1 687 . 12 1 1 A 56 56 ASP H H 145 11.616 8.508 3.108 1
1 688 . 12 1 1 A 56 56 ASP HA H 145 4.417 4.651 -0.234 1
1 691 . 12 1 1 A 56 56 ASP C C 145 176.748 177.385 -0.637 1
1 692 . 12 1 1 A 56 56 ASP CA C 145 55.844 54.420 1.424 1
1 693 . 12 1 1 A 56 56 ASP CB C 145 44.390 42.738 1.652 1
1 694 . 12 1 1 A 56 56 ASP N N 145 122.131 121.374 0.757 1
1 695 . 12 1 1 A 57 57 ALA H H 146 8.508 8.869 -0.361 1
1 696 . 12 1 1 A 57 57 ALA HA H 146 3.797 4.044 -0.247 1
1 700 . 12 1 1 A 57 57 ALA C C 146 178.696 180.007 -1.311 1
1 701 . 12 1 1 A 57 57 ALA CA C 146 55.990 55.375 0.615 1
1 702 . 12 1 1 A 57 57 ALA CB C 146 18.840 18.044 0.796 1
1 703 . 12 1 1 A 57 57 ALA N N 146 130.243 128.989 1.254 1
1 704 . 12 1 1 A 58 58 ALA H H 147 8.378 8.002 0.376 1
1 705 . 12 1 1 A 58 58 ALA HA H 147 4.078 4.188 -0.110 1
1 709 . 12 1 1 A 58 58 ALA C C 147 181.091 179.863 1.228 1
1 710 . 12 1 1 A 58 58 ALA CA C 147 54.770 54.941 -0.171 1
1 711 . 12 1 1 A 58 58 ALA CB C 147 17.700 18.357 -0.657 1
1 712 . 12 1 1 A 58 58 ALA N N 147 121.997 119.819 2.178 1
1 713 . 12 1 1 A 59 59 ALA H H 148 9.138 7.924 1.214 1
1 714 . 12 1 1 A 59 59 ALA HA H 148 3.975 4.098 -0.123 1
1 718 . 12 1 1 A 59 59 ALA C C 148 180.508 179.419 1.089 1
1 719 . 12 1 1 A 59 59 ALA CA C 148 54.840 55.029 -0.189 1
1 720 . 12 1 1 A 59 59 ALA CB C 148 18.600 18.677 -0.077 1
1 721 . 12 1 1 A 59 59 ALA N N 148 123.595 120.013 3.582 1
1 722 . 12 1 1 A 60 60 PHE H H 149 8.814 8.113 0.701 1
1 723 . 12 1 1 A 60 60 PHE HA H 149 3.722 3.990 -0.268 1
1 731 . 12 1 1 A 60 60 PHE C C 149 176.773 177.398 -0.625 1
1 732 . 12 1 1 A 60 60 PHE CA C 149 62.030 61.595 0.435 1
1 733 . 12 1 1 A 60 60 PHE CB C 149 39.960 38.967 0.993 1
1 737 . 12 1 1 A 60 60 PHE N N 149 120.354 119.553 0.801 1
1 738 . 12 1 1 A 61 61 SER H H 150 8.276 8.362 -0.086 1
1 739 . 12 1 1 A 61 61 SER HA H 150 3.880 3.993 -0.113 1
1 742 . 12 1 1 A 61 61 SER C C 150 177.691 176.468 1.223 1
1 743 . 12 1 1 A 61 61 SER CA C 150 62.190 61.603 0.587 1
1 744 . 12 1 1 A 61 61 SER CB C 150 63.016 62.993 0.023 1
1 745 . 12 1 1 A 61 61 SER N N 150 112.086 114.214 -2.128 1
1 746 . 12 1 1 A 62 62 ARG H H 151 7.829 7.821 0.008 1
1 747 . 12 1 1 A 62 62 ARG HA H 151 3.971 4.033 -0.062 1
1 754 . 12 1 1 A 62 62 ARG C C 151 178.287 178.424 -0.137 1
1 755 . 12 1 1 A 62 62 ARG CA C 151 59.340 58.807 0.533 1
1 756 . 12 1 1 A 62 62 ARG CB C 151 29.760 29.916 -0.156 1
1 759 . 12 1 1 A 62 62 ARG N N 151 121.090 119.351 1.739 1
1 760 . 12 1 1 A 63 63 LEU H H 152 7.390 7.465 -0.075 1
1 761 . 12 1 1 A 63 63 LEU HA H 152 3.791 3.948 -0.157 1
1 771 . 12 1 1 A 63 63 LEU C C 152 179.106 178.204 0.902 1
1 772 . 12 1 1 A 63 63 LEU CA C 152 58.900 58.236 0.664 1
1 773 . 12 1 1 A 63 63 LEU CB C 152 41.140 41.208 -0.068 1
1 777 . 12 1 1 A 63 63 LEU N N 152 121.129 122.038 -0.909 1
1 778 . 12 1 1 A 64 64 VAL H H 153 7.552 7.894 -0.342 1
1 779 . 12 1 1 A 64 64 VAL HA H 153 3.411 3.429 -0.018 1
1 787 . 12 1 1 A 64 64 VAL C C 153 180.595 178.517 2.078 1
1 788 . 12 1 1 A 64 64 VAL CA C 153 65.644 66.296 -0.652 1
1 789 . 12 1 1 A 64 64 VAL CB C 153 31.410 31.378 0.032 1
1 792 . 12 1 1 A 64 64 VAL N N 153 118.280 119.173 -0.893 1
1 793 . 12 1 1 A 65 65 GLY H H 154 8.061 8.183 -0.122 1
1 794 . 12 1 1 A 65 65 GLY HA2 H 154 3.846 3.770 0.076 1
1 795 . 12 1 1 A 65 65 GLY HA3 H 154 3.809 3.771 0.038 1
1 796 . 12 1 1 A 65 65 GLY C C 154 175.235 175.356 -0.121 1
1 797 . 12 1 1 A 65 65 GLY CA C 154 46.630 46.833 -0.203 1
1 798 . 12 1 1 A 65 65 GLY N N 154 108.622 107.708 0.914 1
1 799 . 12 1 1 A 66 66 GLU H H 155 7.528 7.508 0.020 1
1 800 . 12 1 1 A 66 66 GLU HA H 155 4.228 4.353 -0.125 1
1 805 . 12 1 1 A 66 66 GLU C C 155 176.761 176.911 -0.150 1
1 806 . 12 1 1 A 66 66 GLU CA C 155 56.590 56.268 0.322 1
1 807 . 12 1 1 A 66 66 GLU CB C 155 30.490 30.160 0.330 1
1 809 . 12 1 1 A 66 66 GLU N N 155 118.361 119.167 -0.806 1
1 810 . 12 1 1 A 67 67 GLY H H 156 7.884 7.836 0.048 1
1 811 . 12 1 1 A 67 67 GLY HA2 H 156 3.918 3.856 0.062 1
1 812 . 12 1 1 A 67 67 GLY HA3 H 156 3.747 3.869 -0.122 1
1 813 . 12 1 1 A 67 67 GLY C C 156 174.788 174.665 0.123 1
1 814 . 12 1 1 A 67 67 GLY CA C 156 45.890 45.987 -0.097 1
1 815 . 12 1 1 A 67 67 GLY N N 156 108.465 109.651 -1.186 1
1 816 . 12 1 1 A 68 68 LEU H H 157 7.332 7.794 -0.462 1
1 817 . 12 1 1 A 68 68 LEU HA H 157 4.361 4.538 -0.177 1
1 827 . 12 1 1 A 68 68 LEU CA C 157 53.060 52.131 0.929 1
1 828 . 12 1 1 A 68 68 LEU CB C 157 41.100 41.708 -0.608 1
1 832 . 12 1 1 A 68 68 LEU N N 157 121.920 121.922 -0.002 1
1 833 . 12 1 1 A 69 69 PRO HA H 158 4.485 4.585 -0.100 1
1 840 . 12 1 1 A 69 69 PRO C C 158 174.602 176.417 -1.815 1
1 841 . 12 1 1 A 69 69 PRO CA C 158 61.556 62.261 -0.705 1
1 842 . 12 1 1 A 69 69 PRO CB C 158 32.370 32.509 -0.139 1
1 845 . 12 1 1 A 70 70 HIS H H 159 8.734 8.479 0.255 1
1 846 . 12 1 1 A 70 70 HIS HA H 159 3.947 4.490 -0.543 1
1 852 . 12 1 1 A 70 70 HIS CA C 159 56.250 55.260 0.990 1
1 853 . 12 1 1 A 70 70 HIS CB C 159 32.280 31.009 1.271 1
1 856 . 12 1 1 A 70 70 HIS N N 159 119.423 121.794 -2.371 1
1 857 . 12 1 1 A 71 71 PRO HA H 160 4.424 4.218 0.206 1
1 864 . 12 1 1 A 71 71 PRO C C 160 177.567 178.850 -1.283 1
1 865 . 12 1 1 A 71 71 PRO CA C 160 64.574 65.329 -0.755 1
1 866 . 12 1 1 A 71 71 PRO CB C 160 32.340 31.933 0.407 1
1 869 . 12 1 1 A 72 72 LEU H H 161 10.123 7.878 2.245 1
1 870 . 12 1 1 A 72 72 LEU HA H 161 4.778 4.206 0.572 1
1 880 . 12 1 1 A 72 72 LEU C C 161 178.721 177.589 1.132 1
1 881 . 12 1 1 A 72 72 LEU CA C 161 55.800 57.297 -1.497 1
1 882 . 12 1 1 A 72 72 LEU CB C 161 42.440 42.266 0.174 1
1 886 . 12 1 1 A 72 72 LEU N N 161 117.374 117.187 0.187 1
1 887 . 12 1 1 A 73 73 THR H H 162 7.523 8.252 -0.729 1
1 888 . 12 1 1 A 73 73 THR HA H 162 4.291 4.664 -0.373 1
1 893 . 12 1 1 A 73 73 THR C C 162 175.557 174.465 1.092 1
1 894 . 12 1 1 A 73 73 THR CA C 162 61.440 61.046 0.394 1
1 895 . 12 1 1 A 73 73 THR CB C 162 70.500 69.506 0.994 1
1 897 . 12 1 1 A 73 73 THR N N 162 107.787 111.134 -3.347 1
1 898 . 12 1 1 A 74 74 ARG H H 163 8.361 8.020 0.341 1
1 899 . 12 1 1 A 74 74 ARG HA H 163 3.836 4.229 -0.393 1
1 906 . 12 1 1 A 74 74 ARG C C 163 174.701 175.513 -0.812 1
1 907 . 12 1 1 A 74 74 ARG CA C 163 57.980 57.396 0.584 1
1 908 . 12 1 1 A 74 74 ARG CB C 163 26.770 26.949 -0.179 1
1 911 . 12 1 1 A 74 74 ARG N N 163 115.130 118.343 -3.213 1
1 912 . 12 1 1 A 75 75 GLU H H 164 7.430 8.002 -0.572 1
1 913 . 12 1 1 A 75 75 GLU HA H 164 4.636 4.414 0.222 1
1 918 . 12 1 1 A 75 75 GLU CA C 164 53.699 55.434 -1.735 1
1 919 . 12 1 1 A 75 75 GLU CB C 164 29.550 28.656 0.894 1
1 921 . 12 1 1 A 75 75 GLU N N 164 120.076 118.661 1.415 1
1 922 . 12 1 1 A 76 76 PRO HA H 165 4.272 4.637 -0.365 1
1 929 . 12 1 1 A 76 76 PRO C C 165 176.649 176.819 -0.170 1
1 930 . 12 1 1 A 76 76 PRO CA C 165 63.204 62.914 0.290 1
1 931 . 12 1 1 A 76 76 PRO CB C 165 31.680 31.549 0.131 1
1 934 . 12 1 1 A 77 77 ILE H H 166 8.812 8.230 0.582 1
1 935 . 12 1 1 A 77 77 ILE HA H 166 3.838 4.289 -0.451 1
1 945 . 12 1 1 A 77 77 ILE C C 166 175.235 175.335 -0.100 1
1 946 . 12 1 1 A 77 77 ILE CA C 166 62.816 61.026 1.790 1
1 947 . 12 1 1 A 77 77 ILE CB C 166 37.750 36.545 1.205 1
1 951 . 12 1 1 A 77 77 ILE N N 166 123.831 123.823 0.008 1
1 952 . 12 1 1 A 78 78 THR H H 167 6.625 8.632 -2.007 1
1 953 . 12 1 1 A 78 78 THR HA H 167 4.632 5.014 -0.382 1
1 958 . 12 1 1 A 78 78 THR C C 167 174.143 174.680 -0.537 1
1 959 . 12 1 1 A 78 78 THR CA C 167 58.750 59.691 -0.941 1
1 960 . 12 1 1 A 78 78 THR CB C 167 71.320 71.292 0.028 1
1 962 . 12 1 1 A 78 78 THR N N 167 115.293 120.641 -5.348 1
1 963 . 12 1 1 A 79 79 ALA H H 168 9.088 9.018 0.070 1
1 964 . 12 1 1 A 79 79 ALA HA H 168 3.916 4.103 -0.187 1
1 968 . 12 1 1 A 79 79 ALA C C 168 179.770 179.483 0.287 1
1 969 . 12 1 1 A 79 79 ALA CA C 168 55.480 55.068 0.412 1
1 970 . 12 1 1 A 79 79 ALA CB C 168 17.630 18.295 -0.665 1
1 971 . 12 1 1 A 79 79 ALA N N 168 122.102 127.348 -5.246 1
1 972 . 12 1 1 A 80 80 SER H H 169 7.988 7.435 0.553 1
1 973 . 12 1 1 A 80 80 SER HA H 169 4.091 4.226 -0.135 1
1 976 . 12 1 1 A 80 80 SER C C 169 175.836 176.397 -0.561 1
1 977 . 12 1 1 A 80 80 SER CA C 169 60.750 61.577 -0.827 1
1 978 . 12 1 1 A 80 80 SER CB C 169 62.510 63.046 -0.536 1
1 979 . 12 1 1 A 80 80 SER N N 169 109.660 113.522 -3.862 1
1 980 . 12 1 1 A 81 81 ILE H H 170 7.052 7.862 -0.810 1
1 981 . 12 1 1 A 81 81 ILE HA H 170 4.344 3.892 0.452 1
1 991 . 12 1 1 A 81 81 ILE C C 170 174.236 176.601 -2.365 1
1 992 . 12 1 1 A 81 81 ILE CA C 170 61.760 64.313 -2.553 1
1 993 . 12 1 1 A 81 81 ILE CB C 170 37.950 37.277 0.673 1
1 997 . 12 1 1 A 81 81 ILE N N 170 112.623 115.607 -2.984 1
1 998 . 12 1 1 A 82 82 ILE H H 171 7.345 7.631 -0.286 1
1 999 . 12 1 1 A 82 82 ILE HA H 171 4.288 4.014 0.274 1
1 1009 . 12 1 1 A 82 82 ILE C C 171 174.931 175.243 -0.312 1
1 1010 . 12 1 1 A 82 82 ILE CA C 171 61.420 61.855 -0.435 1
1 1011 . 12 1 1 A 82 82 ILE CB C 171 37.230 37.879 -0.649 1
1 1015 . 12 1 1 A 82 82 ILE N N 171 124.260 124.675 -0.415 1
1 1016 . 12 1 1 A 83 83 VAL H H 172 7.843 8.668 -0.825 1
1 1017 . 12 1 1 A 83 83 VAL HA H 172 4.818 5.013 -0.195 1
1 1025 . 12 1 1 A 83 83 VAL C C 172 174.918 176.032 -1.114 1
1 1026 . 12 1 1 A 83 83 VAL CA C 172 58.910 59.371 -0.461 1
1 1027 . 12 1 1 A 83 83 VAL CB C 172 34.570 34.674 -0.104 1
1 1030 . 12 1 1 A 83 83 VAL N N 172 118.856 122.624 -3.768 1
1 1031 . 12 1 1 A 84 84 LYS H H 173 8.347 8.713 -0.366 1
1 1032 . 12 1 1 A 84 84 LYS HA H 173 4.356 4.547 -0.191 1
1 1041 . 12 1 1 A 84 84 LYS C C 173 178.653 178.440 0.213 1
1 1042 . 12 1 1 A 84 84 LYS CA C 173 56.360 55.616 0.744 1
1 1043 . 12 1 1 A 84 84 LYS CB C 173 33.366 33.392 -0.026 1
1 1047 . 12 1 1 A 84 84 LYS N N 173 119.602 122.368 -2.766 1
1 1048 . 12 1 1 A 85 85 HIS H H 174 9.143 9.067 0.076 1
1 1049 . 12 1 1 A 85 85 HIS HA H 174 4.013 4.337 -0.324 1
1 1053 . 12 1 1 A 85 85 HIS C C 174 176.606 176.882 -0.276 1
1 1054 . 12 1 1 A 85 85 HIS CA C 174 58.820 60.442 -1.622 1
1 1055 . 12 1 1 A 85 85 HIS CB C 174 28.186 29.768 -1.582 1
1 1057 . 12 1 1 A 85 85 HIS N N 174 120.022 122.610 -2.588 1
1 1058 . 12 1 1 A 86 86 GLU H H 175 8.403 8.723 -0.320 1
1 1059 . 12 1 1 A 86 86 GLU HA H 175 3.863 3.720 0.143 1
1 1064 . 12 1 1 A 86 86 GLU C C 175 177.040 178.855 -1.815 1
1 1065 . 12 1 1 A 86 86 GLU CA C 175 57.830 59.860 -2.030 1
1 1066 . 12 1 1 A 86 86 GLU CB C 175 28.690 29.279 -0.589 1
1 1068 . 12 1 1 A 86 86 GLU N N 175 116.124 118.354 -2.230 1
1 1069 . 12 1 1 A 87 87 GLU H H 176 7.669 7.809 -0.140 1
1 1070 . 12 1 1 A 87 87 GLU HA H 176 4.039 4.566 -0.527 1
1 1075 . 12 1 1 A 87 87 GLU C C 176 175.688 175.398 0.290 1
1 1076 . 12 1 1 A 87 87 GLU CA C 176 57.906 57.342 0.564 1
1 1077 . 12 1 1 A 87 87 GLU CB C 176 30.430 29.128 1.302 1
1 1079 . 12 1 1 A 87 87 GLU N N 176 116.183 116.760 -0.577 1
1 1080 . 12 1 1 A 88 88 CYS H H 177 6.750 7.172 -0.422 1
1 1081 . 12 1 1 A 88 88 CYS HA H 177 4.991 5.039 -0.048 1
1 1084 . 12 1 1 A 88 88 CYS C C 177 172.325 172.295 0.030 1
1 1085 . 12 1 1 A 88 88 CYS CA C 177 55.030 55.430 -0.400 1
1 1086 . 12 1 1 A 88 88 CYS CB C 177 45.610 43.781 1.829 1
1 1087 . 12 1 1 A 88 88 CYS N N 177 114.838 116.070 -1.232 1
1 1088 . 12 1 1 A 89 89 ILE H H 178 9.128 8.780 0.348 1
1 1089 . 12 1 1 A 89 89 ILE HA H 178 4.536 5.004 -0.468 1
1 1099 . 12 1 1 A 89 89 ILE C C 178 174.893 174.473 0.420 1
1 1100 . 12 1 1 A 89 89 ILE CA C 178 59.160 59.382 -0.222 1
1 1101 . 12 1 1 A 89 89 ILE CB C 178 41.840 40.726 1.114 1
1 1105 . 12 1 1 A 89 89 ILE N N 178 120.564 121.677 -1.113 1
1 1106 . 12 1 1 A 90 90 TYR H H 179 9.349 9.156 0.193 1
1 1107 . 12 1 1 A 90 90 TYR HA H 179 3.568 4.325 -0.757 1
1 1112 . 12 1 1 A 90 90 TYR C C 179 173.950 173.912 0.038 1
1 1113 . 12 1 1 A 90 90 TYR CA C 179 61.180 57.748 3.432 1
1 1114 . 12 1 1 A 90 90 TYR CB C 179 37.530 38.420 -0.890 1
1 1116 . 12 1 1 A 90 90 TYR N N 179 129.033 126.938 2.095 1
1 1117 . 12 1 1 A 91 91 ASP H H 180 7.367 8.209 -0.842 1
1 1118 . 12 1 1 A 91 91 ASP HA H 180 4.662 4.588 0.074 1
1 1121 . 12 1 1 A 91 91 ASP C C 180 175.291 175.840 -0.549 1
1 1122 . 12 1 1 A 91 91 ASP CA C 180 52.230 52.437 -0.207 1
1 1123 . 12 1 1 A 91 91 ASP CB C 180 43.650 42.040 1.610 1
1 1124 . 12 1 1 A 91 91 ASP N N 180 129.305 128.825 0.480 1
1 1125 . 12 1 1 A 92 92 ASP H H 181 8.783 8.652 0.131 1
1 1126 . 12 1 1 A 92 92 ASP HA H 181 4.114 3.911 0.203 1
1 1129 . 12 1 1 A 92 92 ASP C C 181 177.573 178.171 -0.598 1
1 1130 . 12 1 1 A 92 92 ASP CA C 181 56.390 57.259 -0.869 1
1 1131 . 12 1 1 A 92 92 ASP CB C 181 41.330 40.318 1.012 1
1 1132 . 12 1 1 A 92 92 ASP N N 181 125.665 125.568 0.097 1
1 1133 . 12 1 1 A 93 93 THR H H 182 8.284 7.906 0.378 1
1 1134 . 12 1 1 A 93 93 THR HA H 182 4.037 3.869 0.168 1
1 1139 . 12 1 1 A 93 93 THR C C 182 176.333 176.077 0.256 1
1 1140 . 12 1 1 A 93 93 THR CA C 182 65.320 66.829 -1.509 1
1 1141 . 12 1 1 A 93 93 THR CB C 182 68.560 68.276 0.284 1
1 1143 . 12 1 1 A 93 93 THR N N 182 114.688 116.708 -2.020 1
1 1144 . 12 1 1 A 94 94 ARG H H 183 7.784 7.409 0.375 1
1 1145 . 12 1 1 A 94 94 ARG HA H 183 4.142 4.261 -0.119 1
1 1152 . 12 1 1 A 94 94 ARG C C 183 177.015 176.902 0.113 1
1 1153 . 12 1 1 A 94 94 ARG CA C 183 55.350 56.056 -0.706 1
1 1154 . 12 1 1 A 94 94 ARG CB C 183 30.930 31.077 -0.147 1
1 1157 . 12 1 1 A 94 94 ARG N N 183 120.156 118.416 1.740 1
1 1158 . 12 1 1 A 95 95 GLY H H 184 8.144 9.067 -0.923 1
1 1159 . 12 1 1 A 95 95 GLY HA2 H 184 3.839 3.844 -0.005 1
1 1160 . 12 1 1 A 95 95 GLY HA3 H 184 3.681 3.879 -0.198 1
1 1161 . 12 1 1 A 95 95 GLY C C 184 173.653 173.337 0.316 1
1 1162 . 12 1 1 A 95 95 GLY CA C 184 46.160 46.092 0.068 1
1 1163 . 12 1 1 A 95 95 GLY N N 184 107.879 109.426 -1.547 1
1 1164 . 12 1 1 A 96 96 ASN H H 185 6.855 7.252 -0.397 1
1 1165 . 12 1 1 A 96 96 ASN HA H 185 4.909 4.967 -0.058 1
1 1170 . 12 1 1 A 96 96 ASN C C 185 174.223 173.285 0.938 1
1 1171 . 12 1 1 A 96 96 ASN CA C 185 52.720 52.388 0.332 1
1 1172 . 12 1 1 A 96 96 ASN CB C 185 45.620 41.464 4.156 1
1 1173 . 12 1 1 A 96 96 ASN N N 185 113.382 116.491 -3.109 1
1 1175 . 12 1 1 A 97 97 PHE H H 186 9.228 8.465 0.763 1
1 1176 . 12 1 1 A 97 97 PHE HA H 186 4.579 4.822 -0.243 1
1 1183 . 12 1 1 A 97 97 PHE C C 186 174.794 175.834 -1.040 1
1 1184 . 12 1 1 A 97 97 PHE CA C 186 59.384 58.906 0.478 1
1 1185 . 12 1 1 A 97 97 PHE CB C 186 40.450 39.742 0.708 1
1 1188 . 12 1 1 A 97 97 PHE N N 186 118.661 119.348 -0.687 1
1 1189 . 12 1 1 A 98 98 ILE H H 187 8.908 8.906 0.002 1
1 1190 . 12 1 1 A 98 98 ILE HA H 187 5.440 4.917 0.523 1
1 1200 . 12 1 1 A 98 98 ILE C C 187 176.171 175.366 0.805 1
1 1201 . 12 1 1 A 98 98 ILE CA C 187 57.610 59.703 -2.093 1
1 1202 . 12 1 1 A 98 98 ILE CB C 187 41.280 41.300 -0.020 1
1 1206 . 12 1 1 A 98 98 ILE N N 187 120.585 123.114 -2.529 1
1 1207 . 12 1 1 A 99 99 ILE H H 188 8.602 8.349 0.253 1
1 1208 . 12 1 1 A 99 99 ILE HA H 188 4.546 4.798 -0.252 1
1 1218 . 12 1 1 A 99 99 ILE C C 188 176.668 174.722 1.946 1
1 1219 . 12 1 1 A 99 99 ILE CA C 188 58.920 61.743 -2.823 1
1 1220 . 12 1 1 A 99 99 ILE CB C 188 37.960 37.312 0.648 1
1 1224 . 12 1 1 A 99 99 ILE N N 188 124.500 125.875 -1.375 1
1 1225 . 12 1 1 A 100 100 LYS H H 189 8.449 8.705 -0.256 1
1 1226 . 12 1 1 A 100 100 LYS HA H 189 4.108 4.772 -0.664 1
1 1235 . 12 1 1 A 100 100 LYS C C 189 176.866 175.646 1.220 1
1 1236 . 12 1 1 A 100 100 LYS CA C 189 56.800 54.784 2.016 1
1 1237 . 12 1 1 A 100 100 LYS CB C 189 33.400 33.329 0.071 1
1 1241 . 12 1 1 A 100 100 LYS N N 189 128.581 129.511 -0.930 1
1 1242 . 12 1 1 A 101 101 GLY H H 190 8.381 8.438 -0.057 1
1 1243 . 12 1 1 A 101 101 GLY HA2 H 190 3.946 4.150 -0.204 1
1 1244 . 12 1 1 A 101 101 GLY HA3 H 190 3.828 4.151 -0.323 1
1 1245 . 12 1 1 A 101 101 GLY C C 190 172.902 172.654 0.248 1
1 1246 . 12 1 1 A 101 101 GLY CA C 190 44.920 45.256 -0.336 1
1 1247 . 12 1 1 A 101 101 GLY N N 190 111.183 114.161 -2.978 1
1 7 . 13 1 1 A 2 2 GLN H H 91 8.786 8.103 0.683 1
1 8 . 13 1 1 A 2 2 GLN HA H 91 4.005 3.984 0.021 1
1 15 . 13 1 1 A 2 2 GLN C C 91 177.270 178.581 -1.311 1
1 16 . 13 1 1 A 2 2 GLN CA C 91 58.220 59.044 -0.824 1
1 17 . 13 1 1 A 2 2 GLN CB C 91 28.650 28.022 0.628 1
1 19 . 13 1 1 A 2 2 GLN N N 91 121.993 120.925 1.068 1
1 21 . 13 1 1 A 3 3 GLU H H 92 8.430 8.482 -0.052 1
1 22 . 13 1 1 A 3 3 GLU HA H 92 4.007 4.072 -0.065 1
1 27 . 13 1 1 A 3 3 GLU C C 92 178.287 178.752 -0.465 1
1 28 . 13 1 1 A 3 3 GLU CA C 92 59.490 59.655 -0.165 1
1 29 . 13 1 1 A 3 3 GLU CB C 92 29.506 29.337 0.169 1
1 31 . 13 1 1 A 3 3 GLU N N 92 120.195 120.092 0.103 1
1 32 . 13 1 1 A 4 4 SER H H 93 8.209 7.508 0.701 1
1 33 . 13 1 1 A 4 4 SER HA H 93 4.272 4.274 -0.002 1
1 36 . 13 1 1 A 4 4 SER C C 93 177.369 177.470 -0.101 1
1 37 . 13 1 1 A 4 4 SER CA C 93 61.044 61.235 -0.191 1
1 38 . 13 1 1 A 4 4 SER CB C 93 62.950 62.811 0.139 1
1 39 . 13 1 1 A 4 4 SER N N 93 115.524 114.320 1.204 1
1 40 . 13 1 1 A 5 5 ILE H H 94 8.080 7.761 0.319 1
1 41 . 13 1 1 A 5 5 ILE HA H 94 3.530 3.619 -0.089 1
1 51 . 13 1 1 A 5 5 ILE C C 94 177.778 177.490 0.288 1
1 52 . 13 1 1 A 5 5 ILE CA C 94 65.710 65.422 0.288 1
1 53 . 13 1 1 A 5 5 ILE CB C 94 37.800 37.721 0.079 1
1 57 . 13 1 1 A 5 5 ILE N N 94 124.148 122.116 2.032 1
1 58 . 13 1 1 A 6 6 GLN H H 95 8.374 8.510 -0.136 1
1 59 . 13 1 1 A 6 6 GLN HA H 95 4.125 4.030 0.095 1
1 66 . 13 1 1 A 6 6 GLN C C 95 179.726 179.175 0.551 1
1 67 . 13 1 1 A 6 6 GLN CA C 95 59.190 58.954 0.236 1
1 68 . 13 1 1 A 6 6 GLN CB C 95 27.060 28.373 -1.313 1
1 70 . 13 1 1 A 6 6 GLN N N 95 118.257 118.871 -0.614 1
1 72 . 13 1 1 A 7 7 ASN H H 96 8.456 8.082 0.374 1
1 73 . 13 1 1 A 7 7 ASN HA H 96 4.446 4.536 -0.090 1
1 78 . 13 1 1 A 7 7 ASN C C 96 177.257 177.759 -0.502 1
1 79 . 13 1 1 A 7 7 ASN CA C 96 56.020 56.188 -0.168 1
1 80 . 13 1 1 A 7 7 ASN CB C 96 38.126 37.825 0.301 1
1 81 . 13 1 1 A 7 7 ASN N N 96 118.597 118.256 0.341 1
1 83 . 13 1 1 A 8 8 LYS H H 97 7.732 7.840 -0.108 1
1 84 . 13 1 1 A 8 8 LYS HA H 97 4.129 4.070 0.059 1
1 93 . 13 1 1 A 8 8 LYS C C 97 179.143 179.245 -0.102 1
1 94 . 13 1 1 A 8 8 LYS CA C 97 59.126 59.832 -0.706 1
1 95 . 13 1 1 A 8 8 LYS CB C 97 32.070 32.268 -0.198 1
1 99 . 13 1 1 A 8 8 LYS N N 97 122.381 120.151 2.230 1
1 100 . 13 1 1 A 9 9 ILE H H 98 8.452 8.012 0.440 1
1 101 . 13 1 1 A 9 9 ILE HA H 98 3.480 3.939 -0.459 1
1 111 . 13 1 1 A 9 9 ILE C C 98 177.406 178.322 -0.916 1
1 112 . 13 1 1 A 9 9 ILE CA C 98 66.430 64.041 2.389 1
1 113 . 13 1 1 A 9 9 ILE CB C 98 37.980 37.120 0.860 1
1 117 . 13 1 1 A 9 9 ILE N N 98 119.950 120.482 -0.532 1
1 118 . 13 1 1 A 10 10 SER H H 99 7.924 7.912 0.012 1
1 119 . 13 1 1 A 10 10 SER HA H 99 3.983 4.231 -0.248 1
1 122 . 13 1 1 A 10 10 SER C C 99 176.327 176.413 -0.086 1
1 123 . 13 1 1 A 10 10 SER CA C 99 61.990 61.342 0.648 1
1 124 . 13 1 1 A 10 10 SER CB C 99 62.790 62.995 -0.205 1
1 125 . 13 1 1 A 10 10 SER N N 99 113.568 117.378 -3.810 1
1 126 . 13 1 1 A 11 11 GLN H H 100 7.832 7.857 -0.025 1
1 127 . 13 1 1 A 11 11 GLN HA H 100 4.238 4.504 -0.266 1
1 134 . 13 1 1 A 11 11 GLN C C 100 178.088 178.021 0.067 1
1 135 . 13 1 1 A 11 11 GLN CA C 100 57.900 57.530 0.370 1
1 136 . 13 1 1 A 11 11 GLN CB C 100 29.790 29.943 -0.153 1
1 138 . 13 1 1 A 11 11 GLN N N 100 117.487 117.909 -0.422 1
1 140 . 13 1 1 A 12 12 CYS H H 101 7.920 8.406 -0.486 1
1 141 . 13 1 1 A 12 12 CYS HA H 101 4.657 4.478 0.179 1
1 144 . 13 1 1 A 12 12 CYS C C 101 175.439 175.040 0.399 1
1 145 . 13 1 1 A 12 12 CYS CA C 101 60.654 62.276 -1.622 1
1 146 . 13 1 1 A 12 12 CYS CB C 101 29.310 26.794 2.516 1
1 147 . 13 1 1 A 12 12 CYS N N 101 114.221 118.077 -3.856 1
1 148 . 13 1 1 A 13 13 LYS H H 102 7.993 7.520 0.473 1
1 149 . 13 1 1 A 13 13 LYS HA H 102 5.038 4.484 0.554 1
1 158 . 13 1 1 A 13 13 LYS C C 102 174.757 176.288 -1.531 1
1 159 . 13 1 1 A 13 13 LYS CA C 102 56.660 56.085 0.575 1
1 160 . 13 1 1 A 13 13 LYS CB C 102 32.970 33.346 -0.376 1
1 164 . 13 1 1 A 13 13 LYS N N 102 123.841 119.029 4.812 1
1 165 . 13 1 1 A 14 14 PHE H H 103 8.822 8.663 0.159 1
1 166 . 13 1 1 A 14 14 PHE HA H 103 5.058 5.173 -0.115 1
1 174 . 13 1 1 A 14 14 PHE C C 103 173.560 173.451 0.109 1
1 175 . 13 1 1 A 14 14 PHE CA C 103 55.470 56.000 -0.530 1
1 176 . 13 1 1 A 14 14 PHE CB C 103 41.760 40.843 0.917 1
1 180 . 13 1 1 A 14 14 PHE N N 103 118.421 116.464 1.957 1
1 181 . 13 1 1 A 15 15 SER H H 104 8.826 8.516 0.310 1
1 182 . 13 1 1 A 15 15 SER HA H 104 4.602 4.873 -0.271 1
1 185 . 13 1 1 A 15 15 SER C C 104 173.851 173.765 0.086 1
1 186 . 13 1 1 A 15 15 SER CA C 104 58.610 57.968 0.642 1
1 187 . 13 1 1 A 15 15 SER CB C 104 62.690 62.938 -0.248 1
1 188 . 13 1 1 A 15 15 SER N N 104 117.781 114.931 2.850 1
1 189 . 13 1 1 A 16 16 VAL H H 105 7.839 8.240 -0.401 1
1 190 . 13 1 1 A 16 16 VAL HA H 105 3.390 4.352 -0.962 1
1 198 . 13 1 1 A 16 16 VAL C C 105 174.987 175.013 -0.026 1
1 199 . 13 1 1 A 16 16 VAL CA C 105 63.650 62.478 1.172 1
1 200 . 13 1 1 A 16 16 VAL CB C 105 31.410 30.279 1.131 1
1 203 . 13 1 1 A 16 16 VAL N N 105 129.036 126.122 2.914 1
1 204 . 13 1 1 A 17 17 CYS H H 106 8.536 8.332 0.204 1
1 205 . 13 1 1 A 17 17 CYS HA H 106 5.011 4.974 0.037 1
1 208 . 13 1 1 A 17 17 CYS CA C 106 55.260 56.552 -1.292 1
1 209 . 13 1 1 A 17 17 CYS CB C 106 28.210 29.708 -1.498 1
1 210 . 13 1 1 A 17 17 CYS N N 106 130.045 127.117 2.928 1
1 211 . 13 1 1 A 18 18 PRO HA H 107 3.991 4.318 -0.327 1
1 218 . 13 1 1 A 18 18 PRO C C 107 178.188 178.143 0.045 1
1 219 . 13 1 1 A 18 18 PRO CA C 107 65.940 64.870 1.070 1
1 220 . 13 1 1 A 18 18 PRO CB C 107 32.000 32.077 -0.077 1
1 223 . 13 1 1 A 19 19 GLU H H 108 9.260 9.120 0.140 1
1 224 . 13 1 1 A 19 19 GLU HA H 108 4.119 4.084 0.035 1
1 229 . 13 1 1 A 19 19 GLU C C 108 178.721 178.848 -0.127 1
1 230 . 13 1 1 A 19 19 GLU CA C 108 59.300 59.157 0.143 1
1 231 . 13 1 1 A 19 19 GLU CB C 108 28.920 28.474 0.446 1
1 233 . 13 1 1 A 19 19 GLU N N 108 118.270 116.582 1.688 1
1 234 . 13 1 1 A 20 20 ARG H H 109 7.672 7.692 -0.020 1
1 235 . 13 1 1 A 20 20 ARG HA H 109 4.331 4.350 -0.019 1
1 242 . 13 1 1 A 20 20 ARG C C 109 177.977 178.038 -0.061 1
1 243 . 13 1 1 A 20 20 ARG CA C 109 57.350 57.933 -0.583 1
1 244 . 13 1 1 A 20 20 ARG CB C 109 30.820 31.111 -0.291 1
1 247 . 13 1 1 A 20 20 ARG N N 109 118.357 119.295 -0.938 1
1 248 . 13 1 1 A 21 21 LEU H H 110 7.601 7.848 -0.247 1
1 249 . 13 1 1 A 21 21 LEU HA H 110 4.380 4.295 0.085 1
1 259 . 13 1 1 A 21 21 LEU C C 110 176.562 176.189 0.373 1
1 260 . 13 1 1 A 21 21 LEU CA C 110 56.096 55.337 0.759 1
1 261 . 13 1 1 A 21 21 LEU CB C 110 44.016 42.260 1.756 1
1 265 . 13 1 1 A 21 21 LEU N N 110 118.626 118.421 0.205 1
1 266 . 13 1 1 A 22 22 GLN H H 111 7.750 7.571 0.179 1
1 267 . 13 1 1 A 22 22 GLN HA H 111 3.870 3.887 -0.017 1
1 274 . 13 1 1 A 22 22 GLN C C 111 173.336 174.044 -0.708 1
1 275 . 13 1 1 A 22 22 GLN CA C 111 56.510 57.085 -0.575 1
1 276 . 13 1 1 A 22 22 GLN CB C 111 26.800 26.240 0.560 1
1 278 . 13 1 1 A 22 22 GLN N N 111 113.926 115.821 -1.895 1
1 280 . 13 1 1 A 23 23 CYS H H 112 7.407 7.792 -0.385 1
1 281 . 13 1 1 A 23 23 CYS HA H 112 4.469 4.896 -0.427 1
1 284 . 13 1 1 A 23 23 CYS CA C 112 52.650 56.623 -3.973 1
1 285 . 13 1 1 A 23 23 CYS CB C 112 29.750 30.890 -1.140 1
1 286 . 13 1 1 A 23 23 CYS N N 112 112.681 117.343 -4.662 1
1 287 . 13 1 1 A 24 24 PRO HA H 113 4.408 4.461 -0.053 1
1 294 . 13 1 1 A 24 24 PRO C C 113 178.175 177.422 0.753 1
1 295 . 13 1 1 A 24 24 PRO CA C 113 62.040 62.474 -0.434 1
1 296 . 13 1 1 A 24 24 PRO CB C 113 31.920 33.395 -1.475 1
1 299 . 13 1 1 A 25 25 LEU H H 114 8.593 8.833 -0.240 1
1 300 . 13 1 1 A 25 25 LEU HA H 114 3.765 4.043 -0.278 1
1 310 . 13 1 1 A 25 25 LEU C C 114 179.950 178.562 1.388 1
1 311 . 13 1 1 A 25 25 LEU CA C 114 57.674 57.815 -0.141 1
1 312 . 13 1 1 A 25 25 LEU CB C 114 40.690 41.493 -0.803 1
1 316 . 13 1 1 A 25 25 LEU N N 114 123.729 123.505 0.224 1
1 317 . 13 1 1 A 26 26 GLU H H 115 9.108 8.085 1.023 1
1 318 . 13 1 1 A 26 26 GLU HA H 115 3.876 4.002 -0.126 1
1 323 . 13 1 1 A 26 26 GLU C C 115 177.505 179.336 -1.831 1
1 324 . 13 1 1 A 26 26 GLU CA C 115 59.410 59.302 0.108 1
1 325 . 13 1 1 A 26 26 GLU CB C 115 28.460 28.931 -0.471 1
1 327 . 13 1 1 A 26 26 GLU N N 115 116.817 117.761 -0.944 1
1 328 . 13 1 1 A 27 27 ALA H H 116 7.360 7.715 -0.355 1
1 329 . 13 1 1 A 27 27 ALA HA H 116 4.408 3.663 0.745 1
1 333 . 13 1 1 A 27 27 ALA C C 116 177.046 178.195 -1.149 1
1 334 . 13 1 1 A 27 27 ALA CA C 116 52.970 54.470 -1.500 1
1 335 . 13 1 1 A 27 27 ALA CB C 116 19.916 17.785 2.131 1
1 336 . 13 1 1 A 27 27 ALA N N 116 118.966 121.196 -2.230 1
1 337 . 13 1 1 A 28 28 ILE H H 117 7.168 7.098 0.070 1
1 338 . 13 1 1 A 28 28 ILE HA H 117 4.432 4.787 -0.355 1
1 348 . 13 1 1 A 28 28 ILE C C 117 172.641 175.424 -2.783 1
1 349 . 13 1 1 A 28 28 ILE CA C 117 59.980 59.931 0.049 1
1 350 . 13 1 1 A 28 28 ILE CB C 117 37.350 37.702 -0.352 1
1 354 . 13 1 1 A 28 28 ILE N N 117 108.913 109.288 -0.375 1
1 355 . 13 1 1 A 29 29 GLN H H 118 6.562 7.236 -0.674 1
1 356 . 13 1 1 A 29 29 GLN HA H 118 3.922 4.223 -0.301 1
1 363 . 13 1 1 A 29 29 GLN C C 118 175.049 175.535 -0.486 1
1 364 . 13 1 1 A 29 29 GLN CA C 118 54.596 56.075 -1.479 1
1 365 . 13 1 1 A 29 29 GLN CB C 118 29.570 29.250 0.320 1
1 367 . 13 1 1 A 29 29 GLN N N 118 116.455 123.074 -6.619 1
1 369 . 13 1 1 A 30 30 CYS H H 119 8.138 8.372 -0.234 1
1 370 . 13 1 1 A 30 30 CYS HA H 119 4.580 4.525 0.055 1
1 373 . 13 1 1 A 30 30 CYS CA C 119 57.810 57.246 0.564 1
1 374 . 13 1 1 A 30 30 CYS CB C 119 30.200 28.649 1.551 1
1 375 . 13 1 1 A 30 30 CYS N N 119 134.136 125.411 8.725 1
1 376 . 13 1 1 A 31 31 PRO HA H 120 4.424 4.348 0.076 1
1 383 . 13 1 1 A 31 31 PRO C C 120 177.431 178.679 -1.248 1
1 384 . 13 1 1 A 31 31 PRO CA C 120 64.060 64.682 -0.622 1
1 385 . 13 1 1 A 31 31 PRO CB C 120 32.776 32.123 0.653 1
1 388 . 13 1 1 A 32 32 ILE H H 121 11.318 7.162 4.156 1
1 389 . 13 1 1 A 32 32 ILE HA H 121 4.038 3.943 0.095 1
1 399 . 13 1 1 A 32 32 ILE C C 121 178.485 177.611 0.874 1
1 400 . 13 1 1 A 32 32 ILE CA C 121 64.060 64.207 -0.147 1
1 401 . 13 1 1 A 32 32 ILE CB C 121 39.340 38.287 1.053 1
1 405 . 13 1 1 A 32 32 ILE N N 121 124.500 116.808 7.692 1
1 406 . 13 1 1 A 33 33 THR H H 122 9.928 7.393 2.535 1
1 407 . 13 1 1 A 33 33 THR HA H 122 4.048 4.432 -0.384 1
1 412 . 13 1 1 A 33 33 THR C C 122 175.793 174.643 1.150 1
1 413 . 13 1 1 A 33 33 THR CA C 122 62.990 61.546 1.444 1
1 414 . 13 1 1 A 33 33 THR CB C 122 70.300 69.282 1.018 1
1 416 . 13 1 1 A 33 33 THR N N 122 115.136 108.691 6.445 1
1 417 . 13 1 1 A 34 34 LEU H H 123 8.439 7.746 0.693 1
1 418 . 13 1 1 A 34 34 LEU HA H 123 3.912 4.069 -0.157 1
1 428 . 13 1 1 A 34 34 LEU C C 123 175.495 175.426 0.069 1
1 429 . 13 1 1 A 34 34 LEU CA C 123 56.290 55.745 0.545 1
1 430 . 13 1 1 A 34 34 LEU CB C 123 38.500 39.697 -1.197 1
1 434 . 13 1 1 A 34 34 LEU N N 123 117.230 121.705 -4.475 1
1 435 . 13 1 1 A 35 35 GLU H H 124 7.816 7.501 0.315 1
1 436 . 13 1 1 A 35 35 GLU HA H 124 4.634 4.705 -0.071 1
1 441 . 13 1 1 A 35 35 GLU C C 124 174.838 174.127 0.711 1
1 442 . 13 1 1 A 35 35 GLU CA C 124 53.780 54.689 -0.909 1
1 443 . 13 1 1 A 35 35 GLU CB C 124 33.710 32.314 1.396 1
1 445 . 13 1 1 A 35 35 GLU N N 124 116.577 116.451 0.126 1
1 446 . 13 1 1 A 36 36 GLN H H 125 8.532 8.569 -0.037 1
1 447 . 13 1 1 A 36 36 GLN HA H 125 4.958 4.389 0.569 1
1 454 . 13 1 1 A 36 36 GLN CA C 125 53.350 53.800 -0.450 1
1 455 . 13 1 1 A 36 36 GLN CB C 125 29.950 29.834 0.116 1
1 457 . 13 1 1 A 36 36 GLN N N 125 123.034 121.467 1.567 1
1 459 . 13 1 1 A 37 37 PRO HA H 126 4.458 4.249 0.209 1
1 466 . 13 1 1 A 37 37 PRO C C 126 176.314 177.331 -1.017 1
1 467 . 13 1 1 A 37 37 PRO CA C 126 62.816 65.767 -2.951 1
1 468 . 13 1 1 A 37 37 PRO CB C 126 33.070 31.566 1.504 1
1 471 . 13 1 1 A 38 38 GLU H H 127 8.626 7.617 1.009 1
1 472 . 13 1 1 A 38 38 GLU HA H 127 4.274 4.452 -0.178 1
1 477 . 13 1 1 A 38 38 GLU C C 127 177.809 174.961 2.848 1
1 478 . 13 1 1 A 38 38 GLU CA C 127 58.730 58.291 0.439 1
1 479 . 13 1 1 A 38 38 GLU CB C 127 30.340 29.444 0.896 1
1 481 . 13 1 1 A 38 38 GLU N N 127 120.691 119.272 1.419 1
1 482 . 13 1 1 A 39 39 LYS H H 128 7.891 7.894 -0.003 1
1 483 . 13 1 1 A 39 39 LYS HA H 128 4.870 4.688 0.182 1
1 492 . 13 1 1 A 39 39 LYS C C 128 175.452 175.546 -0.094 1
1 493 . 13 1 1 A 39 39 LYS CA C 128 53.540 54.706 -1.166 1
1 494 . 13 1 1 A 39 39 LYS CB C 128 33.630 34.141 -0.511 1
1 498 . 13 1 1 A 39 39 LYS N N 128 118.149 118.021 0.128 1
1 499 . 13 1 1 A 40 40 GLY H H 129 8.524 8.093 0.431 1
1 500 . 13 1 1 A 40 40 GLY HA2 H 129 4.973 3.952 1.021 1
1 501 . 13 1 1 A 40 40 GLY HA3 H 129 2.459 4.104 -1.645 1
1 502 . 13 1 1 A 40 40 GLY C C 129 169.943 171.921 -1.978 1
1 503 . 13 1 1 A 40 40 GLY CA C 129 42.910 44.674 -1.764 1
1 504 . 13 1 1 A 40 40 GLY N N 129 112.845 111.261 1.584 1
1 505 . 13 1 1 A 41 41 ILE H H 130 8.659 8.072 0.587 1
1 506 . 13 1 1 A 41 41 ILE HA H 130 4.591 4.682 -0.091 1
1 516 . 13 1 1 A 41 41 ILE C C 130 172.586 173.954 -1.368 1
1 517 . 13 1 1 A 41 41 ILE CA C 130 58.090 59.005 -0.915 1
1 518 . 13 1 1 A 41 41 ILE CB C 130 43.320 41.992 1.328 1
1 522 . 13 1 1 A 41 41 ILE N N 130 114.060 119.259 -5.199 1
1 523 . 13 1 1 A 42 42 PHE H H 131 9.206 8.751 0.455 1
1 524 . 13 1 1 A 42 42 PHE HA H 131 5.159 4.656 0.503 1
1 532 . 13 1 1 A 42 42 PHE C C 131 174.931 175.880 -0.949 1
1 533 . 13 1 1 A 42 42 PHE CA C 131 57.790 58.146 -0.356 1
1 534 . 13 1 1 A 42 42 PHE CB C 131 42.220 39.231 2.989 1
1 538 . 13 1 1 A 42 42 PHE N N 131 126.002 128.089 -2.087 1
1 539 . 13 1 1 A 43 43 VAL H H 132 8.502 8.667 -0.165 1
1 540 . 13 1 1 A 43 43 VAL HA H 132 4.921 4.665 0.256 1
1 548 . 13 1 1 A 43 43 VAL C C 132 178.219 175.624 2.595 1
1 549 . 13 1 1 A 43 43 VAL CA C 132 59.600 60.046 -0.446 1
1 550 . 13 1 1 A 43 43 VAL CB C 132 35.920 35.700 0.220 1
1 553 . 13 1 1 A 43 43 VAL N N 132 119.068 122.405 -3.337 1
1 554 . 13 1 1 A 44 44 LYS H H 133 10.036 8.762 1.274 1
1 555 . 13 1 1 A 44 44 LYS HA H 133 5.070 4.241 0.829 1
1 564 . 13 1 1 A 44 44 LYS C C 133 177.276 177.635 -0.359 1
1 565 . 13 1 1 A 44 44 LYS CA C 133 56.720 57.389 -0.669 1
1 566 . 13 1 1 A 44 44 LYS CB C 133 34.410 32.430 1.980 1
1 570 . 13 1 1 A 44 44 LYS N N 133 130.934 125.021 5.913 1
1 571 . 13 1 1 A 45 45 ASN H H 134 8.093 8.592 -0.499 1
1 572 . 13 1 1 A 45 45 ASN HA H 134 4.152 4.808 -0.656 1
1 577 . 13 1 1 A 45 45 ASN C C 134 174.087 175.003 -0.916 1
1 578 . 13 1 1 A 45 45 ASN CA C 134 55.360 55.963 -0.603 1
1 579 . 13 1 1 A 45 45 ASN CB C 134 37.530 39.088 -1.558 1
1 580 . 13 1 1 A 45 45 ASN N N 134 117.963 124.344 -6.381 1
1 582 . 13 1 1 A 46 46 SER H H 135 7.524 7.374 0.150 1
1 583 . 13 1 1 A 46 46 SER HA H 135 4.219 4.763 -0.544 1
1 586 . 13 1 1 A 46 46 SER C C 135 174.490 173.876 0.614 1
1 587 . 13 1 1 A 46 46 SER CA C 135 57.090 57.600 -0.510 1
1 588 . 13 1 1 A 46 46 SER CB C 135 63.860 65.524 -1.664 1
1 589 . 13 1 1 A 46 46 SER N N 135 105.939 111.037 -5.098 1
1 590 . 13 1 1 A 47 47 ASP H H 136 9.113 9.164 -0.051 1
1 591 . 13 1 1 A 47 47 ASP HA H 136 4.220 4.240 -0.020 1
1 594 . 13 1 1 A 47 47 ASP CA C 136 57.610 57.166 0.444 1
1 595 . 13 1 1 A 47 47 ASP CB C 136 40.810 40.481 0.329 1
1 596 . 13 1 1 A 47 47 ASP N N 136 120.995 126.154 -5.159 1
1 597 . 13 1 1 A 48 48 GLY H H 137 8.181 8.118 0.063 1
1 598 . 13 1 1 A 48 48 GLY HA2 H 137 4.120 3.964 0.156 1
1 599 . 13 1 1 A 48 48 GLY HA3 H 137 3.659 3.964 -0.305 1
1 600 . 13 1 1 A 48 48 GLY C C 137 174.062 172.900 1.162 1
1 601 . 13 1 1 A 48 48 GLY CA C 137 45.130 45.387 -0.257 1
1 602 . 13 1 1 A 48 48 GLY N N 137 106.197 105.968 0.229 1
1 603 . 13 1 1 A 49 49 SER H H 138 7.179 7.162 0.017 1
1 604 . 13 1 1 A 49 49 SER HA H 138 4.383 5.028 -0.645 1
1 607 . 13 1 1 A 49 49 SER C C 138 173.864 173.503 0.361 1
1 608 . 13 1 1 A 49 49 SER CA C 138 57.614 57.468 0.146 1
1 609 . 13 1 1 A 49 49 SER CB C 138 65.100 66.766 -1.666 1
1 610 . 13 1 1 A 49 49 SER N N 138 115.015 114.652 0.363 1
1 611 . 13 1 1 A 50 50 ASP H H 139 8.078 8.463 -0.385 1
1 612 . 13 1 1 A 50 50 ASP HA H 139 4.642 4.821 -0.179 1
1 615 . 13 1 1 A 50 50 ASP C C 139 174.261 175.022 -0.761 1
1 616 . 13 1 1 A 50 50 ASP CA C 139 52.406 54.227 -1.821 1
1 617 . 13 1 1 A 50 50 ASP CB C 139 40.254 41.317 -1.063 1
1 618 . 13 1 1 A 50 50 ASP N N 139 122.400 122.245 0.155 1
1 619 . 13 1 1 A 51 51 VAL H H 140 8.111 7.462 0.649 1
1 620 . 13 1 1 A 51 51 VAL HA H 140 4.360 4.540 -0.180 1
1 628 . 13 1 1 A 51 51 VAL C C 140 176.147 173.924 2.223 1
1 629 . 13 1 1 A 51 51 VAL CA C 140 62.670 60.374 2.296 1
1 630 . 13 1 1 A 51 51 VAL CB C 140 33.930 33.729 0.201 1
1 632 . 13 1 1 A 51 51 VAL N N 140 120.374 119.527 0.847 1
1 633 . 13 1 1 A 52 52 CYS H H 141 8.358 8.991 -0.633 1
1 634 . 13 1 1 A 52 52 CYS HA H 141 4.957 5.501 -0.544 1
1 637 . 13 1 1 A 52 52 CYS C C 141 173.070 172.763 0.307 1
1 638 . 13 1 1 A 52 52 CYS CA C 141 53.380 54.358 -0.978 1
1 639 . 13 1 1 A 52 52 CYS CB C 141 46.110 46.125 -0.015 1
1 640 . 13 1 1 A 52 52 CYS N N 141 121.305 128.744 -7.439 1
1 641 . 13 1 1 A 53 53 THR H H 142 8.929 8.721 0.208 1
1 642 . 13 1 1 A 53 53 THR HA H 142 4.498 4.874 -0.376 1
1 648 . 13 1 1 A 53 53 THR C C 142 172.151 172.135 0.016 1
1 649 . 13 1 1 A 53 53 THR CA C 142 62.960 60.958 2.002 1
1 650 . 13 1 1 A 53 53 THR CB C 142 70.540 72.798 -2.258 1
1 652 . 13 1 1 A 53 53 THR N N 142 120.105 118.100 2.005 1
1 653 . 13 1 1 A 54 54 LEU H H 143 8.448 8.565 -0.117 1
1 654 . 13 1 1 A 54 54 LEU HA H 143 4.322 4.699 -0.377 1
1 664 . 13 1 1 A 54 54 LEU C C 143 174.484 174.387 0.097 1
1 665 . 13 1 1 A 54 54 LEU CA C 143 54.596 53.319 1.277 1
1 666 . 13 1 1 A 54 54 LEU CB C 143 42.396 43.784 -1.388 1
1 670 . 13 1 1 A 54 54 LEU N N 143 128.819 128.099 0.720 1
1 671 . 13 1 1 A 55 55 PHE H H 144 8.661 8.644 0.017 1
1 672 . 13 1 1 A 55 55 PHE HA H 144 5.459 4.981 0.478 1
1 680 . 13 1 1 A 55 55 PHE C C 144 176.035 174.777 1.258 1
1 681 . 13 1 1 A 55 55 PHE CA C 144 55.020 56.698 -1.678 1
1 682 . 13 1 1 A 55 55 PHE CB C 144 44.100 42.560 1.540 1
1 686 . 13 1 1 A 55 55 PHE N N 144 121.897 125.959 -4.062 1
1 687 . 13 1 1 A 56 56 ASP H H 145 11.616 8.575 3.041 1
1 688 . 13 1 1 A 56 56 ASP HA H 145 4.417 4.579 -0.162 1
1 691 . 13 1 1 A 56 56 ASP C C 145 176.748 177.490 -0.742 1
1 692 . 13 1 1 A 56 56 ASP CA C 145 55.844 54.509 1.335 1
1 693 . 13 1 1 A 56 56 ASP CB C 145 44.390 42.883 1.507 1
1 694 . 13 1 1 A 56 56 ASP N N 145 122.131 121.866 0.265 1
1 695 . 13 1 1 A 57 57 ALA H H 146 8.508 8.913 -0.405 1
1 696 . 13 1 1 A 57 57 ALA HA H 146 3.797 4.074 -0.277 1
1 700 . 13 1 1 A 57 57 ALA C C 146 178.696 180.025 -1.329 1
1 701 . 13 1 1 A 57 57 ALA CA C 146 55.990 55.431 0.559 1
1 702 . 13 1 1 A 57 57 ALA CB C 146 18.840 18.081 0.759 1
1 703 . 13 1 1 A 57 57 ALA N N 146 130.243 128.854 1.389 1
1 704 . 13 1 1 A 58 58 ALA H H 147 8.378 7.903 0.475 1
1 705 . 13 1 1 A 58 58 ALA HA H 147 4.078 4.182 -0.104 1
1 709 . 13 1 1 A 58 58 ALA C C 147 181.091 179.700 1.391 1
1 710 . 13 1 1 A 58 58 ALA CA C 147 54.770 54.930 -0.160 1
1 711 . 13 1 1 A 58 58 ALA CB C 147 17.700 18.412 -0.712 1
1 712 . 13 1 1 A 58 58 ALA N N 147 121.997 119.793 2.204 1
1 713 . 13 1 1 A 59 59 ALA H H 148 9.138 8.036 1.102 1
1 714 . 13 1 1 A 59 59 ALA HA H 148 3.975 4.078 -0.103 1
1 718 . 13 1 1 A 59 59 ALA C C 148 180.508 179.774 0.734 1
1 719 . 13 1 1 A 59 59 ALA CA C 148 54.840 55.023 -0.183 1
1 720 . 13 1 1 A 59 59 ALA CB C 148 18.600 18.523 0.077 1
1 721 . 13 1 1 A 59 59 ALA N N 148 123.595 120.285 3.310 1
1 722 . 13 1 1 A 60 60 PHE H H 149 8.814 8.089 0.725 1
1 723 . 13 1 1 A 60 60 PHE HA H 149 3.722 4.032 -0.310 1
1 731 . 13 1 1 A 60 60 PHE C C 149 176.773 177.619 -0.846 1
1 732 . 13 1 1 A 60 60 PHE CA C 149 62.030 61.461 0.569 1
1 733 . 13 1 1 A 60 60 PHE CB C 149 39.960 38.778 1.182 1
1 737 . 13 1 1 A 60 60 PHE N N 149 120.354 119.931 0.423 1
1 738 . 13 1 1 A 61 61 SER H H 150 8.276 8.129 0.147 1
1 739 . 13 1 1 A 61 61 SER HA H 150 3.880 4.085 -0.205 1
1 742 . 13 1 1 A 61 61 SER C C 150 177.691 176.521 1.170 1
1 743 . 13 1 1 A 61 61 SER CA C 150 62.190 61.522 0.668 1
1 744 . 13 1 1 A 61 61 SER CB C 150 63.016 62.947 0.069 1
1 745 . 13 1 1 A 61 61 SER N N 150 112.086 114.200 -2.114 1
1 746 . 13 1 1 A 62 62 ARG H H 151 7.829 7.908 -0.079 1
1 747 . 13 1 1 A 62 62 ARG HA H 151 3.971 4.022 -0.051 1
1 754 . 13 1 1 A 62 62 ARG C C 151 178.287 178.348 -0.061 1
1 755 . 13 1 1 A 62 62 ARG CA C 151 59.340 58.950 0.390 1
1 756 . 13 1 1 A 62 62 ARG CB C 151 29.760 29.718 0.042 1
1 759 . 13 1 1 A 62 62 ARG N N 151 121.090 119.219 1.871 1
1 760 . 13 1 1 A 63 63 LEU H H 152 7.390 7.471 -0.081 1
1 761 . 13 1 1 A 63 63 LEU HA H 152 3.791 3.935 -0.144 1
1 771 . 13 1 1 A 63 63 LEU C C 152 179.106 178.215 0.891 1
1 772 . 13 1 1 A 63 63 LEU CA C 152 58.900 58.177 0.723 1
1 773 . 13 1 1 A 63 63 LEU CB C 152 41.140 41.222 -0.082 1
1 777 . 13 1 1 A 63 63 LEU N N 152 121.129 122.053 -0.924 1
1 778 . 13 1 1 A 64 64 VAL H H 153 7.552 8.012 -0.460 1
1 779 . 13 1 1 A 64 64 VAL HA H 153 3.411 3.510 -0.099 1
1 787 . 13 1 1 A 64 64 VAL C C 153 180.595 178.812 1.783 1
1 788 . 13 1 1 A 64 64 VAL CA C 153 65.644 66.052 -0.408 1
1 789 . 13 1 1 A 64 64 VAL CB C 153 31.410 31.353 0.057 1
1 792 . 13 1 1 A 64 64 VAL N N 153 118.280 118.924 -0.644 1
1 793 . 13 1 1 A 65 65 GLY H H 154 8.061 8.328 -0.267 1
1 794 . 13 1 1 A 65 65 GLY HA2 H 154 3.846 3.805 0.041 1
1 795 . 13 1 1 A 65 65 GLY HA3 H 154 3.809 3.807 0.002 1
1 796 . 13 1 1 A 65 65 GLY C C 154 175.235 175.645 -0.410 1
1 797 . 13 1 1 A 65 65 GLY CA C 154 46.630 46.721 -0.091 1
1 798 . 13 1 1 A 65 65 GLY N N 154 108.622 107.897 0.725 1
1 799 . 13 1 1 A 66 66 GLU H H 155 7.528 7.457 0.071 1
1 800 . 13 1 1 A 66 66 GLU HA H 155 4.228 4.339 -0.111 1
1 805 . 13 1 1 A 66 66 GLU C C 155 176.761 176.978 -0.217 1
1 806 . 13 1 1 A 66 66 GLU CA C 155 56.590 56.329 0.261 1
1 807 . 13 1 1 A 66 66 GLU CB C 155 30.490 30.494 -0.004 1
1 809 . 13 1 1 A 66 66 GLU N N 155 118.361 118.387 -0.026 1
1 810 . 13 1 1 A 67 67 GLY H H 156 7.884 7.523 0.361 1
1 811 . 13 1 1 A 67 67 GLY HA2 H 156 3.918 3.866 0.052 1
1 812 . 13 1 1 A 67 67 GLY HA3 H 156 3.747 3.883 -0.136 1
1 813 . 13 1 1 A 67 67 GLY C C 156 174.788 174.566 0.222 1
1 814 . 13 1 1 A 67 67 GLY CA C 156 45.890 46.195 -0.305 1
1 815 . 13 1 1 A 67 67 GLY N N 156 108.465 108.277 0.188 1
1 816 . 13 1 1 A 68 68 LEU H H 157 7.332 7.809 -0.477 1
1 817 . 13 1 1 A 68 68 LEU HA H 157 4.361 4.625 -0.264 1
1 827 . 13 1 1 A 68 68 LEU CA C 157 53.060 52.094 0.966 1
1 828 . 13 1 1 A 68 68 LEU CB C 157 41.100 41.832 -0.732 1
1 832 . 13 1 1 A 68 68 LEU N N 157 121.920 121.412 0.508 1
1 833 . 13 1 1 A 69 69 PRO HA H 158 4.485 4.551 -0.066 1
1 840 . 13 1 1 A 69 69 PRO C C 158 174.602 176.370 -1.768 1
1 841 . 13 1 1 A 69 69 PRO CA C 158 61.556 62.258 -0.702 1
1 842 . 13 1 1 A 69 69 PRO CB C 158 32.370 32.471 -0.101 1
1 845 . 13 1 1 A 70 70 HIS H H 159 8.734 8.515 0.219 1
1 846 . 13 1 1 A 70 70 HIS HA H 159 3.947 4.480 -0.533 1
1 852 . 13 1 1 A 70 70 HIS CA C 159 56.250 55.264 0.986 1
1 853 . 13 1 1 A 70 70 HIS CB C 159 32.280 31.000 1.280 1
1 856 . 13 1 1 A 70 70 HIS N N 159 119.423 121.928 -2.505 1
1 857 . 13 1 1 A 71 71 PRO HA H 160 4.424 4.152 0.272 1
1 864 . 13 1 1 A 71 71 PRO C C 160 177.567 178.626 -1.059 1
1 865 . 13 1 1 A 71 71 PRO CA C 160 64.574 65.489 -0.915 1
1 866 . 13 1 1 A 71 71 PRO CB C 160 32.340 31.767 0.573 1
1 869 . 13 1 1 A 72 72 LEU H H 161 10.123 7.604 2.519 1
1 870 . 13 1 1 A 72 72 LEU HA H 161 4.778 4.263 0.515 1
1 880 . 13 1 1 A 72 72 LEU C C 161 178.721 177.852 0.869 1
1 881 . 13 1 1 A 72 72 LEU CA C 161 55.800 57.279 -1.479 1
1 882 . 13 1 1 A 72 72 LEU CB C 161 42.440 42.696 -0.256 1
1 886 . 13 1 1 A 72 72 LEU N N 161 117.374 117.285 0.089 1
1 887 . 13 1 1 A 73 73 THR H H 162 7.523 7.799 -0.276 1
1 888 . 13 1 1 A 73 73 THR HA H 162 4.291 4.604 -0.313 1
1 893 . 13 1 1 A 73 73 THR C C 162 175.557 174.462 1.095 1
1 894 . 13 1 1 A 73 73 THR CA C 162 61.440 62.046 -0.606 1
1 895 . 13 1 1 A 73 73 THR CB C 162 70.500 69.927 0.573 1
1 897 . 13 1 1 A 73 73 THR N N 162 107.787 111.484 -3.697 1
1 898 . 13 1 1 A 74 74 ARG H H 163 8.361 8.010 0.351 1
1 899 . 13 1 1 A 74 74 ARG HA H 163 3.836 4.196 -0.360 1
1 906 . 13 1 1 A 74 74 ARG C C 163 174.701 175.178 -0.477 1
1 907 . 13 1 1 A 74 74 ARG CA C 163 57.980 57.365 0.615 1
1 908 . 13 1 1 A 74 74 ARG CB C 163 26.770 27.011 -0.241 1
1 911 . 13 1 1 A 74 74 ARG N N 163 115.130 118.716 -3.586 1
1 912 . 13 1 1 A 75 75 GLU H H 164 7.430 8.126 -0.696 1
1 913 . 13 1 1 A 75 75 GLU HA H 164 4.636 4.447 0.189 1
1 918 . 13 1 1 A 75 75 GLU CA C 164 53.699 55.246 -1.547 1
1 919 . 13 1 1 A 75 75 GLU CB C 164 29.550 28.541 1.009 1
1 921 . 13 1 1 A 75 75 GLU N N 164 120.076 118.900 1.176 1
1 922 . 13 1 1 A 76 76 PRO HA H 165 4.272 4.562 -0.290 1
1 929 . 13 1 1 A 76 76 PRO C C 165 176.649 176.773 -0.124 1
1 930 . 13 1 1 A 76 76 PRO CA C 165 63.204 62.974 0.230 1
1 931 . 13 1 1 A 76 76 PRO CB C 165 31.680 31.555 0.125 1
1 934 . 13 1 1 A 77 77 ILE H H 166 8.812 8.246 0.566 1
1 935 . 13 1 1 A 77 77 ILE HA H 166 3.838 4.335 -0.497 1
1 945 . 13 1 1 A 77 77 ILE C C 166 175.235 175.715 -0.480 1
1 946 . 13 1 1 A 77 77 ILE CA C 166 62.816 61.009 1.807 1
1 947 . 13 1 1 A 77 77 ILE CB C 166 37.750 37.275 0.475 1
1 951 . 13 1 1 A 77 77 ILE N N 166 123.831 124.031 -0.200 1
1 952 . 13 1 1 A 78 78 THR H H 167 6.625 8.606 -1.981 1
1 953 . 13 1 1 A 78 78 THR HA H 167 4.632 4.871 -0.239 1
1 958 . 13 1 1 A 78 78 THR C C 167 174.143 173.823 0.320 1
1 959 . 13 1 1 A 78 78 THR CA C 167 58.750 59.922 -1.172 1
1 960 . 13 1 1 A 78 78 THR CB C 167 71.320 70.517 0.803 1
1 962 . 13 1 1 A 78 78 THR N N 167 115.293 118.926 -3.633 1
1 963 . 13 1 1 A 79 79 ALA H H 168 9.088 8.875 0.213 1
1 964 . 13 1 1 A 79 79 ALA HA H 168 3.916 4.140 -0.224 1
1 968 . 13 1 1 A 79 79 ALA C C 168 179.770 179.387 0.383 1
1 969 . 13 1 1 A 79 79 ALA CA C 168 55.480 54.941 0.539 1
1 970 . 13 1 1 A 79 79 ALA CB C 168 17.630 18.376 -0.746 1
1 971 . 13 1 1 A 79 79 ALA N N 168 122.102 127.189 -5.087 1
1 972 . 13 1 1 A 80 80 SER H H 169 7.988 7.914 0.074 1
1 973 . 13 1 1 A 80 80 SER HA H 169 4.091 4.222 -0.131 1
1 976 . 13 1 1 A 80 80 SER C C 169 175.836 176.354 -0.518 1
1 977 . 13 1 1 A 80 80 SER CA C 169 60.750 61.293 -0.543 1
1 978 . 13 1 1 A 80 80 SER CB C 169 62.510 63.163 -0.653 1
1 979 . 13 1 1 A 80 80 SER N N 169 109.660 112.980 -3.320 1
1 980 . 13 1 1 A 81 81 ILE H H 170 7.052 7.327 -0.275 1
1 981 . 13 1 1 A 81 81 ILE HA H 170 4.344 4.184 0.160 1
1 991 . 13 1 1 A 81 81 ILE C C 170 174.236 176.435 -2.199 1
1 992 . 13 1 1 A 81 81 ILE CA C 170 61.760 63.699 -1.939 1
1 993 . 13 1 1 A 81 81 ILE CB C 170 37.950 38.050 -0.100 1
1 997 . 13 1 1 A 81 81 ILE N N 170 112.623 112.992 -0.369 1
1 998 . 13 1 1 A 82 82 ILE H H 171 7.345 7.577 -0.232 1
1 999 . 13 1 1 A 82 82 ILE HA H 171 4.288 4.007 0.281 1
1 1009 . 13 1 1 A 82 82 ILE C C 171 174.931 175.258 -0.327 1
1 1010 . 13 1 1 A 82 82 ILE CA C 171 61.420 61.732 -0.312 1
1 1011 . 13 1 1 A 82 82 ILE CB C 171 37.230 37.889 -0.659 1
1 1015 . 13 1 1 A 82 82 ILE N N 171 124.260 124.743 -0.483 1
1 1016 . 13 1 1 A 83 83 VAL H H 172 7.843 8.720 -0.877 1
1 1017 . 13 1 1 A 83 83 VAL HA H 172 4.818 5.104 -0.286 1
1 1025 . 13 1 1 A 83 83 VAL C C 172 174.918 175.697 -0.779 1
1 1026 . 13 1 1 A 83 83 VAL CA C 172 58.910 59.304 -0.394 1
1 1027 . 13 1 1 A 83 83 VAL CB C 172 34.570 34.979 -0.409 1
1 1030 . 13 1 1 A 83 83 VAL N N 172 118.856 121.971 -3.115 1
1 1031 . 13 1 1 A 84 84 LYS H H 173 8.347 8.779 -0.432 1
1 1032 . 13 1 1 A 84 84 LYS HA H 173 4.356 4.751 -0.395 1
1 1041 . 13 1 1 A 84 84 LYS C C 173 178.653 178.121 0.532 1
1 1042 . 13 1 1 A 84 84 LYS CA C 173 56.360 55.212 1.148 1
1 1043 . 13 1 1 A 84 84 LYS CB C 173 33.366 33.875 -0.509 1
1 1047 . 13 1 1 A 84 84 LYS N N 173 119.602 121.771 -2.169 1
1 1048 . 13 1 1 A 85 85 HIS H H 174 9.143 8.777 0.366 1
1 1049 . 13 1 1 A 85 85 HIS HA H 174 4.013 4.472 -0.459 1
1 1053 . 13 1 1 A 85 85 HIS C C 174 176.606 177.940 -1.334 1
1 1054 . 13 1 1 A 85 85 HIS CA C 174 58.820 59.792 -0.972 1
1 1055 . 13 1 1 A 85 85 HIS CB C 174 28.186 29.164 -0.978 1
1 1057 . 13 1 1 A 85 85 HIS N N 174 120.022 121.172 -1.150 1
1 1058 . 13 1 1 A 86 86 GLU H H 175 8.403 8.141 0.262 1
1 1059 . 13 1 1 A 86 86 GLU HA H 175 3.863 3.860 0.003 1
1 1064 . 13 1 1 A 86 86 GLU C C 175 177.040 179.162 -2.122 1
1 1065 . 13 1 1 A 86 86 GLU CA C 175 57.830 59.698 -1.868 1
1 1066 . 13 1 1 A 86 86 GLU CB C 175 28.690 29.462 -0.772 1
1 1068 . 13 1 1 A 86 86 GLU N N 175 116.124 120.072 -3.948 1
1 1069 . 13 1 1 A 87 87 GLU H H 176 7.669 8.094 -0.425 1
1 1070 . 13 1 1 A 87 87 GLU HA H 176 4.039 3.881 0.158 1
1 1075 . 13 1 1 A 87 87 GLU C C 176 175.688 177.248 -1.560 1
1 1076 . 13 1 1 A 87 87 GLU CA C 176 57.906 59.637 -1.731 1
1 1077 . 13 1 1 A 87 87 GLU CB C 176 30.430 29.235 1.195 1
1 1079 . 13 1 1 A 87 87 GLU N N 176 116.183 118.678 -2.495 1
1 1080 . 13 1 1 A 88 88 CYS H H 177 6.750 7.872 -1.122 1
1 1081 . 13 1 1 A 88 88 CYS HA H 177 4.991 4.855 0.136 1
1 1084 . 13 1 1 A 88 88 CYS C C 177 172.325 173.375 -1.050 1
1 1085 . 13 1 1 A 88 88 CYS CA C 177 55.030 54.257 0.773 1
1 1086 . 13 1 1 A 88 88 CYS CB C 177 45.610 42.185 3.425 1
1 1087 . 13 1 1 A 88 88 CYS N N 177 114.838 116.568 -1.730 1
1 1088 . 13 1 1 A 89 89 ILE H H 178 9.128 8.766 0.362 1
1 1089 . 13 1 1 A 89 89 ILE HA H 178 4.536 4.993 -0.457 1
1 1099 . 13 1 1 A 89 89 ILE C C 178 174.893 174.342 0.551 1
1 1100 . 13 1 1 A 89 89 ILE CA C 178 59.160 59.604 -0.444 1
1 1101 . 13 1 1 A 89 89 ILE CB C 178 41.840 40.678 1.162 1
1 1105 . 13 1 1 A 89 89 ILE N N 178 120.564 121.101 -0.537 1
1 1106 . 13 1 1 A 90 90 TYR H H 179 9.349 9.089 0.260 1
1 1107 . 13 1 1 A 90 90 TYR HA H 179 3.568 4.235 -0.667 1
1 1112 . 13 1 1 A 90 90 TYR C C 179 173.950 174.031 -0.081 1
1 1113 . 13 1 1 A 90 90 TYR CA C 179 61.180 57.661 3.519 1
1 1114 . 13 1 1 A 90 90 TYR CB C 179 37.530 38.153 -0.623 1
1 1116 . 13 1 1 A 90 90 TYR N N 179 129.033 127.201 1.832 1
1 1117 . 13 1 1 A 91 91 ASP H H 180 7.367 8.199 -0.832 1
1 1118 . 13 1 1 A 91 91 ASP HA H 180 4.662 4.704 -0.042 1
1 1121 . 13 1 1 A 91 91 ASP C C 180 175.291 175.754 -0.463 1
1 1122 . 13 1 1 A 91 91 ASP CA C 180 52.230 53.371 -1.141 1
1 1123 . 13 1 1 A 91 91 ASP CB C 180 43.650 42.319 1.331 1
1 1124 . 13 1 1 A 91 91 ASP N N 180 129.305 128.877 0.428 1
1 1125 . 13 1 1 A 92 92 ASP H H 181 8.783 9.085 -0.302 1
1 1126 . 13 1 1 A 92 92 ASP HA H 181 4.114 4.074 0.040 1
1 1129 . 13 1 1 A 92 92 ASP C C 181 177.573 177.696 -0.123 1
1 1130 . 13 1 1 A 92 92 ASP CA C 181 56.390 57.789 -1.399 1
1 1131 . 13 1 1 A 92 92 ASP CB C 181 41.330 40.860 0.470 1
1 1132 . 13 1 1 A 92 92 ASP N N 181 125.665 127.810 -2.145 1
1 1133 . 13 1 1 A 93 93 THR H H 182 8.284 8.020 0.264 1
1 1134 . 13 1 1 A 93 93 THR HA H 182 4.037 3.880 0.157 1
1 1139 . 13 1 1 A 93 93 THR C C 182 176.333 176.198 0.135 1
1 1140 . 13 1 1 A 93 93 THR CA C 182 65.320 66.911 -1.591 1
1 1141 . 13 1 1 A 93 93 THR CB C 182 68.560 68.270 0.290 1
1 1143 . 13 1 1 A 93 93 THR N N 182 114.688 115.889 -1.201 1
1 1144 . 13 1 1 A 94 94 ARG H H 183 7.784 7.512 0.272 1
1 1145 . 13 1 1 A 94 94 ARG HA H 183 4.142 4.199 -0.057 1
1 1152 . 13 1 1 A 94 94 ARG C C 183 177.015 177.036 -0.021 1
1 1153 . 13 1 1 A 94 94 ARG CA C 183 55.350 56.161 -0.811 1
1 1154 . 13 1 1 A 94 94 ARG CB C 183 30.930 30.808 0.122 1
1 1157 . 13 1 1 A 94 94 ARG N N 183 120.156 118.248 1.908 1
1 1158 . 13 1 1 A 95 95 GLY H H 184 8.144 8.620 -0.476 1
1 1159 . 13 1 1 A 95 95 GLY HA2 H 184 3.839 3.689 0.150 1
1 1160 . 13 1 1 A 95 95 GLY HA3 H 184 3.681 3.867 -0.186 1
1 1161 . 13 1 1 A 95 95 GLY C C 184 173.653 173.099 0.554 1
1 1162 . 13 1 1 A 95 95 GLY CA C 184 46.160 46.108 0.052 1
1 1163 . 13 1 1 A 95 95 GLY N N 184 107.879 108.659 -0.780 1
1 1164 . 13 1 1 A 96 96 ASN H H 185 6.855 6.925 -0.070 1
1 1165 . 13 1 1 A 96 96 ASN HA H 185 4.909 5.014 -0.105 1
1 1170 . 13 1 1 A 96 96 ASN C C 185 174.223 173.123 1.100 1
1 1171 . 13 1 1 A 96 96 ASN CA C 185 52.720 52.212 0.508 1
1 1172 . 13 1 1 A 96 96 ASN CB C 185 45.620 41.673 3.947 1
1 1173 . 13 1 1 A 96 96 ASN N N 185 113.382 116.029 -2.647 1
1 1175 . 13 1 1 A 97 97 PHE H H 186 9.228 8.628 0.600 1
1 1176 . 13 1 1 A 97 97 PHE HA H 186 4.579 4.539 0.040 1
1 1183 . 13 1 1 A 97 97 PHE C C 186 174.794 175.597 -0.803 1
1 1184 . 13 1 1 A 97 97 PHE CA C 186 59.384 59.096 0.288 1
1 1185 . 13 1 1 A 97 97 PHE CB C 186 40.450 39.216 1.234 1
1 1188 . 13 1 1 A 97 97 PHE N N 186 118.661 119.442 -0.781 1
1 1189 . 13 1 1 A 98 98 ILE H H 187 8.908 9.028 -0.120 1
1 1190 . 13 1 1 A 98 98 ILE HA H 187 5.440 4.789 0.651 1
1 1200 . 13 1 1 A 98 98 ILE C C 187 176.171 175.144 1.027 1
1 1201 . 13 1 1 A 98 98 ILE CA C 187 57.610 60.126 -2.516 1
1 1202 . 13 1 1 A 98 98 ILE CB C 187 41.280 39.469 1.811 1
1 1206 . 13 1 1 A 98 98 ILE N N 187 120.585 123.439 -2.854 1
1 1207 . 13 1 1 A 99 99 ILE H H 188 8.602 8.332 0.270 1
1 1208 . 13 1 1 A 99 99 ILE HA H 188 4.546 4.867 -0.321 1
1 1218 . 13 1 1 A 99 99 ILE C C 188 176.668 175.138 1.530 1
1 1219 . 13 1 1 A 99 99 ILE CA C 188 58.920 60.085 -1.165 1
1 1220 . 13 1 1 A 99 99 ILE CB C 188 37.960 39.690 -1.730 1
1 1224 . 13 1 1 A 99 99 ILE N N 188 124.500 124.550 -0.050 1
1 1225 . 13 1 1 A 100 100 LYS H H 189 8.449 8.562 -0.113 1
1 1226 . 13 1 1 A 100 100 LYS HA H 189 4.108 4.893 -0.785 1
1 1235 . 13 1 1 A 100 100 LYS C C 189 176.866 175.057 1.809 1
1 1236 . 13 1 1 A 100 100 LYS CA C 189 56.800 55.154 1.646 1
1 1237 . 13 1 1 A 100 100 LYS CB C 189 33.400 34.367 -0.967 1
1 1241 . 13 1 1 A 100 100 LYS N N 189 128.581 126.847 1.734 1
1 1242 . 13 1 1 A 101 101 GLY H H 190 8.381 8.293 0.088 1
1 1243 . 13 1 1 A 101 101 GLY HA2 H 190 3.946 4.111 -0.165 1
1 1244 . 13 1 1 A 101 101 GLY HA3 H 190 3.828 4.112 -0.284 1
1 1245 . 13 1 1 A 101 101 GLY C C 190 172.902 174.030 -1.128 1
1 1246 . 13 1 1 A 101 101 GLY CA C 190 44.920 45.595 -0.675 1
1 1247 . 13 1 1 A 101 101 GLY N N 190 111.183 112.711 -1.528 1
1 7 . 14 1 1 A 2 2 GLN H H 91 8.786 8.837 -0.051 1
1 8 . 14 1 1 A 2 2 GLN HA H 91 4.005 3.973 0.032 1
1 15 . 14 1 1 A 2 2 GLN C C 91 177.270 177.099 0.171 1
1 16 . 14 1 1 A 2 2 GLN CA C 91 58.220 59.121 -0.901 1
1 17 . 14 1 1 A 2 2 GLN CB C 91 28.650 28.368 0.282 1
1 19 . 14 1 1 A 2 2 GLN N N 91 121.993 124.004 -2.011 1
1 21 . 14 1 1 A 3 3 GLU H H 92 8.430 8.177 0.253 1
1 22 . 14 1 1 A 3 3 GLU HA H 92 4.007 4.080 -0.073 1
1 27 . 14 1 1 A 3 3 GLU C C 92 178.287 178.650 -0.363 1
1 28 . 14 1 1 A 3 3 GLU CA C 92 59.490 59.258 0.232 1
1 29 . 14 1 1 A 3 3 GLU CB C 92 29.506 29.325 0.181 1
1 31 . 14 1 1 A 3 3 GLU N N 92 120.195 120.039 0.156 1
1 32 . 14 1 1 A 4 4 SER H H 93 8.209 7.790 0.419 1
1 33 . 14 1 1 A 4 4 SER HA H 93 4.272 4.264 0.008 1
1 36 . 14 1 1 A 4 4 SER C C 93 177.369 177.274 0.095 1
1 37 . 14 1 1 A 4 4 SER CA C 93 61.044 61.262 -0.218 1
1 38 . 14 1 1 A 4 4 SER CB C 93 62.950 62.834 0.116 1
1 39 . 14 1 1 A 4 4 SER N N 93 115.524 114.528 0.996 1
1 40 . 14 1 1 A 5 5 ILE H H 94 8.080 8.038 0.042 1
1 41 . 14 1 1 A 5 5 ILE HA H 94 3.530 3.675 -0.145 1
1 51 . 14 1 1 A 5 5 ILE C C 94 177.778 177.646 0.132 1
1 52 . 14 1 1 A 5 5 ILE CA C 94 65.710 65.327 0.383 1
1 53 . 14 1 1 A 5 5 ILE CB C 94 37.800 37.368 0.432 1
1 57 . 14 1 1 A 5 5 ILE N N 94 124.148 122.054 2.094 1
1 58 . 14 1 1 A 6 6 GLN H H 95 8.374 8.151 0.223 1
1 59 . 14 1 1 A 6 6 GLN HA H 95 4.125 3.901 0.224 1
1 66 . 14 1 1 A 6 6 GLN C C 95 179.726 178.940 0.786 1
1 67 . 14 1 1 A 6 6 GLN CA C 95 59.190 58.952 0.238 1
1 68 . 14 1 1 A 6 6 GLN CB C 95 27.060 28.276 -1.216 1
1 70 . 14 1 1 A 6 6 GLN N N 95 118.257 119.000 -0.743 1
1 72 . 14 1 1 A 7 7 ASN H H 96 8.456 8.387 0.069 1
1 73 . 14 1 1 A 7 7 ASN HA H 96 4.446 4.560 -0.114 1
1 78 . 14 1 1 A 7 7 ASN C C 96 177.257 177.431 -0.174 1
1 79 . 14 1 1 A 7 7 ASN CA C 96 56.020 55.952 0.068 1
1 80 . 14 1 1 A 7 7 ASN CB C 96 38.126 37.873 0.253 1
1 81 . 14 1 1 A 7 7 ASN N N 96 118.597 118.461 0.136 1
1 83 . 14 1 1 A 8 8 LYS H H 97 7.732 7.668 0.064 1
1 84 . 14 1 1 A 8 8 LYS HA H 97 4.129 4.070 0.059 1
1 93 . 14 1 1 A 8 8 LYS C C 97 179.143 179.405 -0.262 1
1 94 . 14 1 1 A 8 8 LYS CA C 97 59.126 59.576 -0.450 1
1 95 . 14 1 1 A 8 8 LYS CB C 97 32.070 32.115 -0.045 1
1 99 . 14 1 1 A 8 8 LYS N N 97 122.381 121.031 1.350 1
1 100 . 14 1 1 A 9 9 ILE H H 98 8.452 7.900 0.552 1
1 101 . 14 1 1 A 9 9 ILE HA H 98 3.480 3.915 -0.435 1
1 111 . 14 1 1 A 9 9 ILE C C 98 177.406 178.365 -0.959 1
1 112 . 14 1 1 A 9 9 ILE CA C 98 66.430 64.487 1.943 1
1 113 . 14 1 1 A 9 9 ILE CB C 98 37.980 36.918 1.062 1
1 117 . 14 1 1 A 9 9 ILE N N 98 119.950 120.281 -0.331 1
1 118 . 14 1 1 A 10 10 SER H H 99 7.924 7.702 0.222 1
1 119 . 14 1 1 A 10 10 SER HA H 99 3.983 4.207 -0.224 1
1 122 . 14 1 1 A 10 10 SER C C 99 176.327 176.425 -0.098 1
1 123 . 14 1 1 A 10 10 SER CA C 99 61.990 61.392 0.598 1
1 124 . 14 1 1 A 10 10 SER CB C 99 62.790 62.914 -0.124 1
1 125 . 14 1 1 A 10 10 SER N N 99 113.568 117.130 -3.562 1
1 126 . 14 1 1 A 11 11 GLN H H 100 7.832 7.958 -0.126 1
1 127 . 14 1 1 A 11 11 GLN HA H 100 4.238 4.333 -0.095 1
1 134 . 14 1 1 A 11 11 GLN C C 100 178.088 177.669 0.419 1
1 135 . 14 1 1 A 11 11 GLN CA C 100 57.900 58.149 -0.249 1
1 136 . 14 1 1 A 11 11 GLN CB C 100 29.790 29.464 0.326 1
1 138 . 14 1 1 A 11 11 GLN N N 100 117.487 118.035 -0.548 1
1 140 . 14 1 1 A 12 12 CYS H H 101 7.920 8.073 -0.153 1
1 141 . 14 1 1 A 12 12 CYS HA H 101 4.657 4.450 0.207 1
1 144 . 14 1 1 A 12 12 CYS C C 101 175.439 174.792 0.647 1
1 145 . 14 1 1 A 12 12 CYS CA C 101 60.654 58.736 1.918 1
1 146 . 14 1 1 A 12 12 CYS CB C 101 29.310 27.172 2.138 1
1 147 . 14 1 1 A 12 12 CYS N N 101 114.221 116.930 -2.709 1
1 148 . 14 1 1 A 13 13 LYS H H 102 7.993 7.429 0.564 1
1 149 . 14 1 1 A 13 13 LYS HA H 102 5.038 4.628 0.410 1
1 158 . 14 1 1 A 13 13 LYS C C 102 174.757 176.288 -1.531 1
1 159 . 14 1 1 A 13 13 LYS CA C 102 56.660 56.091 0.569 1
1 160 . 14 1 1 A 13 13 LYS CB C 102 32.970 33.492 -0.522 1
1 164 . 14 1 1 A 13 13 LYS N N 102 123.841 119.801 4.040 1
1 165 . 14 1 1 A 14 14 PHE H H 103 8.822 8.709 0.113 1
1 166 . 14 1 1 A 14 14 PHE HA H 103 5.058 5.097 -0.039 1
1 174 . 14 1 1 A 14 14 PHE C C 103 173.560 173.282 0.278 1
1 175 . 14 1 1 A 14 14 PHE CA C 103 55.470 56.042 -0.572 1
1 176 . 14 1 1 A 14 14 PHE CB C 103 41.760 40.516 1.244 1
1 180 . 14 1 1 A 14 14 PHE N N 103 118.421 116.332 2.089 1
1 181 . 14 1 1 A 15 15 SER H H 104 8.826 8.451 0.375 1
1 182 . 14 1 1 A 15 15 SER HA H 104 4.602 4.778 -0.176 1
1 185 . 14 1 1 A 15 15 SER C C 104 173.851 173.462 0.389 1
1 186 . 14 1 1 A 15 15 SER CA C 104 58.610 57.763 0.847 1
1 187 . 14 1 1 A 15 15 SER CB C 104 62.690 62.628 0.062 1
1 188 . 14 1 1 A 15 15 SER N N 104 117.781 114.957 2.824 1
1 189 . 14 1 1 A 16 16 VAL H H 105 7.839 8.202 -0.363 1
1 190 . 14 1 1 A 16 16 VAL HA H 105 3.390 4.244 -0.854 1
1 198 . 14 1 1 A 16 16 VAL C C 105 174.987 174.938 0.049 1
1 199 . 14 1 1 A 16 16 VAL CA C 105 63.650 62.306 1.344 1
1 200 . 14 1 1 A 16 16 VAL CB C 105 31.410 30.161 1.249 1
1 203 . 14 1 1 A 16 16 VAL N N 105 129.036 126.130 2.906 1
1 204 . 14 1 1 A 17 17 CYS H H 106 8.536 8.086 0.450 1
1 205 . 14 1 1 A 17 17 CYS HA H 106 5.011 4.971 0.040 1
1 208 . 14 1 1 A 17 17 CYS CA C 106 55.260 56.480 -1.220 1
1 209 . 14 1 1 A 17 17 CYS CB C 106 28.210 29.029 -0.819 1
1 210 . 14 1 1 A 17 17 CYS N N 106 130.045 126.721 3.324 1
1 211 . 14 1 1 A 18 18 PRO HA H 107 3.991 4.407 -0.416 1
1 218 . 14 1 1 A 18 18 PRO C C 107 178.188 177.888 0.300 1
1 219 . 14 1 1 A 18 18 PRO CA C 107 65.940 64.486 1.454 1
1 220 . 14 1 1 A 18 18 PRO CB C 107 32.000 31.976 0.024 1
1 223 . 14 1 1 A 19 19 GLU H H 108 9.260 8.973 0.287 1
1 224 . 14 1 1 A 19 19 GLU HA H 108 4.119 4.071 0.048 1
1 229 . 14 1 1 A 19 19 GLU C C 108 178.721 179.218 -0.497 1
1 230 . 14 1 1 A 19 19 GLU CA C 108 59.300 59.685 -0.385 1
1 231 . 14 1 1 A 19 19 GLU CB C 108 28.920 28.852 0.068 1
1 233 . 14 1 1 A 19 19 GLU N N 108 118.270 116.048 2.222 1
1 234 . 14 1 1 A 20 20 ARG H H 109 7.672 7.605 0.067 1
1 235 . 14 1 1 A 20 20 ARG HA H 109 4.331 4.116 0.215 1
1 242 . 14 1 1 A 20 20 ARG C C 109 177.977 178.569 -0.592 1
1 243 . 14 1 1 A 20 20 ARG CA C 109 57.350 59.156 -1.806 1
1 244 . 14 1 1 A 20 20 ARG CB C 109 30.820 30.715 0.105 1
1 247 . 14 1 1 A 20 20 ARG N N 109 118.357 119.413 -1.056 1
1 248 . 14 1 1 A 21 21 LEU H H 110 7.601 7.594 0.007 1
1 249 . 14 1 1 A 21 21 LEU HA H 110 4.380 4.293 0.087 1
1 259 . 14 1 1 A 21 21 LEU C C 110 176.562 176.318 0.244 1
1 260 . 14 1 1 A 21 21 LEU CA C 110 56.096 55.496 0.600 1
1 261 . 14 1 1 A 21 21 LEU CB C 110 44.016 42.094 1.922 1
1 265 . 14 1 1 A 21 21 LEU N N 110 118.626 118.548 0.078 1
1 266 . 14 1 1 A 22 22 GLN H H 111 7.750 7.580 0.170 1
1 267 . 14 1 1 A 22 22 GLN HA H 111 3.870 3.873 -0.003 1
1 274 . 14 1 1 A 22 22 GLN C C 111 173.336 174.031 -0.695 1
1 275 . 14 1 1 A 22 22 GLN CA C 111 56.510 56.964 -0.454 1
1 276 . 14 1 1 A 22 22 GLN CB C 111 26.800 26.619 0.181 1
1 278 . 14 1 1 A 22 22 GLN N N 111 113.926 115.591 -1.665 1
1 280 . 14 1 1 A 23 23 CYS H H 112 7.407 7.861 -0.454 1
1 281 . 14 1 1 A 23 23 CYS HA H 112 4.469 4.854 -0.385 1
1 284 . 14 1 1 A 23 23 CYS CA C 112 52.650 56.505 -3.855 1
1 285 . 14 1 1 A 23 23 CYS CB C 112 29.750 29.460 0.290 1
1 286 . 14 1 1 A 23 23 CYS N N 112 112.681 117.439 -4.758 1
1 287 . 14 1 1 A 24 24 PRO HA H 113 4.408 4.532 -0.124 1
1 294 . 14 1 1 A 24 24 PRO C C 113 178.175 177.531 0.644 1
1 295 . 14 1 1 A 24 24 PRO CA C 113 62.040 62.378 -0.338 1
1 296 . 14 1 1 A 24 24 PRO CB C 113 31.920 32.668 -0.748 1
1 299 . 14 1 1 A 25 25 LEU H H 114 8.593 8.745 -0.152 1
1 300 . 14 1 1 A 25 25 LEU HA H 114 3.765 4.044 -0.279 1
1 310 . 14 1 1 A 25 25 LEU C C 114 179.950 178.619 1.331 1
1 311 . 14 1 1 A 25 25 LEU CA C 114 57.674 58.042 -0.368 1
1 312 . 14 1 1 A 25 25 LEU CB C 114 40.690 41.433 -0.743 1
1 316 . 14 1 1 A 25 25 LEU N N 114 123.729 124.192 -0.463 1
1 317 . 14 1 1 A 26 26 GLU H H 115 9.108 8.226 0.882 1
1 318 . 14 1 1 A 26 26 GLU HA H 115 3.876 4.005 -0.129 1
1 323 . 14 1 1 A 26 26 GLU C C 115 177.505 179.299 -1.794 1
1 324 . 14 1 1 A 26 26 GLU CA C 115 59.410 59.487 -0.077 1
1 325 . 14 1 1 A 26 26 GLU CB C 115 28.460 29.130 -0.670 1
1 327 . 14 1 1 A 26 26 GLU N N 115 116.817 118.193 -1.376 1
1 328 . 14 1 1 A 27 27 ALA H H 116 7.360 7.682 -0.322 1
1 329 . 14 1 1 A 27 27 ALA HA H 116 4.408 4.050 0.358 1
1 333 . 14 1 1 A 27 27 ALA C C 116 177.046 178.271 -1.225 1
1 334 . 14 1 1 A 27 27 ALA CA C 116 52.970 54.772 -1.802 1
1 335 . 14 1 1 A 27 27 ALA CB C 116 19.916 18.153 1.763 1
1 336 . 14 1 1 A 27 27 ALA N N 116 118.966 121.012 -2.046 1
1 337 . 14 1 1 A 28 28 ILE H H 117 7.168 7.209 -0.041 1
1 338 . 14 1 1 A 28 28 ILE HA H 117 4.432 4.821 -0.389 1
1 348 . 14 1 1 A 28 28 ILE C C 117 172.641 175.543 -2.902 1
1 349 . 14 1 1 A 28 28 ILE CA C 117 59.980 60.274 -0.294 1
1 350 . 14 1 1 A 28 28 ILE CB C 117 37.350 37.850 -0.500 1
1 354 . 14 1 1 A 28 28 ILE N N 117 108.913 109.012 -0.099 1
1 355 . 14 1 1 A 29 29 GLN H H 118 6.562 7.676 -1.114 1
1 356 . 14 1 1 A 29 29 GLN HA H 118 3.922 4.191 -0.269 1
1 363 . 14 1 1 A 29 29 GLN C C 118 175.049 175.648 -0.599 1
1 364 . 14 1 1 A 29 29 GLN CA C 118 54.596 56.088 -1.492 1
1 365 . 14 1 1 A 29 29 GLN CB C 118 29.570 29.016 0.554 1
1 367 . 14 1 1 A 29 29 GLN N N 118 116.455 123.289 -6.834 1
1 369 . 14 1 1 A 30 30 CYS H H 119 8.138 8.337 -0.199 1
1 370 . 14 1 1 A 30 30 CYS HA H 119 4.580 4.587 -0.007 1
1 373 . 14 1 1 A 30 30 CYS CA C 119 57.810 57.121 0.689 1
1 374 . 14 1 1 A 30 30 CYS CB C 119 30.200 28.871 1.329 1
1 375 . 14 1 1 A 30 30 CYS N N 119 134.136 125.610 8.526 1
1 376 . 14 1 1 A 31 31 PRO HA H 120 4.424 4.460 -0.036 1
1 383 . 14 1 1 A 31 31 PRO C C 120 177.431 178.369 -0.938 1
1 384 . 14 1 1 A 31 31 PRO CA C 120 64.060 64.394 -0.334 1
1 385 . 14 1 1 A 31 31 PRO CB C 120 32.776 32.016 0.760 1
1 388 . 14 1 1 A 32 32 ILE H H 121 11.318 7.639 3.679 1
1 389 . 14 1 1 A 32 32 ILE HA H 121 4.038 3.958 0.080 1
1 399 . 14 1 1 A 32 32 ILE C C 121 178.485 177.625 0.860 1
1 400 . 14 1 1 A 32 32 ILE CA C 121 64.060 64.234 -0.174 1
1 401 . 14 1 1 A 32 32 ILE CB C 121 39.340 38.352 0.988 1
1 405 . 14 1 1 A 32 32 ILE N N 121 124.500 116.773 7.727 1
1 406 . 14 1 1 A 33 33 THR H H 122 9.928 7.346 2.582 1
1 407 . 14 1 1 A 33 33 THR HA H 122 4.048 4.462 -0.414 1
1 412 . 14 1 1 A 33 33 THR C C 122 175.793 174.576 1.217 1
1 413 . 14 1 1 A 33 33 THR CA C 122 62.990 61.539 1.451 1
1 414 . 14 1 1 A 33 33 THR CB C 122 70.300 69.207 1.093 1
1 416 . 14 1 1 A 33 33 THR N N 122 115.136 108.917 6.219 1
1 417 . 14 1 1 A 34 34 LEU H H 123 8.439 7.745 0.694 1
1 418 . 14 1 1 A 34 34 LEU HA H 123 3.912 4.001 -0.089 1
1 428 . 14 1 1 A 34 34 LEU C C 123 175.495 175.552 -0.057 1
1 429 . 14 1 1 A 34 34 LEU CA C 123 56.290 55.973 0.317 1
1 430 . 14 1 1 A 34 34 LEU CB C 123 38.500 39.724 -1.224 1
1 434 . 14 1 1 A 34 34 LEU N N 123 117.230 121.196 -3.966 1
1 435 . 14 1 1 A 35 35 GLU H H 124 7.816 7.463 0.353 1
1 436 . 14 1 1 A 35 35 GLU HA H 124 4.634 4.582 0.052 1
1 441 . 14 1 1 A 35 35 GLU C C 124 174.838 174.098 0.740 1
1 442 . 14 1 1 A 35 35 GLU CA C 124 53.780 54.695 -0.915 1
1 443 . 14 1 1 A 35 35 GLU CB C 124 33.710 31.897 1.813 1
1 445 . 14 1 1 A 35 35 GLU N N 124 116.577 116.302 0.275 1
1 446 . 14 1 1 A 36 36 GLN H H 125 8.532 8.581 -0.049 1
1 447 . 14 1 1 A 36 36 GLN HA H 125 4.958 4.346 0.612 1
1 454 . 14 1 1 A 36 36 GLN CA C 125 53.350 53.903 -0.553 1
1 455 . 14 1 1 A 36 36 GLN CB C 125 29.950 29.923 0.027 1
1 457 . 14 1 1 A 36 36 GLN N N 125 123.034 121.482 1.552 1
1 459 . 14 1 1 A 37 37 PRO HA H 126 4.458 4.361 0.097 1
1 466 . 14 1 1 A 37 37 PRO C C 126 176.314 177.286 -0.972 1
1 467 . 14 1 1 A 37 37 PRO CA C 126 62.816 65.746 -2.930 1
1 468 . 14 1 1 A 37 37 PRO CB C 126 33.070 31.551 1.519 1
1 471 . 14 1 1 A 38 38 GLU H H 127 8.626 8.101 0.525 1
1 472 . 14 1 1 A 38 38 GLU HA H 127 4.274 4.492 -0.218 1
1 477 . 14 1 1 A 38 38 GLU C C 127 177.809 174.934 2.875 1
1 478 . 14 1 1 A 38 38 GLU CA C 127 58.730 58.295 0.435 1
1 479 . 14 1 1 A 38 38 GLU CB C 127 30.340 29.439 0.901 1
1 481 . 14 1 1 A 38 38 GLU N N 127 120.691 119.275 1.416 1
1 482 . 14 1 1 A 39 39 LYS H H 128 7.891 7.867 0.024 1
1 483 . 14 1 1 A 39 39 LYS HA H 128 4.870 4.756 0.114 1
1 492 . 14 1 1 A 39 39 LYS C C 128 175.452 175.983 -0.531 1
1 493 . 14 1 1 A 39 39 LYS CA C 128 53.540 54.689 -1.149 1
1 494 . 14 1 1 A 39 39 LYS CB C 128 33.630 34.879 -1.249 1
1 498 . 14 1 1 A 39 39 LYS N N 128 118.149 118.308 -0.159 1
1 499 . 14 1 1 A 40 40 GLY H H 129 8.524 8.071 0.453 1
1 500 . 14 1 1 A 40 40 GLY HA2 H 129 4.973 4.132 0.841 1
1 501 . 14 1 1 A 40 40 GLY HA3 H 129 2.459 4.254 -1.795 1
1 502 . 14 1 1 A 40 40 GLY C C 129 169.943 171.959 -2.016 1
1 503 . 14 1 1 A 40 40 GLY CA C 129 42.910 45.214 -2.304 1
1 504 . 14 1 1 A 40 40 GLY N N 129 112.845 110.590 2.255 1
1 505 . 14 1 1 A 41 41 ILE H H 130 8.659 8.157 0.502 1
1 506 . 14 1 1 A 41 41 ILE HA H 130 4.591 4.792 -0.201 1
1 516 . 14 1 1 A 41 41 ILE C C 130 172.586 173.979 -1.393 1
1 517 . 14 1 1 A 41 41 ILE CA C 130 58.090 58.915 -0.825 1
1 518 . 14 1 1 A 41 41 ILE CB C 130 43.320 42.192 1.128 1
1 522 . 14 1 1 A 41 41 ILE N N 130 114.060 119.187 -5.127 1
1 523 . 14 1 1 A 42 42 PHE H H 131 9.206 8.699 0.507 1
1 524 . 14 1 1 A 42 42 PHE HA H 131 5.159 4.713 0.446 1
1 532 . 14 1 1 A 42 42 PHE C C 131 174.931 175.812 -0.881 1
1 533 . 14 1 1 A 42 42 PHE CA C 131 57.790 57.985 -0.195 1
1 534 . 14 1 1 A 42 42 PHE CB C 131 42.220 38.971 3.249 1
1 538 . 14 1 1 A 42 42 PHE N N 131 126.002 128.204 -2.202 1
1 539 . 14 1 1 A 43 43 VAL H H 132 8.502 9.063 -0.561 1
1 540 . 14 1 1 A 43 43 VAL HA H 132 4.921 4.704 0.217 1
1 548 . 14 1 1 A 43 43 VAL C C 132 178.219 175.315 2.904 1
1 549 . 14 1 1 A 43 43 VAL CA C 132 59.600 60.143 -0.543 1
1 550 . 14 1 1 A 43 43 VAL CB C 132 35.920 35.485 0.435 1
1 553 . 14 1 1 A 43 43 VAL N N 132 119.068 123.232 -4.164 1
1 554 . 14 1 1 A 44 44 LYS H H 133 10.036 8.675 1.361 1
1 555 . 14 1 1 A 44 44 LYS HA H 133 5.070 4.414 0.656 1
1 564 . 14 1 1 A 44 44 LYS C C 133 177.276 177.459 -0.183 1
1 565 . 14 1 1 A 44 44 LYS CA C 133 56.720 56.980 -0.260 1
1 566 . 14 1 1 A 44 44 LYS CB C 133 34.410 32.727 1.683 1
1 570 . 14 1 1 A 44 44 LYS N N 133 130.934 126.213 4.721 1
1 571 . 14 1 1 A 45 45 ASN H H 134 8.093 9.026 -0.933 1
1 572 . 14 1 1 A 45 45 ASN HA H 134 4.152 4.790 -0.638 1
1 577 . 14 1 1 A 45 45 ASN C C 134 174.087 174.973 -0.886 1
1 578 . 14 1 1 A 45 45 ASN CA C 134 55.360 53.963 1.397 1
1 579 . 14 1 1 A 45 45 ASN CB C 134 37.530 39.518 -1.988 1
1 580 . 14 1 1 A 45 45 ASN N N 134 117.963 123.216 -5.253 1
1 582 . 14 1 1 A 46 46 SER H H 135 7.524 7.524 0.000 1
1 583 . 14 1 1 A 46 46 SER HA H 135 4.219 4.608 -0.389 1
1 586 . 14 1 1 A 46 46 SER C C 135 174.490 174.042 0.448 1
1 587 . 14 1 1 A 46 46 SER CA C 135 57.090 57.346 -0.256 1
1 588 . 14 1 1 A 46 46 SER CB C 135 63.860 65.344 -1.484 1
1 589 . 14 1 1 A 46 46 SER N N 135 105.939 110.138 -4.199 1
1 590 . 14 1 1 A 47 47 ASP H H 136 9.113 8.788 0.325 1
1 591 . 14 1 1 A 47 47 ASP HA H 136 4.220 4.277 -0.057 1
1 594 . 14 1 1 A 47 47 ASP CA C 136 57.610 57.124 0.486 1
1 595 . 14 1 1 A 47 47 ASP CB C 136 40.810 40.866 -0.056 1
1 596 . 14 1 1 A 47 47 ASP N N 136 120.995 123.229 -2.234 1
1 597 . 14 1 1 A 48 48 GLY H H 137 8.181 8.117 0.064 1
1 598 . 14 1 1 A 48 48 GLY HA2 H 137 4.120 3.978 0.142 1
1 599 . 14 1 1 A 48 48 GLY HA3 H 137 3.659 3.979 -0.320 1
1 600 . 14 1 1 A 48 48 GLY C C 137 174.062 174.105 -0.043 1
1 601 . 14 1 1 A 48 48 GLY CA C 137 45.130 46.188 -1.058 1
1 602 . 14 1 1 A 48 48 GLY N N 137 106.197 107.531 -1.334 1
1 603 . 14 1 1 A 49 49 SER H H 138 7.179 7.858 -0.679 1
1 604 . 14 1 1 A 49 49 SER HA H 138 4.383 4.819 -0.436 1
1 607 . 14 1 1 A 49 49 SER C C 138 173.864 173.728 0.136 1
1 608 . 14 1 1 A 49 49 SER CA C 138 57.614 57.638 -0.024 1
1 609 . 14 1 1 A 49 49 SER CB C 138 65.100 65.312 -0.212 1
1 610 . 14 1 1 A 49 49 SER N N 138 115.015 116.370 -1.355 1
1 611 . 14 1 1 A 50 50 ASP H H 139 8.078 8.613 -0.535 1
1 612 . 14 1 1 A 50 50 ASP HA H 139 4.642 4.844 -0.202 1
1 615 . 14 1 1 A 50 50 ASP C C 139 174.261 175.899 -1.638 1
1 616 . 14 1 1 A 50 50 ASP CA C 139 52.406 54.495 -2.089 1
1 617 . 14 1 1 A 50 50 ASP CB C 139 40.254 41.033 -0.779 1
1 618 . 14 1 1 A 50 50 ASP N N 139 122.400 122.815 -0.415 1
1 619 . 14 1 1 A 51 51 VAL H H 140 8.111 7.319 0.792 1
1 620 . 14 1 1 A 51 51 VAL HA H 140 4.360 4.218 0.142 1
1 628 . 14 1 1 A 51 51 VAL C C 140 176.147 174.532 1.615 1
1 629 . 14 1 1 A 51 51 VAL CA C 140 62.670 61.965 0.705 1
1 630 . 14 1 1 A 51 51 VAL CB C 140 33.930 32.157 1.773 1
1 632 . 14 1 1 A 51 51 VAL N N 140 120.374 120.061 0.313 1
1 633 . 14 1 1 A 52 52 CYS H H 141 8.358 8.757 -0.399 1
1 634 . 14 1 1 A 52 52 CYS HA H 141 4.957 5.229 -0.272 1
1 637 . 14 1 1 A 52 52 CYS C C 141 173.070 173.253 -0.183 1
1 638 . 14 1 1 A 52 52 CYS CA C 141 53.380 55.339 -1.959 1
1 639 . 14 1 1 A 52 52 CYS CB C 141 46.110 44.311 1.799 1
1 640 . 14 1 1 A 52 52 CYS N N 141 121.305 129.171 -7.866 1
1 641 . 14 1 1 A 53 53 THR H H 142 8.929 8.867 0.062 1
1 642 . 14 1 1 A 53 53 THR HA H 142 4.498 5.127 -0.629 1
1 648 . 14 1 1 A 53 53 THR C C 142 172.151 172.739 -0.588 1
1 649 . 14 1 1 A 53 53 THR CA C 142 62.960 61.489 1.471 1
1 650 . 14 1 1 A 53 53 THR CB C 142 70.540 70.665 -0.125 1
1 652 . 14 1 1 A 53 53 THR N N 142 120.105 120.282 -0.177 1
1 653 . 14 1 1 A 54 54 LEU H H 143 8.448 8.825 -0.377 1
1 654 . 14 1 1 A 54 54 LEU HA H 143 4.322 4.809 -0.487 1
1 664 . 14 1 1 A 54 54 LEU C C 143 174.484 174.737 -0.253 1
1 665 . 14 1 1 A 54 54 LEU CA C 143 54.596 53.491 1.105 1
1 666 . 14 1 1 A 54 54 LEU CB C 143 42.396 43.411 -1.015 1
1 670 . 14 1 1 A 54 54 LEU N N 143 128.819 129.561 -0.742 1
1 671 . 14 1 1 A 55 55 PHE H H 144 8.661 8.888 -0.227 1
1 672 . 14 1 1 A 55 55 PHE HA H 144 5.459 4.942 0.517 1
1 680 . 14 1 1 A 55 55 PHE C C 144 176.035 174.638 1.397 1
1 681 . 14 1 1 A 55 55 PHE CA C 144 55.020 56.931 -1.911 1
1 682 . 14 1 1 A 55 55 PHE CB C 144 44.100 42.480 1.620 1
1 686 . 14 1 1 A 55 55 PHE N N 144 121.897 126.519 -4.622 1
1 687 . 14 1 1 A 56 56 ASP H H 145 11.616 8.565 3.051 1
1 688 . 14 1 1 A 56 56 ASP HA H 145 4.417 4.767 -0.350 1
1 691 . 14 1 1 A 56 56 ASP C C 145 176.748 177.058 -0.310 1
1 692 . 14 1 1 A 56 56 ASP CA C 145 55.844 54.051 1.793 1
1 693 . 14 1 1 A 56 56 ASP CB C 145 44.390 42.994 1.396 1
1 694 . 14 1 1 A 56 56 ASP N N 145 122.131 121.425 0.706 1
1 695 . 14 1 1 A 57 57 ALA H H 146 8.508 9.082 -0.574 1
1 696 . 14 1 1 A 57 57 ALA HA H 146 3.797 4.081 -0.284 1
1 700 . 14 1 1 A 57 57 ALA C C 146 178.696 180.117 -1.421 1
1 701 . 14 1 1 A 57 57 ALA CA C 146 55.990 55.329 0.661 1
1 702 . 14 1 1 A 57 57 ALA CB C 146 18.840 18.102 0.738 1
1 703 . 14 1 1 A 57 57 ALA N N 146 130.243 128.542 1.701 1
1 704 . 14 1 1 A 58 58 ALA H H 147 8.378 7.634 0.744 1
1 705 . 14 1 1 A 58 58 ALA HA H 147 4.078 4.237 -0.159 1
1 709 . 14 1 1 A 58 58 ALA C C 147 181.091 179.374 1.717 1
1 710 . 14 1 1 A 58 58 ALA CA C 147 54.770 55.031 -0.261 1
1 711 . 14 1 1 A 58 58 ALA CB C 147 17.700 18.591 -0.891 1
1 712 . 14 1 1 A 58 58 ALA N N 147 121.997 119.806 2.191 1
1 713 . 14 1 1 A 59 59 ALA H H 148 9.138 8.062 1.076 1
1 714 . 14 1 1 A 59 59 ALA HA H 148 3.975 4.029 -0.054 1
1 718 . 14 1 1 A 59 59 ALA C C 148 180.508 179.680 0.828 1
1 719 . 14 1 1 A 59 59 ALA CA C 148 54.840 55.156 -0.316 1
1 720 . 14 1 1 A 59 59 ALA CB C 148 18.600 18.631 -0.031 1
1 721 . 14 1 1 A 59 59 ALA N N 148 123.595 120.474 3.121 1
1 722 . 14 1 1 A 60 60 PHE H H 149 8.814 8.115 0.699 1
1 723 . 14 1 1 A 60 60 PHE HA H 149 3.722 3.981 -0.259 1
1 731 . 14 1 1 A 60 60 PHE C C 149 176.773 177.667 -0.894 1
1 732 . 14 1 1 A 60 60 PHE CA C 149 62.030 61.494 0.536 1
1 733 . 14 1 1 A 60 60 PHE CB C 149 39.960 39.028 0.932 1
1 737 . 14 1 1 A 60 60 PHE N N 149 120.354 119.624 0.730 1
1 738 . 14 1 1 A 61 61 SER H H 150 8.276 8.021 0.255 1
1 739 . 14 1 1 A 61 61 SER HA H 150 3.880 4.070 -0.190 1
1 742 . 14 1 1 A 61 61 SER C C 150 177.691 176.524 1.167 1
1 743 . 14 1 1 A 61 61 SER CA C 150 62.190 61.415 0.775 1
1 744 . 14 1 1 A 61 61 SER CB C 150 63.016 62.880 0.136 1
1 745 . 14 1 1 A 61 61 SER N N 150 112.086 114.475 -2.389 1
1 746 . 14 1 1 A 62 62 ARG H H 151 7.829 7.915 -0.086 1
1 747 . 14 1 1 A 62 62 ARG HA H 151 3.971 4.030 -0.059 1
1 754 . 14 1 1 A 62 62 ARG C C 151 178.287 178.400 -0.113 1
1 755 . 14 1 1 A 62 62 ARG CA C 151 59.340 58.799 0.541 1
1 756 . 14 1 1 A 62 62 ARG CB C 151 29.760 29.640 0.120 1
1 759 . 14 1 1 A 62 62 ARG N N 151 121.090 119.171 1.919 1
1 760 . 14 1 1 A 63 63 LEU H H 152 7.390 7.433 -0.043 1
1 761 . 14 1 1 A 63 63 LEU HA H 152 3.791 3.928 -0.137 1
1 771 . 14 1 1 A 63 63 LEU C C 152 179.106 178.160 0.946 1
1 772 . 14 1 1 A 63 63 LEU CA C 152 58.900 58.166 0.734 1
1 773 . 14 1 1 A 63 63 LEU CB C 152 41.140 41.126 0.014 1
1 777 . 14 1 1 A 63 63 LEU N N 152 121.129 122.044 -0.915 1
1 778 . 14 1 1 A 64 64 VAL H H 153 7.552 7.912 -0.360 1
1 779 . 14 1 1 A 64 64 VAL HA H 153 3.411 3.470 -0.059 1
1 787 . 14 1 1 A 64 64 VAL C C 153 180.595 178.571 2.024 1
1 788 . 14 1 1 A 64 64 VAL CA C 153 65.644 66.052 -0.408 1
1 789 . 14 1 1 A 64 64 VAL CB C 153 31.410 31.303 0.107 1
1 792 . 14 1 1 A 64 64 VAL N N 153 118.280 118.888 -0.608 1
1 793 . 14 1 1 A 65 65 GLY H H 154 8.061 8.337 -0.276 1
1 794 . 14 1 1 A 65 65 GLY HA2 H 154 3.846 3.731 0.115 1
1 795 . 14 1 1 A 65 65 GLY HA3 H 154 3.809 3.733 0.076 1
1 796 . 14 1 1 A 65 65 GLY C C 154 175.235 176.431 -1.196 1
1 797 . 14 1 1 A 65 65 GLY CA C 154 46.630 46.930 -0.300 1
1 798 . 14 1 1 A 65 65 GLY N N 154 108.622 107.521 1.101 1
1 799 . 14 1 1 A 66 66 GLU H H 155 7.528 7.511 0.017 1
1 800 . 14 1 1 A 66 66 GLU HA H 155 4.228 4.209 0.019 1
1 805 . 14 1 1 A 66 66 GLU C C 155 176.761 177.331 -0.570 1
1 806 . 14 1 1 A 66 66 GLU CA C 155 56.590 56.908 -0.318 1
1 807 . 14 1 1 A 66 66 GLU CB C 155 30.490 29.994 0.496 1
1 809 . 14 1 1 A 66 66 GLU N N 155 118.361 119.551 -1.190 1
1 810 . 14 1 1 A 67 67 GLY H H 156 7.884 7.679 0.205 1
1 811 . 14 1 1 A 67 67 GLY HA2 H 156 3.918 3.885 0.033 1
1 812 . 14 1 1 A 67 67 GLY HA3 H 156 3.747 3.900 -0.153 1
1 813 . 14 1 1 A 67 67 GLY C C 156 174.788 174.477 0.311 1
1 814 . 14 1 1 A 67 67 GLY CA C 156 45.890 46.484 -0.594 1
1 815 . 14 1 1 A 67 67 GLY N N 156 108.465 107.934 0.531 1
1 816 . 14 1 1 A 68 68 LEU H H 157 7.332 7.439 -0.107 1
1 817 . 14 1 1 A 68 68 LEU HA H 157 4.361 4.689 -0.328 1
1 827 . 14 1 1 A 68 68 LEU CA C 157 53.060 51.772 1.288 1
1 828 . 14 1 1 A 68 68 LEU CB C 157 41.100 42.853 -1.753 1
1 832 . 14 1 1 A 68 68 LEU N N 157 121.920 120.962 0.958 1
1 833 . 14 1 1 A 69 69 PRO HA H 158 4.485 4.607 -0.122 1
1 840 . 14 1 1 A 69 69 PRO C C 158 174.602 176.432 -1.830 1
1 841 . 14 1 1 A 69 69 PRO CA C 158 61.556 62.339 -0.783 1
1 842 . 14 1 1 A 69 69 PRO CB C 158 32.370 32.561 -0.191 1
1 845 . 14 1 1 A 70 70 HIS H H 159 8.734 8.418 0.316 1
1 846 . 14 1 1 A 70 70 HIS HA H 159 3.947 4.491 -0.544 1
1 852 . 14 1 1 A 70 70 HIS CA C 159 56.250 55.252 0.998 1
1 853 . 14 1 1 A 70 70 HIS CB C 159 32.280 30.963 1.317 1
1 856 . 14 1 1 A 70 70 HIS N N 159 119.423 121.818 -2.395 1
1 857 . 14 1 1 A 71 71 PRO HA H 160 4.424 4.208 0.216 1
1 864 . 14 1 1 A 71 71 PRO C C 160 177.567 178.382 -0.815 1
1 865 . 14 1 1 A 71 71 PRO CA C 160 64.574 65.374 -0.800 1
1 866 . 14 1 1 A 71 71 PRO CB C 160 32.340 31.822 0.518 1
1 869 . 14 1 1 A 72 72 LEU H H 161 10.123 7.692 2.431 1
1 870 . 14 1 1 A 72 72 LEU HA H 161 4.778 4.328 0.450 1
1 880 . 14 1 1 A 72 72 LEU C C 161 178.721 178.133 0.588 1
1 881 . 14 1 1 A 72 72 LEU CA C 161 55.800 57.177 -1.377 1
1 882 . 14 1 1 A 72 72 LEU CB C 161 42.440 43.168 -0.728 1
1 886 . 14 1 1 A 72 72 LEU N N 161 117.374 117.314 0.060 1
1 887 . 14 1 1 A 73 73 THR H H 162 7.523 7.889 -0.366 1
1 888 . 14 1 1 A 73 73 THR HA H 162 4.291 4.528 -0.237 1
1 893 . 14 1 1 A 73 73 THR C C 162 175.557 174.405 1.152 1
1 894 . 14 1 1 A 73 73 THR CA C 162 61.440 62.663 -1.223 1
1 895 . 14 1 1 A 73 73 THR CB C 162 70.500 69.903 0.597 1
1 897 . 14 1 1 A 73 73 THR N N 162 107.787 112.457 -4.670 1
1 898 . 14 1 1 A 74 74 ARG H H 163 8.361 7.849 0.512 1
1 899 . 14 1 1 A 74 74 ARG HA H 163 3.836 4.188 -0.352 1
1 906 . 14 1 1 A 74 74 ARG C C 163 174.701 175.118 -0.417 1
1 907 . 14 1 1 A 74 74 ARG CA C 163 57.980 57.395 0.585 1
1 908 . 14 1 1 A 74 74 ARG CB C 163 26.770 26.983 -0.213 1
1 911 . 14 1 1 A 74 74 ARG N N 163 115.130 119.408 -4.278 1
1 912 . 14 1 1 A 75 75 GLU H H 164 7.430 8.064 -0.634 1
1 913 . 14 1 1 A 75 75 GLU HA H 164 4.636 4.491 0.145 1
1 918 . 14 1 1 A 75 75 GLU CA C 164 53.699 54.953 -1.254 1
1 919 . 14 1 1 A 75 75 GLU CB C 164 29.550 28.442 1.108 1
1 921 . 14 1 1 A 75 75 GLU N N 164 120.076 118.989 1.087 1
1 922 . 14 1 1 A 76 76 PRO HA H 165 4.272 4.449 -0.177 1
1 929 . 14 1 1 A 76 76 PRO C C 165 176.649 176.931 -0.282 1
1 930 . 14 1 1 A 76 76 PRO CA C 165 63.204 63.177 0.027 1
1 931 . 14 1 1 A 76 76 PRO CB C 165 31.680 31.553 0.127 1
1 934 . 14 1 1 A 77 77 ILE H H 166 8.812 8.171 0.641 1
1 935 . 14 1 1 A 77 77 ILE HA H 166 3.838 4.292 -0.454 1
1 945 . 14 1 1 A 77 77 ILE C C 166 175.235 175.780 -0.545 1
1 946 . 14 1 1 A 77 77 ILE CA C 166 62.816 61.179 1.637 1
1 947 . 14 1 1 A 77 77 ILE CB C 166 37.750 36.976 0.774 1
1 951 . 14 1 1 A 77 77 ILE N N 166 123.831 124.263 -0.432 1
1 952 . 14 1 1 A 78 78 THR H H 167 6.625 8.583 -1.958 1
1 953 . 14 1 1 A 78 78 THR HA H 167 4.632 5.108 -0.476 1
1 958 . 14 1 1 A 78 78 THR C C 167 174.143 175.051 -0.908 1
1 959 . 14 1 1 A 78 78 THR CA C 167 58.750 59.937 -1.187 1
1 960 . 14 1 1 A 78 78 THR CB C 167 71.320 71.265 0.055 1
1 962 . 14 1 1 A 78 78 THR N N 167 115.293 119.952 -4.659 1
1 963 . 14 1 1 A 79 79 ALA H H 168 9.088 9.160 -0.072 1
1 964 . 14 1 1 A 79 79 ALA HA H 168 3.916 4.037 -0.121 1
1 968 . 14 1 1 A 79 79 ALA C C 168 179.770 179.448 0.322 1
1 969 . 14 1 1 A 79 79 ALA CA C 168 55.480 55.176 0.304 1
1 970 . 14 1 1 A 79 79 ALA CB C 168 17.630 18.462 -0.832 1
1 971 . 14 1 1 A 79 79 ALA N N 168 122.102 128.779 -6.677 1
1 972 . 14 1 1 A 80 80 SER H H 169 7.988 7.715 0.273 1
1 973 . 14 1 1 A 80 80 SER HA H 169 4.091 4.189 -0.098 1
1 976 . 14 1 1 A 80 80 SER C C 169 175.836 176.641 -0.805 1
1 977 . 14 1 1 A 80 80 SER CA C 169 60.750 61.542 -0.792 1
1 978 . 14 1 1 A 80 80 SER CB C 169 62.510 63.004 -0.494 1
1 979 . 14 1 1 A 80 80 SER N N 169 109.660 113.424 -3.764 1
1 980 . 14 1 1 A 81 81 ILE H H 170 7.052 7.697 -0.645 1
1 981 . 14 1 1 A 81 81 ILE HA H 170 4.344 4.117 0.227 1
1 991 . 14 1 1 A 81 81 ILE C C 170 174.236 176.427 -2.191 1
1 992 . 14 1 1 A 81 81 ILE CA C 170 61.760 63.491 -1.731 1
1 993 . 14 1 1 A 81 81 ILE CB C 170 37.950 37.739 0.211 1
1 997 . 14 1 1 A 81 81 ILE N N 170 112.623 114.263 -1.640 1
1 998 . 14 1 1 A 82 82 ILE H H 171 7.345 7.100 0.245 1
1 999 . 14 1 1 A 82 82 ILE HA H 171 4.288 4.050 0.238 1
1 1009 . 14 1 1 A 82 82 ILE C C 171 174.931 175.353 -0.422 1
1 1010 . 14 1 1 A 82 82 ILE CA C 171 61.420 61.946 -0.526 1
1 1011 . 14 1 1 A 82 82 ILE CB C 171 37.230 37.788 -0.558 1
1 1015 . 14 1 1 A 82 82 ILE N N 171 124.260 124.891 -0.631 1
1 1016 . 14 1 1 A 83 83 VAL H H 172 7.843 8.717 -0.874 1
1 1017 . 14 1 1 A 83 83 VAL HA H 172 4.818 5.089 -0.271 1
1 1025 . 14 1 1 A 83 83 VAL C C 172 174.918 175.760 -0.842 1
1 1026 . 14 1 1 A 83 83 VAL CA C 172 58.910 59.059 -0.149 1
1 1027 . 14 1 1 A 83 83 VAL CB C 172 34.570 34.915 -0.345 1
1 1030 . 14 1 1 A 83 83 VAL N N 172 118.856 122.438 -3.582 1
1 1031 . 14 1 1 A 84 84 LYS H H 173 8.347 8.784 -0.437 1
1 1032 . 14 1 1 A 84 84 LYS HA H 173 4.356 4.394 -0.038 1
1 1041 . 14 1 1 A 84 84 LYS C C 173 178.653 178.133 0.520 1
1 1042 . 14 1 1 A 84 84 LYS CA C 173 56.360 55.206 1.154 1
1 1043 . 14 1 1 A 84 84 LYS CB C 173 33.366 33.584 -0.218 1
1 1047 . 14 1 1 A 84 84 LYS N N 173 119.602 122.178 -2.576 1
1 1048 . 14 1 1 A 85 85 HIS H H 174 9.143 8.442 0.701 1
1 1049 . 14 1 1 A 85 85 HIS HA H 174 4.013 4.435 -0.422 1
1 1053 . 14 1 1 A 85 85 HIS C C 174 176.606 177.745 -1.139 1
1 1054 . 14 1 1 A 85 85 HIS CA C 174 58.820 59.914 -1.094 1
1 1055 . 14 1 1 A 85 85 HIS CB C 174 28.186 29.959 -1.773 1
1 1057 . 14 1 1 A 85 85 HIS N N 174 120.022 121.326 -1.304 1
1 1058 . 14 1 1 A 86 86 GLU H H 175 8.403 8.429 -0.026 1
1 1059 . 14 1 1 A 86 86 GLU HA H 175 3.863 3.851 0.012 1
1 1064 . 14 1 1 A 86 86 GLU C C 175 177.040 178.645 -1.605 1
1 1065 . 14 1 1 A 86 86 GLU CA C 175 57.830 59.492 -1.662 1
1 1066 . 14 1 1 A 86 86 GLU CB C 175 28.690 29.300 -0.610 1
1 1068 . 14 1 1 A 86 86 GLU N N 175 116.124 119.771 -3.647 1
1 1069 . 14 1 1 A 87 87 GLU H H 176 7.669 8.018 -0.349 1
1 1070 . 14 1 1 A 87 87 GLU HA H 176 4.039 4.460 -0.421 1
1 1075 . 14 1 1 A 87 87 GLU C C 176 175.688 177.431 -1.743 1
1 1076 . 14 1 1 A 87 87 GLU CA C 176 57.906 58.948 -1.042 1
1 1077 . 14 1 1 A 87 87 GLU CB C 176 30.430 28.853 1.577 1
1 1079 . 14 1 1 A 87 87 GLU N N 176 116.183 118.108 -1.925 1
1 1080 . 14 1 1 A 88 88 CYS H H 177 6.750 7.694 -0.944 1
1 1081 . 14 1 1 A 88 88 CYS HA H 177 4.991 4.872 0.119 1
1 1084 . 14 1 1 A 88 88 CYS C C 177 172.325 173.535 -1.210 1
1 1085 . 14 1 1 A 88 88 CYS CA C 177 55.030 54.209 0.821 1
1 1086 . 14 1 1 A 88 88 CYS CB C 177 45.610 42.079 3.531 1
1 1087 . 14 1 1 A 88 88 CYS N N 177 114.838 117.148 -2.310 1
1 1088 . 14 1 1 A 89 89 ILE H H 178 9.128 8.947 0.181 1
1 1089 . 14 1 1 A 89 89 ILE HA H 178 4.536 4.975 -0.439 1
1 1099 . 14 1 1 A 89 89 ILE C C 178 174.893 174.410 0.483 1
1 1100 . 14 1 1 A 89 89 ILE CA C 178 59.160 59.642 -0.482 1
1 1101 . 14 1 1 A 89 89 ILE CB C 178 41.840 40.572 1.268 1
1 1105 . 14 1 1 A 89 89 ILE N N 178 120.564 122.075 -1.511 1
1 1106 . 14 1 1 A 90 90 TYR H H 179 9.349 9.143 0.206 1
1 1107 . 14 1 1 A 90 90 TYR HA H 179 3.568 4.352 -0.784 1
1 1112 . 14 1 1 A 90 90 TYR C C 179 173.950 174.070 -0.120 1
1 1113 . 14 1 1 A 90 90 TYR CA C 179 61.180 57.412 3.768 1
1 1114 . 14 1 1 A 90 90 TYR CB C 179 37.530 38.266 -0.736 1
1 1116 . 14 1 1 A 90 90 TYR N N 179 129.033 127.362 1.671 1
1 1117 . 14 1 1 A 91 91 ASP H H 180 7.367 8.174 -0.807 1
1 1118 . 14 1 1 A 91 91 ASP HA H 180 4.662 4.665 -0.003 1
1 1121 . 14 1 1 A 91 91 ASP C C 180 175.291 175.557 -0.266 1
1 1122 . 14 1 1 A 91 91 ASP CA C 180 52.230 53.215 -0.985 1
1 1123 . 14 1 1 A 91 91 ASP CB C 180 43.650 42.050 1.600 1
1 1124 . 14 1 1 A 91 91 ASP N N 180 129.305 128.899 0.406 1
1 1125 . 14 1 1 A 92 92 ASP H H 181 8.783 9.027 -0.244 1
1 1126 . 14 1 1 A 92 92 ASP HA H 181 4.114 3.994 0.120 1
1 1129 . 14 1 1 A 92 92 ASP C C 181 177.573 177.676 -0.103 1
1 1130 . 14 1 1 A 92 92 ASP CA C 181 56.390 57.694 -1.304 1
1 1131 . 14 1 1 A 92 92 ASP CB C 181 41.330 40.786 0.544 1
1 1132 . 14 1 1 A 92 92 ASP N N 181 125.665 128.120 -2.455 1
1 1133 . 14 1 1 A 93 93 THR H H 182 8.284 7.565 0.719 1
1 1134 . 14 1 1 A 93 93 THR HA H 182 4.037 4.010 0.027 1
1 1139 . 14 1 1 A 93 93 THR C C 182 176.333 176.425 -0.092 1
1 1140 . 14 1 1 A 93 93 THR CA C 182 65.320 66.399 -1.079 1
1 1141 . 14 1 1 A 93 93 THR CB C 182 68.560 68.448 0.112 1
1 1143 . 14 1 1 A 93 93 THR N N 182 114.688 115.478 -0.790 1
1 1144 . 14 1 1 A 94 94 ARG H H 183 7.784 7.509 0.275 1
1 1145 . 14 1 1 A 94 94 ARG HA H 183 4.142 4.238 -0.096 1
1 1152 . 14 1 1 A 94 94 ARG C C 183 177.015 176.941 0.074 1
1 1153 . 14 1 1 A 94 94 ARG CA C 183 55.350 55.929 -0.579 1
1 1154 . 14 1 1 A 94 94 ARG CB C 183 30.930 30.951 -0.021 1
1 1157 . 14 1 1 A 94 94 ARG N N 183 120.156 118.460 1.696 1
1 1158 . 14 1 1 A 95 95 GLY H H 184 8.144 8.817 -0.673 1
1 1159 . 14 1 1 A 95 95 GLY HA2 H 184 3.839 3.752 0.087 1
1 1160 . 14 1 1 A 95 95 GLY HA3 H 184 3.681 3.875 -0.194 1
1 1161 . 14 1 1 A 95 95 GLY C C 184 173.653 173.189 0.464 1
1 1162 . 14 1 1 A 95 95 GLY CA C 184 46.160 45.949 0.211 1
1 1163 . 14 1 1 A 95 95 GLY N N 184 107.879 109.367 -1.488 1
1 1164 . 14 1 1 A 96 96 ASN H H 185 6.855 6.999 -0.144 1
1 1165 . 14 1 1 A 96 96 ASN HA H 185 4.909 4.988 -0.079 1
1 1170 . 14 1 1 A 96 96 ASN C C 185 174.223 173.152 1.071 1
1 1171 . 14 1 1 A 96 96 ASN CA C 185 52.720 52.237 0.483 1
1 1172 . 14 1 1 A 96 96 ASN CB C 185 45.620 41.724 3.896 1
1 1173 . 14 1 1 A 96 96 ASN N N 185 113.382 116.252 -2.870 1
1 1175 . 14 1 1 A 97 97 PHE H H 186 9.228 8.499 0.729 1
1 1176 . 14 1 1 A 97 97 PHE HA H 186 4.579 4.836 -0.257 1
1 1183 . 14 1 1 A 97 97 PHE C C 186 174.794 175.488 -0.694 1
1 1184 . 14 1 1 A 97 97 PHE CA C 186 59.384 59.085 0.299 1
1 1185 . 14 1 1 A 97 97 PHE CB C 186 40.450 39.137 1.313 1
1 1188 . 14 1 1 A 97 97 PHE N N 186 118.661 119.451 -0.790 1
1 1189 . 14 1 1 A 98 98 ILE H H 187 8.908 9.098 -0.190 1
1 1190 . 14 1 1 A 98 98 ILE HA H 187 5.440 4.770 0.670 1
1 1200 . 14 1 1 A 98 98 ILE C C 187 176.171 175.176 0.995 1
1 1201 . 14 1 1 A 98 98 ILE CA C 187 57.610 60.147 -2.537 1
1 1202 . 14 1 1 A 98 98 ILE CB C 187 41.280 40.187 1.093 1
1 1206 . 14 1 1 A 98 98 ILE N N 187 120.585 123.386 -2.801 1
1 1207 . 14 1 1 A 99 99 ILE H H 188 8.602 8.284 0.318 1
1 1208 . 14 1 1 A 99 99 ILE HA H 188 4.546 4.770 -0.224 1
1 1218 . 14 1 1 A 99 99 ILE C C 188 176.668 175.161 1.507 1
1 1219 . 14 1 1 A 99 99 ILE CA C 188 58.920 60.270 -1.350 1
1 1220 . 14 1 1 A 99 99 ILE CB C 188 37.960 39.061 -1.101 1
1 1224 . 14 1 1 A 99 99 ILE N N 188 124.500 125.730 -1.230 1
1 1225 . 14 1 1 A 100 100 LYS H H 189 8.449 8.402 0.047 1
1 1226 . 14 1 1 A 100 100 LYS HA H 189 4.108 4.840 -0.732 1
1 1235 . 14 1 1 A 100 100 LYS C C 189 176.866 175.538 1.328 1
1 1236 . 14 1 1 A 100 100 LYS CA C 189 56.800 55.340 1.460 1
1 1237 . 14 1 1 A 100 100 LYS CB C 189 33.400 34.822 -1.422 1
1 1241 . 14 1 1 A 100 100 LYS N N 189 128.581 127.632 0.949 1
1 1242 . 14 1 1 A 101 101 GLY H H 190 8.381 8.411 -0.030 1
1 1243 . 14 1 1 A 101 101 GLY HA2 H 190 3.946 4.036 -0.090 1
1 1244 . 14 1 1 A 101 101 GLY HA3 H 190 3.828 4.038 -0.210 1
1 1245 . 14 1 1 A 101 101 GLY C C 190 172.902 173.128 -0.226 1
1 1246 . 14 1 1 A 101 101 GLY CA C 190 44.920 46.006 -1.086 1
1 1247 . 14 1 1 A 101 101 GLY N N 190 111.183 113.678 -2.495 1
1 7 . 15 1 1 A 2 2 GLN H H 91 8.786 8.441 0.345 1
1 8 . 15 1 1 A 2 2 GLN HA H 91 4.005 4.062 -0.057 1
1 15 . 15 1 1 A 2 2 GLN C C 91 177.270 178.120 -0.850 1
1 16 . 15 1 1 A 2 2 GLN CA C 91 58.220 59.169 -0.949 1
1 17 . 15 1 1 A 2 2 GLN CB C 91 28.650 28.368 0.282 1
1 19 . 15 1 1 A 2 2 GLN N N 91 121.993 125.032 -3.039 1
1 21 . 15 1 1 A 3 3 GLU H H 92 8.430 8.291 0.139 1
1 22 . 15 1 1 A 3 3 GLU HA H 92 4.007 4.073 -0.066 1
1 27 . 15 1 1 A 3 3 GLU C C 92 178.287 178.680 -0.393 1
1 28 . 15 1 1 A 3 3 GLU CA C 92 59.490 59.521 -0.031 1
1 29 . 15 1 1 A 3 3 GLU CB C 92 29.506 29.210 0.296 1
1 31 . 15 1 1 A 3 3 GLU N N 92 120.195 120.157 0.038 1
1 32 . 15 1 1 A 4 4 SER H H 93 8.209 7.792 0.417 1
1 33 . 15 1 1 A 4 4 SER HA H 93 4.272 4.285 -0.013 1
1 36 . 15 1 1 A 4 4 SER C C 93 177.369 177.489 -0.120 1
1 37 . 15 1 1 A 4 4 SER CA C 93 61.044 61.310 -0.266 1
1 38 . 15 1 1 A 4 4 SER CB C 93 62.950 62.832 0.118 1
1 39 . 15 1 1 A 4 4 SER N N 93 115.524 114.304 1.220 1
1 40 . 15 1 1 A 5 5 ILE H H 94 8.080 7.925 0.155 1
1 41 . 15 1 1 A 5 5 ILE HA H 94 3.530 3.603 -0.073 1
1 51 . 15 1 1 A 5 5 ILE C C 94 177.778 177.714 0.064 1
1 52 . 15 1 1 A 5 5 ILE CA C 94 65.710 65.225 0.485 1
1 53 . 15 1 1 A 5 5 ILE CB C 94 37.800 37.444 0.356 1
1 57 . 15 1 1 A 5 5 ILE N N 94 124.148 121.969 2.179 1
1 58 . 15 1 1 A 6 6 GLN H H 95 8.374 8.336 0.038 1
1 59 . 15 1 1 A 6 6 GLN HA H 95 4.125 4.048 0.077 1
1 66 . 15 1 1 A 6 6 GLN C C 95 179.726 179.102 0.624 1
1 67 . 15 1 1 A 6 6 GLN CA C 95 59.190 59.038 0.152 1
1 68 . 15 1 1 A 6 6 GLN CB C 95 27.060 28.177 -1.117 1
1 70 . 15 1 1 A 6 6 GLN N N 95 118.257 118.633 -0.376 1
1 72 . 15 1 1 A 7 7 ASN H H 96 8.456 8.072 0.384 1
1 73 . 15 1 1 A 7 7 ASN HA H 96 4.446 4.539 -0.093 1
1 78 . 15 1 1 A 7 7 ASN C C 96 177.257 178.399 -1.142 1
1 79 . 15 1 1 A 7 7 ASN CA C 96 56.020 56.167 -0.147 1
1 80 . 15 1 1 A 7 7 ASN CB C 96 38.126 37.739 0.387 1
1 81 . 15 1 1 A 7 7 ASN N N 96 118.597 118.334 0.263 1
1 83 . 15 1 1 A 8 8 LYS H H 97 7.732 7.801 -0.069 1
1 84 . 15 1 1 A 8 8 LYS HA H 97 4.129 4.093 0.036 1
1 93 . 15 1 1 A 8 8 LYS C C 97 179.143 179.466 -0.323 1
1 94 . 15 1 1 A 8 8 LYS CA C 97 59.126 59.602 -0.476 1
1 95 . 15 1 1 A 8 8 LYS CB C 97 32.070 32.174 -0.104 1
1 99 . 15 1 1 A 8 8 LYS N N 97 122.381 119.613 2.768 1
1 100 . 15 1 1 A 9 9 ILE H H 98 8.452 8.046 0.406 1
1 101 . 15 1 1 A 9 9 ILE HA H 98 3.480 3.953 -0.473 1
1 111 . 15 1 1 A 9 9 ILE C C 98 177.406 178.203 -0.797 1
1 112 . 15 1 1 A 9 9 ILE CA C 98 66.430 64.186 2.244 1
1 113 . 15 1 1 A 9 9 ILE CB C 98 37.980 37.282 0.698 1
1 117 . 15 1 1 A 9 9 ILE N N 98 119.950 120.404 -0.454 1
1 118 . 15 1 1 A 10 10 SER H H 99 7.924 7.727 0.197 1
1 119 . 15 1 1 A 10 10 SER HA H 99 3.983 4.298 -0.315 1
1 122 . 15 1 1 A 10 10 SER C C 99 176.327 176.309 0.018 1
1 123 . 15 1 1 A 10 10 SER CA C 99 61.990 61.270 0.720 1
1 124 . 15 1 1 A 10 10 SER CB C 99 62.790 63.107 -0.317 1
1 125 . 15 1 1 A 10 10 SER N N 99 113.568 117.848 -4.280 1
1 126 . 15 1 1 A 11 11 GLN H H 100 7.832 7.844 -0.012 1
1 127 . 15 1 1 A 11 11 GLN HA H 100 4.238 4.435 -0.197 1
1 134 . 15 1 1 A 11 11 GLN C C 100 178.088 178.491 -0.403 1
1 135 . 15 1 1 A 11 11 GLN CA C 100 57.900 57.044 0.856 1
1 136 . 15 1 1 A 11 11 GLN CB C 100 29.790 29.855 -0.065 1
1 138 . 15 1 1 A 11 11 GLN N N 100 117.487 117.899 -0.412 1
1 140 . 15 1 1 A 12 12 CYS H H 101 7.920 8.081 -0.161 1
1 141 . 15 1 1 A 12 12 CYS HA H 101 4.657 4.459 0.198 1
1 144 . 15 1 1 A 12 12 CYS C C 101 175.439 174.533 0.906 1
1 145 . 15 1 1 A 12 12 CYS CA C 101 60.654 61.259 -0.605 1
1 146 . 15 1 1 A 12 12 CYS CB C 101 29.310 28.108 1.202 1
1 147 . 15 1 1 A 12 12 CYS N N 101 114.221 119.098 -4.877 1
1 148 . 15 1 1 A 13 13 LYS H H 102 7.993 7.495 0.498 1
1 149 . 15 1 1 A 13 13 LYS HA H 102 5.038 4.431 0.607 1
1 158 . 15 1 1 A 13 13 LYS C C 102 174.757 176.208 -1.451 1
1 159 . 15 1 1 A 13 13 LYS CA C 102 56.660 56.073 0.587 1
1 160 . 15 1 1 A 13 13 LYS CB C 102 32.970 33.385 -0.415 1
1 164 . 15 1 1 A 13 13 LYS N N 102 123.841 118.408 5.433 1
1 165 . 15 1 1 A 14 14 PHE H H 103 8.822 8.645 0.177 1
1 166 . 15 1 1 A 14 14 PHE HA H 103 5.058 5.034 0.024 1
1 174 . 15 1 1 A 14 14 PHE C C 103 173.560 173.476 0.084 1
1 175 . 15 1 1 A 14 14 PHE CA C 103 55.470 55.965 -0.495 1
1 176 . 15 1 1 A 14 14 PHE CB C 103 41.760 40.823 0.937 1
1 180 . 15 1 1 A 14 14 PHE N N 103 118.421 116.437 1.984 1
1 181 . 15 1 1 A 15 15 SER H H 104 8.826 8.573 0.253 1
1 182 . 15 1 1 A 15 15 SER HA H 104 4.602 4.653 -0.051 1
1 185 . 15 1 1 A 15 15 SER C C 104 173.851 173.573 0.278 1
1 186 . 15 1 1 A 15 15 SER CA C 104 58.610 58.174 0.436 1
1 187 . 15 1 1 A 15 15 SER CB C 104 62.690 62.875 -0.185 1
1 188 . 15 1 1 A 15 15 SER N N 104 117.781 114.794 2.987 1
1 189 . 15 1 1 A 16 16 VAL H H 105 7.839 8.487 -0.648 1
1 190 . 15 1 1 A 16 16 VAL HA H 105 3.390 4.395 -1.005 1
1 198 . 15 1 1 A 16 16 VAL C C 105 174.987 174.645 0.342 1
1 199 . 15 1 1 A 16 16 VAL CA C 105 63.650 62.198 1.452 1
1 200 . 15 1 1 A 16 16 VAL CB C 105 31.410 30.690 0.720 1
1 203 . 15 1 1 A 16 16 VAL N N 105 129.036 125.772 3.264 1
1 204 . 15 1 1 A 17 17 CYS H H 106 8.536 8.632 -0.096 1
1 205 . 15 1 1 A 17 17 CYS HA H 106 5.011 5.054 -0.043 1
1 208 . 15 1 1 A 17 17 CYS CA C 106 55.260 55.776 -0.516 1
1 209 . 15 1 1 A 17 17 CYS CB C 106 28.210 30.426 -2.216 1
1 210 . 15 1 1 A 17 17 CYS N N 106 130.045 126.279 3.766 1
1 211 . 15 1 1 A 18 18 PRO HA H 107 3.991 4.540 -0.549 1
1 218 . 15 1 1 A 18 18 PRO C C 107 178.188 177.926 0.262 1
1 219 . 15 1 1 A 18 18 PRO CA C 107 65.940 64.502 1.438 1
1 220 . 15 1 1 A 18 18 PRO CB C 107 32.000 31.923 0.077 1
1 223 . 15 1 1 A 19 19 GLU H H 108 9.260 8.556 0.704 1
1 224 . 15 1 1 A 19 19 GLU HA H 108 4.119 4.112 0.007 1
1 229 . 15 1 1 A 19 19 GLU C C 108 178.721 179.259 -0.538 1
1 230 . 15 1 1 A 19 19 GLU CA C 108 59.300 59.715 -0.415 1
1 231 . 15 1 1 A 19 19 GLU CB C 108 28.920 29.329 -0.409 1
1 233 . 15 1 1 A 19 19 GLU N N 108 118.270 117.522 0.748 1
1 234 . 15 1 1 A 20 20 ARG H H 109 7.672 7.974 -0.302 1
1 235 . 15 1 1 A 20 20 ARG HA H 109 4.331 4.152 0.179 1
1 242 . 15 1 1 A 20 20 ARG C C 109 177.977 178.363 -0.386 1
1 243 . 15 1 1 A 20 20 ARG CA C 109 57.350 59.216 -1.866 1
1 244 . 15 1 1 A 20 20 ARG CB C 109 30.820 30.342 0.478 1
1 247 . 15 1 1 A 20 20 ARG N N 109 118.357 119.818 -1.461 1
1 248 . 15 1 1 A 21 21 LEU H H 110 7.601 7.840 -0.239 1
1 249 . 15 1 1 A 21 21 LEU HA H 110 4.380 4.352 0.028 1
1 259 . 15 1 1 A 21 21 LEU C C 110 176.562 176.353 0.209 1
1 260 . 15 1 1 A 21 21 LEU CA C 110 56.096 55.421 0.675 1
1 261 . 15 1 1 A 21 21 LEU CB C 110 44.016 42.196 1.820 1
1 265 . 15 1 1 A 21 21 LEU N N 110 118.626 118.358 0.268 1
1 266 . 15 1 1 A 22 22 GLN H H 111 7.750 7.929 -0.179 1
1 267 . 15 1 1 A 22 22 GLN HA H 111 3.870 4.088 -0.218 1
1 274 . 15 1 1 A 22 22 GLN C C 111 173.336 174.360 -1.024 1
1 275 . 15 1 1 A 22 22 GLN CA C 111 56.510 57.306 -0.796 1
1 276 . 15 1 1 A 22 22 GLN CB C 111 26.800 26.615 0.185 1
1 278 . 15 1 1 A 22 22 GLN N N 111 113.926 115.851 -1.925 1
1 280 . 15 1 1 A 23 23 CYS H H 112 7.407 7.842 -0.435 1
1 281 . 15 1 1 A 23 23 CYS HA H 112 4.469 5.003 -0.534 1
1 284 . 15 1 1 A 23 23 CYS CA C 112 52.650 56.794 -4.144 1
1 285 . 15 1 1 A 23 23 CYS CB C 112 29.750 28.364 1.386 1
1 286 . 15 1 1 A 23 23 CYS N N 112 112.681 117.686 -5.005 1
1 287 . 15 1 1 A 24 24 PRO HA H 113 4.408 4.500 -0.092 1
1 294 . 15 1 1 A 24 24 PRO C C 113 178.175 177.597 0.578 1
1 295 . 15 1 1 A 24 24 PRO CA C 113 62.040 62.606 -0.566 1
1 296 . 15 1 1 A 24 24 PRO CB C 113 31.920 32.576 -0.656 1
1 299 . 15 1 1 A 25 25 LEU H H 114 8.593 8.865 -0.272 1
1 300 . 15 1 1 A 25 25 LEU HA H 114 3.765 4.047 -0.282 1
1 310 . 15 1 1 A 25 25 LEU C C 114 179.950 178.646 1.304 1
1 311 . 15 1 1 A 25 25 LEU CA C 114 57.674 58.037 -0.363 1
1 312 . 15 1 1 A 25 25 LEU CB C 114 40.690 41.372 -0.682 1
1 316 . 15 1 1 A 25 25 LEU N N 114 123.729 124.167 -0.438 1
1 317 . 15 1 1 A 26 26 GLU H H 115 9.108 8.193 0.915 1
1 318 . 15 1 1 A 26 26 GLU HA H 115 3.876 3.995 -0.119 1
1 323 . 15 1 1 A 26 26 GLU C C 115 177.505 178.977 -1.472 1
1 324 . 15 1 1 A 26 26 GLU CA C 115 59.410 59.551 -0.141 1
1 325 . 15 1 1 A 26 26 GLU CB C 115 28.460 29.155 -0.695 1
1 327 . 15 1 1 A 26 26 GLU N N 115 116.817 118.130 -1.313 1
1 328 . 15 1 1 A 27 27 ALA H H 116 7.360 7.567 -0.207 1
1 329 . 15 1 1 A 27 27 ALA HA H 116 4.408 3.743 0.665 1
1 333 . 15 1 1 A 27 27 ALA C C 116 177.046 177.720 -0.674 1
1 334 . 15 1 1 A 27 27 ALA CA C 116 52.970 54.012 -1.042 1
1 335 . 15 1 1 A 27 27 ALA CB C 116 19.916 17.496 2.420 1
1 336 . 15 1 1 A 27 27 ALA N N 116 118.966 120.923 -1.957 1
1 337 . 15 1 1 A 28 28 ILE H H 117 7.168 7.040 0.128 1
1 338 . 15 1 1 A 28 28 ILE HA H 117 4.432 4.824 -0.392 1
1 348 . 15 1 1 A 28 28 ILE C C 117 172.641 175.518 -2.877 1
1 349 . 15 1 1 A 28 28 ILE CA C 117 59.980 60.016 -0.036 1
1 350 . 15 1 1 A 28 28 ILE CB C 117 37.350 38.014 -0.664 1
1 354 . 15 1 1 A 28 28 ILE N N 117 108.913 108.348 0.565 1
1 355 . 15 1 1 A 29 29 GLN H H 118 6.562 7.276 -0.714 1
1 356 . 15 1 1 A 29 29 GLN HA H 118 3.922 4.201 -0.279 1
1 363 . 15 1 1 A 29 29 GLN C C 118 175.049 175.502 -0.453 1
1 364 . 15 1 1 A 29 29 GLN CA C 118 54.596 55.965 -1.369 1
1 365 . 15 1 1 A 29 29 GLN CB C 118 29.570 29.145 0.425 1
1 367 . 15 1 1 A 29 29 GLN N N 118 116.455 123.035 -6.580 1
1 369 . 15 1 1 A 30 30 CYS H H 119 8.138 8.435 -0.297 1
1 370 . 15 1 1 A 30 30 CYS HA H 119 4.580 4.527 0.053 1
1 373 . 15 1 1 A 30 30 CYS CA C 119 57.810 57.605 0.205 1
1 374 . 15 1 1 A 30 30 CYS CB C 119 30.200 28.699 1.501 1
1 375 . 15 1 1 A 30 30 CYS N N 119 134.136 125.556 8.580 1
1 376 . 15 1 1 A 31 31 PRO HA H 120 4.424 4.379 0.045 1
1 383 . 15 1 1 A 31 31 PRO C C 120 177.431 178.765 -1.334 1
1 384 . 15 1 1 A 31 31 PRO CA C 120 64.060 64.696 -0.636 1
1 385 . 15 1 1 A 31 31 PRO CB C 120 32.776 32.271 0.505 1
1 388 . 15 1 1 A 32 32 ILE H H 121 11.318 7.152 4.166 1
1 389 . 15 1 1 A 32 32 ILE HA H 121 4.038 3.944 0.094 1
1 399 . 15 1 1 A 32 32 ILE C C 121 178.485 177.608 0.877 1
1 400 . 15 1 1 A 32 32 ILE CA C 121 64.060 64.234 -0.174 1
1 401 . 15 1 1 A 32 32 ILE CB C 121 39.340 38.283 1.057 1
1 405 . 15 1 1 A 32 32 ILE N N 121 124.500 116.681 7.819 1
1 406 . 15 1 1 A 33 33 THR H H 122 9.928 7.408 2.520 1
1 407 . 15 1 1 A 33 33 THR HA H 122 4.048 4.469 -0.421 1
1 412 . 15 1 1 A 33 33 THR C C 122 175.793 174.603 1.190 1
1 413 . 15 1 1 A 33 33 THR CA C 122 62.990 61.577 1.413 1
1 414 . 15 1 1 A 33 33 THR CB C 122 70.300 69.167 1.133 1
1 416 . 15 1 1 A 33 33 THR N N 122 115.136 108.694 6.442 1
1 417 . 15 1 1 A 34 34 LEU H H 123 8.439 7.769 0.670 1
1 418 . 15 1 1 A 34 34 LEU HA H 123 3.912 3.999 -0.087 1
1 428 . 15 1 1 A 34 34 LEU C C 123 175.495 175.602 -0.107 1
1 429 . 15 1 1 A 34 34 LEU CA C 123 56.290 55.976 0.314 1
1 430 . 15 1 1 A 34 34 LEU CB C 123 38.500 39.715 -1.215 1
1 434 . 15 1 1 A 34 34 LEU N N 123 117.230 121.186 -3.956 1
1 435 . 15 1 1 A 35 35 GLU H H 124 7.816 7.471 0.345 1
1 436 . 15 1 1 A 35 35 GLU HA H 124 4.634 4.708 -0.074 1
1 441 . 15 1 1 A 35 35 GLU C C 124 174.838 174.160 0.678 1
1 442 . 15 1 1 A 35 35 GLU CA C 124 53.780 54.741 -0.961 1
1 443 . 15 1 1 A 35 35 GLU CB C 124 33.710 32.125 1.585 1
1 445 . 15 1 1 A 35 35 GLU N N 124 116.577 116.297 0.280 1
1 446 . 15 1 1 A 36 36 GLN H H 125 8.532 8.583 -0.051 1
1 447 . 15 1 1 A 36 36 GLN HA H 125 4.958 4.375 0.583 1
1 454 . 15 1 1 A 36 36 GLN CA C 125 53.350 53.907 -0.557 1
1 455 . 15 1 1 A 36 36 GLN CB C 125 29.950 29.962 -0.012 1
1 457 . 15 1 1 A 36 36 GLN N N 125 123.034 121.502 1.532 1
1 459 . 15 1 1 A 37 37 PRO HA H 126 4.458 4.557 -0.099 1
1 466 . 15 1 1 A 37 37 PRO C C 126 176.314 177.298 -0.984 1
1 467 . 15 1 1 A 37 37 PRO CA C 126 62.816 65.756 -2.940 1
1 468 . 15 1 1 A 37 37 PRO CB C 126 33.070 31.560 1.510 1
1 471 . 15 1 1 A 38 38 GLU H H 127 8.626 7.658 0.968 1
1 472 . 15 1 1 A 38 38 GLU HA H 127 4.274 4.581 -0.307 1
1 477 . 15 1 1 A 38 38 GLU C C 127 177.809 175.009 2.800 1
1 478 . 15 1 1 A 38 38 GLU CA C 127 58.730 58.323 0.407 1
1 479 . 15 1 1 A 38 38 GLU CB C 127 30.340 29.453 0.887 1
1 481 . 15 1 1 A 38 38 GLU N N 127 120.691 119.290 1.401 1
1 482 . 15 1 1 A 39 39 LYS H H 128 7.891 7.836 0.055 1
1 483 . 15 1 1 A 39 39 LYS HA H 128 4.870 4.639 0.231 1
1 492 . 15 1 1 A 39 39 LYS C C 128 175.452 175.658 -0.206 1
1 493 . 15 1 1 A 39 39 LYS CA C 128 53.540 54.786 -1.246 1
1 494 . 15 1 1 A 39 39 LYS CB C 128 33.630 34.412 -0.782 1
1 498 . 15 1 1 A 39 39 LYS N N 128 118.149 117.879 0.270 1
1 499 . 15 1 1 A 40 40 GLY H H 129 8.524 8.103 0.421 1
1 500 . 15 1 1 A 40 40 GLY HA2 H 129 4.973 3.997 0.976 1
1 501 . 15 1 1 A 40 40 GLY HA3 H 129 2.459 4.133 -1.674 1
1 502 . 15 1 1 A 40 40 GLY C C 129 169.943 171.951 -2.008 1
1 503 . 15 1 1 A 40 40 GLY CA C 129 42.910 44.716 -1.806 1
1 504 . 15 1 1 A 40 40 GLY N N 129 112.845 111.303 1.542 1
1 505 . 15 1 1 A 41 41 ILE H H 130 8.659 8.244 0.415 1
1 506 . 15 1 1 A 41 41 ILE HA H 130 4.591 4.703 -0.112 1
1 516 . 15 1 1 A 41 41 ILE C C 130 172.586 174.023 -1.437 1
1 517 . 15 1 1 A 41 41 ILE CA C 130 58.090 59.134 -1.044 1
1 518 . 15 1 1 A 41 41 ILE CB C 130 43.320 42.001 1.319 1
1 522 . 15 1 1 A 41 41 ILE N N 130 114.060 119.278 -5.218 1
1 523 . 15 1 1 A 42 42 PHE H H 131 9.206 8.790 0.416 1
1 524 . 15 1 1 A 42 42 PHE HA H 131 5.159 4.677 0.482 1
1 532 . 15 1 1 A 42 42 PHE C C 131 174.931 175.986 -1.055 1
1 533 . 15 1 1 A 42 42 PHE CA C 131 57.790 58.293 -0.503 1
1 534 . 15 1 1 A 42 42 PHE CB C 131 42.220 39.596 2.624 1
1 538 . 15 1 1 A 42 42 PHE N N 131 126.002 128.221 -2.219 1
1 539 . 15 1 1 A 43 43 VAL H H 132 8.502 8.878 -0.376 1
1 540 . 15 1 1 A 43 43 VAL HA H 132 4.921 4.650 0.271 1
1 548 . 15 1 1 A 43 43 VAL C C 132 178.219 175.586 2.633 1
1 549 . 15 1 1 A 43 43 VAL CA C 132 59.600 60.064 -0.464 1
1 550 . 15 1 1 A 43 43 VAL CB C 132 35.920 35.700 0.220 1
1 553 . 15 1 1 A 43 43 VAL N N 132 119.068 122.383 -3.315 1
1 554 . 15 1 1 A 44 44 LYS H H 133 10.036 8.702 1.334 1
1 555 . 15 1 1 A 44 44 LYS HA H 133 5.070 4.294 0.776 1
1 564 . 15 1 1 A 44 44 LYS C C 133 177.276 177.827 -0.551 1
1 565 . 15 1 1 A 44 44 LYS CA C 133 56.720 57.331 -0.611 1
1 566 . 15 1 1 A 44 44 LYS CB C 133 34.410 32.800 1.610 1
1 570 . 15 1 1 A 44 44 LYS N N 133 130.934 125.091 5.843 1
1 571 . 15 1 1 A 45 45 ASN H H 134 8.093 8.697 -0.604 1
1 572 . 15 1 1 A 45 45 ASN HA H 134 4.152 4.736 -0.584 1
1 577 . 15 1 1 A 45 45 ASN C C 134 174.087 175.185 -1.098 1
1 578 . 15 1 1 A 45 45 ASN CA C 134 55.360 55.772 -0.412 1
1 579 . 15 1 1 A 45 45 ASN CB C 134 37.530 39.194 -1.664 1
1 580 . 15 1 1 A 45 45 ASN N N 134 117.963 122.123 -4.160 1
1 582 . 15 1 1 A 46 46 SER H H 135 7.524 7.857 -0.333 1
1 583 . 15 1 1 A 46 46 SER HA H 135 4.219 4.679 -0.460 1
1 586 . 15 1 1 A 46 46 SER C C 135 174.490 174.326 0.164 1
1 587 . 15 1 1 A 46 46 SER CA C 135 57.090 55.607 1.483 1
1 588 . 15 1 1 A 46 46 SER CB C 135 63.860 66.944 -3.084 1
1 589 . 15 1 1 A 46 46 SER N N 135 105.939 108.944 -3.005 1
1 590 . 15 1 1 A 47 47 ASP H H 136 9.113 9.075 0.038 1
1 591 . 15 1 1 A 47 47 ASP HA H 136 4.220 4.246 -0.026 1
1 594 . 15 1 1 A 47 47 ASP CA C 136 57.610 57.193 0.417 1
1 595 . 15 1 1 A 47 47 ASP CB C 136 40.810 40.892 -0.082 1
1 596 . 15 1 1 A 47 47 ASP N N 136 120.995 122.320 -1.325 1
1 597 . 15 1 1 A 48 48 GLY H H 137 8.181 8.124 0.057 1
1 598 . 15 1 1 A 48 48 GLY HA2 H 137 4.120 3.889 0.231 1
1 599 . 15 1 1 A 48 48 GLY HA3 H 137 3.659 3.890 -0.231 1
1 600 . 15 1 1 A 48 48 GLY C C 137 174.062 173.490 0.572 1
1 601 . 15 1 1 A 48 48 GLY CA C 137 45.130 46.333 -1.203 1
1 602 . 15 1 1 A 48 48 GLY N N 137 106.197 106.957 -0.760 1
1 603 . 15 1 1 A 49 49 SER H H 138 7.179 7.628 -0.449 1
1 604 . 15 1 1 A 49 49 SER HA H 138 4.383 5.001 -0.618 1
1 607 . 15 1 1 A 49 49 SER C C 138 173.864 173.484 0.380 1
1 608 . 15 1 1 A 49 49 SER CA C 138 57.614 57.516 0.098 1
1 609 . 15 1 1 A 49 49 SER CB C 138 65.100 67.222 -2.122 1
1 610 . 15 1 1 A 49 49 SER N N 138 115.015 114.197 0.818 1
1 611 . 15 1 1 A 50 50 ASP H H 139 8.078 8.557 -0.479 1
1 612 . 15 1 1 A 50 50 ASP HA H 139 4.642 4.825 -0.183 1
1 615 . 15 1 1 A 50 50 ASP C C 139 174.261 175.342 -1.081 1
1 616 . 15 1 1 A 50 50 ASP CA C 139 52.406 54.812 -2.406 1
1 617 . 15 1 1 A 50 50 ASP CB C 139 40.254 41.484 -1.230 1
1 618 . 15 1 1 A 50 50 ASP N N 139 122.400 121.630 0.770 1
1 619 . 15 1 1 A 51 51 VAL H H 140 8.111 7.490 0.621 1
1 620 . 15 1 1 A 51 51 VAL HA H 140 4.360 4.466 -0.106 1
1 628 . 15 1 1 A 51 51 VAL C C 140 176.147 174.426 1.721 1
1 629 . 15 1 1 A 51 51 VAL CA C 140 62.670 60.968 1.702 1
1 630 . 15 1 1 A 51 51 VAL CB C 140 33.930 32.892 1.038 1
1 632 . 15 1 1 A 51 51 VAL N N 140 120.374 120.008 0.366 1
1 633 . 15 1 1 A 52 52 CYS H H 141 8.358 8.957 -0.599 1
1 634 . 15 1 1 A 52 52 CYS HA H 141 4.957 5.462 -0.505 1
1 637 . 15 1 1 A 52 52 CYS C C 141 173.070 172.731 0.339 1
1 638 . 15 1 1 A 52 52 CYS CA C 141 53.380 54.383 -1.003 1
1 639 . 15 1 1 A 52 52 CYS CB C 141 46.110 46.074 0.036 1
1 640 . 15 1 1 A 52 52 CYS N N 141 121.305 128.720 -7.415 1
1 641 . 15 1 1 A 53 53 THR H H 142 8.929 8.784 0.145 1
1 642 . 15 1 1 A 53 53 THR HA H 142 4.498 4.867 -0.369 1
1 648 . 15 1 1 A 53 53 THR C C 142 172.151 172.225 -0.074 1
1 649 . 15 1 1 A 53 53 THR CA C 142 62.960 60.973 1.987 1
1 650 . 15 1 1 A 53 53 THR CB C 142 70.540 72.610 -2.070 1
1 652 . 15 1 1 A 53 53 THR N N 142 120.105 118.063 2.042 1
1 653 . 15 1 1 A 54 54 LEU H H 143 8.448 8.666 -0.218 1
1 654 . 15 1 1 A 54 54 LEU HA H 143 4.322 4.807 -0.485 1
1 664 . 15 1 1 A 54 54 LEU C C 143 174.484 174.401 0.083 1
1 665 . 15 1 1 A 54 54 LEU CA C 143 54.596 53.431 1.165 1
1 666 . 15 1 1 A 54 54 LEU CB C 143 42.396 43.900 -1.504 1
1 670 . 15 1 1 A 54 54 LEU N N 143 128.819 128.226 0.593 1
1 671 . 15 1 1 A 55 55 PHE H H 144 8.661 8.755 -0.094 1
1 672 . 15 1 1 A 55 55 PHE HA H 144 5.459 5.042 0.417 1
1 680 . 15 1 1 A 55 55 PHE C C 144 176.035 174.729 1.306 1
1 681 . 15 1 1 A 55 55 PHE CA C 144 55.020 56.561 -1.541 1
1 682 . 15 1 1 A 55 55 PHE CB C 144 44.100 42.672 1.428 1
1 686 . 15 1 1 A 55 55 PHE N N 144 121.897 125.744 -3.847 1
1 687 . 15 1 1 A 56 56 ASP H H 145 11.616 8.574 3.042 1
1 688 . 15 1 1 A 56 56 ASP HA H 145 4.417 4.531 -0.114 1
1 691 . 15 1 1 A 56 56 ASP C C 145 176.748 177.500 -0.752 1
1 692 . 15 1 1 A 56 56 ASP CA C 145 55.844 54.591 1.253 1
1 693 . 15 1 1 A 56 56 ASP CB C 145 44.390 42.537 1.853 1
1 694 . 15 1 1 A 56 56 ASP N N 145 122.131 122.039 0.092 1
1 695 . 15 1 1 A 57 57 ALA H H 146 8.508 8.861 -0.353 1
1 696 . 15 1 1 A 57 57 ALA HA H 146 3.797 4.085 -0.288 1
1 700 . 15 1 1 A 57 57 ALA C C 146 178.696 180.031 -1.335 1
1 701 . 15 1 1 A 57 57 ALA CA C 146 55.990 55.448 0.542 1
1 702 . 15 1 1 A 57 57 ALA CB C 146 18.840 18.087 0.753 1
1 703 . 15 1 1 A 57 57 ALA N N 146 130.243 128.998 1.245 1
1 704 . 15 1 1 A 58 58 ALA H H 147 8.378 7.647 0.731 1
1 705 . 15 1 1 A 58 58 ALA HA H 147 4.078 4.173 -0.095 1
1 709 . 15 1 1 A 58 58 ALA C C 147 181.091 179.831 1.260 1
1 710 . 15 1 1 A 58 58 ALA CA C 147 54.770 54.963 -0.193 1
1 711 . 15 1 1 A 58 58 ALA CB C 147 17.700 18.296 -0.596 1
1 712 . 15 1 1 A 58 58 ALA N N 147 121.997 119.816 2.181 1
1 713 . 15 1 1 A 59 59 ALA H H 148 9.138 8.045 1.093 1
1 714 . 15 1 1 A 59 59 ALA HA H 148 3.975 4.125 -0.150 1
1 718 . 15 1 1 A 59 59 ALA C C 148 180.508 179.876 0.632 1
1 719 . 15 1 1 A 59 59 ALA CA C 148 54.840 54.962 -0.122 1
1 720 . 15 1 1 A 59 59 ALA CB C 148 18.600 18.645 -0.045 1
1 721 . 15 1 1 A 59 59 ALA N N 148 123.595 120.262 3.333 1
1 722 . 15 1 1 A 60 60 PHE H H 149 8.814 8.068 0.746 1
1 723 . 15 1 1 A 60 60 PHE HA H 149 3.722 4.023 -0.301 1
1 731 . 15 1 1 A 60 60 PHE C C 149 176.773 177.624 -0.851 1
1 732 . 15 1 1 A 60 60 PHE CA C 149 62.030 61.020 1.010 1
1 733 . 15 1 1 A 60 60 PHE CB C 149 39.960 38.820 1.140 1
1 737 . 15 1 1 A 60 60 PHE N N 149 120.354 120.215 0.139 1
1 738 . 15 1 1 A 61 61 SER H H 150 8.276 8.053 0.223 1
1 739 . 15 1 1 A 61 61 SER HA H 150 3.880 4.148 -0.268 1
1 742 . 15 1 1 A 61 61 SER C C 150 177.691 176.596 1.095 1
1 743 . 15 1 1 A 61 61 SER CA C 150 62.190 61.547 0.643 1
1 744 . 15 1 1 A 61 61 SER CB C 150 63.016 62.900 0.116 1
1 745 . 15 1 1 A 61 61 SER N N 150 112.086 114.296 -2.210 1
1 746 . 15 1 1 A 62 62 ARG H H 151 7.829 7.820 0.009 1
1 747 . 15 1 1 A 62 62 ARG HA H 151 3.971 4.038 -0.067 1
1 754 . 15 1 1 A 62 62 ARG C C 151 178.287 178.407 -0.120 1
1 755 . 15 1 1 A 62 62 ARG CA C 151 59.340 58.853 0.487 1
1 756 . 15 1 1 A 62 62 ARG CB C 151 29.760 30.004 -0.244 1
1 759 . 15 1 1 A 62 62 ARG N N 151 121.090 119.228 1.862 1
1 760 . 15 1 1 A 63 63 LEU H H 152 7.390 7.526 -0.136 1
1 761 . 15 1 1 A 63 63 LEU HA H 152 3.791 3.862 -0.071 1
1 771 . 15 1 1 A 63 63 LEU C C 152 179.106 178.250 0.856 1
1 772 . 15 1 1 A 63 63 LEU CA C 152 58.900 58.231 0.669 1
1 773 . 15 1 1 A 63 63 LEU CB C 152 41.140 41.677 -0.537 1
1 777 . 15 1 1 A 63 63 LEU N N 152 121.129 122.183 -1.054 1
1 778 . 15 1 1 A 64 64 VAL H H 153 7.552 7.807 -0.255 1
1 779 . 15 1 1 A 64 64 VAL HA H 153 3.411 3.533 -0.122 1
1 787 . 15 1 1 A 64 64 VAL C C 153 180.595 178.577 2.018 1
1 788 . 15 1 1 A 64 64 VAL CA C 153 65.644 66.040 -0.396 1
1 789 . 15 1 1 A 64 64 VAL CB C 153 31.410 31.347 0.063 1
1 792 . 15 1 1 A 64 64 VAL N N 153 118.280 118.990 -0.710 1
1 793 . 15 1 1 A 65 65 GLY H H 154 8.061 8.354 -0.293 1
1 794 . 15 1 1 A 65 65 GLY HA2 H 154 3.846 3.774 0.072 1
1 795 . 15 1 1 A 65 65 GLY HA3 H 154 3.809 3.775 0.034 1
1 796 . 15 1 1 A 65 65 GLY C C 154 175.235 176.058 -0.823 1
1 797 . 15 1 1 A 65 65 GLY CA C 154 46.630 46.938 -0.308 1
1 798 . 15 1 1 A 65 65 GLY N N 154 108.622 107.889 0.733 1
1 799 . 15 1 1 A 66 66 GLU H H 155 7.528 7.520 0.008 1
1 800 . 15 1 1 A 66 66 GLU HA H 155 4.228 4.330 -0.102 1
1 805 . 15 1 1 A 66 66 GLU C C 155 176.761 176.878 -0.117 1
1 806 . 15 1 1 A 66 66 GLU CA C 155 56.590 56.283 0.307 1
1 807 . 15 1 1 A 66 66 GLU CB C 155 30.490 30.450 0.040 1
1 809 . 15 1 1 A 66 66 GLU N N 155 118.361 118.898 -0.537 1
1 810 . 15 1 1 A 67 67 GLY H H 156 7.884 7.515 0.369 1
1 811 . 15 1 1 A 67 67 GLY HA2 H 156 3.918 3.847 0.071 1
1 812 . 15 1 1 A 67 67 GLY HA3 H 156 3.747 3.862 -0.115 1
1 813 . 15 1 1 A 67 67 GLY C C 156 174.788 174.718 0.070 1
1 814 . 15 1 1 A 67 67 GLY CA C 156 45.890 45.777 0.113 1
1 815 . 15 1 1 A 67 67 GLY N N 156 108.465 108.660 -0.195 1
1 816 . 15 1 1 A 68 68 LEU H H 157 7.332 7.900 -0.568 1
1 817 . 15 1 1 A 68 68 LEU HA H 157 4.361 4.529 -0.168 1
1 827 . 15 1 1 A 68 68 LEU CA C 157 53.060 52.307 0.753 1
1 828 . 15 1 1 A 68 68 LEU CB C 157 41.100 41.522 -0.422 1
1 832 . 15 1 1 A 68 68 LEU N N 157 121.920 121.718 0.202 1
1 833 . 15 1 1 A 69 69 PRO HA H 158 4.485 4.585 -0.100 1
1 840 . 15 1 1 A 69 69 PRO C C 158 174.602 176.222 -1.620 1
1 841 . 15 1 1 A 69 69 PRO CA C 158 61.556 62.264 -0.708 1
1 842 . 15 1 1 A 69 69 PRO CB C 158 32.370 32.586 -0.216 1
1 845 . 15 1 1 A 70 70 HIS H H 159 8.734 8.716 0.018 1
1 846 . 15 1 1 A 70 70 HIS HA H 159 3.947 4.478 -0.531 1
1 852 . 15 1 1 A 70 70 HIS CA C 159 56.250 55.223 1.027 1
1 853 . 15 1 1 A 70 70 HIS CB C 159 32.280 31.008 1.272 1
1 856 . 15 1 1 A 70 70 HIS N N 159 119.423 120.784 -1.361 1
1 857 . 15 1 1 A 71 71 PRO HA H 160 4.424 4.118 0.306 1
1 864 . 15 1 1 A 71 71 PRO C C 160 177.567 178.673 -1.106 1
1 865 . 15 1 1 A 71 71 PRO CA C 160 64.574 65.739 -1.165 1
1 866 . 15 1 1 A 71 71 PRO CB C 160 32.340 31.646 0.694 1
1 869 . 15 1 1 A 72 72 LEU H H 161 10.123 7.348 2.775 1
1 870 . 15 1 1 A 72 72 LEU HA H 161 4.778 4.276 0.502 1
1 880 . 15 1 1 A 72 72 LEU C C 161 178.721 178.256 0.465 1
1 881 . 15 1 1 A 72 72 LEU CA C 161 55.800 57.332 -1.532 1
1 882 . 15 1 1 A 72 72 LEU CB C 161 42.440 42.378 0.062 1
1 886 . 15 1 1 A 72 72 LEU N N 161 117.374 117.646 -0.272 1
1 887 . 15 1 1 A 73 73 THR H H 162 7.523 7.792 -0.269 1
1 888 . 15 1 1 A 73 73 THR HA H 162 4.291 4.492 -0.201 1
1 893 . 15 1 1 A 73 73 THR C C 162 175.557 174.333 1.224 1
1 894 . 15 1 1 A 73 73 THR CA C 162 61.440 62.909 -1.469 1
1 895 . 15 1 1 A 73 73 THR CB C 162 70.500 69.741 0.759 1
1 897 . 15 1 1 A 73 73 THR N N 162 107.787 111.968 -4.181 1
1 898 . 15 1 1 A 74 74 ARG H H 163 8.361 7.855 0.506 1
1 899 . 15 1 1 A 74 74 ARG HA H 163 3.836 4.296 -0.460 1
1 906 . 15 1 1 A 74 74 ARG C C 163 174.701 175.169 -0.468 1
1 907 . 15 1 1 A 74 74 ARG CA C 163 57.980 57.569 0.411 1
1 908 . 15 1 1 A 74 74 ARG CB C 163 26.770 26.882 -0.112 1
1 911 . 15 1 1 A 74 74 ARG N N 163 115.130 118.717 -3.587 1
1 912 . 15 1 1 A 75 75 GLU H H 164 7.430 8.086 -0.656 1
1 913 . 15 1 1 A 75 75 GLU HA H 164 4.636 4.501 0.135 1
1 918 . 15 1 1 A 75 75 GLU CA C 164 53.699 54.954 -1.255 1
1 919 . 15 1 1 A 75 75 GLU CB C 164 29.550 28.505 1.045 1
1 921 . 15 1 1 A 75 75 GLU N N 164 120.076 118.984 1.092 1
1 922 . 15 1 1 A 76 76 PRO HA H 165 4.272 4.637 -0.365 1
1 929 . 15 1 1 A 76 76 PRO C C 165 176.649 176.948 -0.299 1
1 930 . 15 1 1 A 76 76 PRO CA C 165 63.204 62.796 0.408 1
1 931 . 15 1 1 A 76 76 PRO CB C 165 31.680 31.640 0.040 1
1 934 . 15 1 1 A 77 77 ILE H H 166 8.812 8.228 0.584 1
1 935 . 15 1 1 A 77 77 ILE HA H 166 3.838 4.308 -0.470 1
1 945 . 15 1 1 A 77 77 ILE C C 166 175.235 175.880 -0.645 1
1 946 . 15 1 1 A 77 77 ILE CA C 166 62.816 61.202 1.614 1
1 947 . 15 1 1 A 77 77 ILE CB C 166 37.750 37.947 -0.197 1
1 951 . 15 1 1 A 77 77 ILE N N 166 123.831 124.027 -0.196 1
1 952 . 15 1 1 A 78 78 THR H H 167 6.625 8.537 -1.912 1
1 953 . 15 1 1 A 78 78 THR HA H 167 4.632 5.065 -0.433 1
1 958 . 15 1 1 A 78 78 THR C C 167 174.143 174.880 -0.737 1
1 959 . 15 1 1 A 78 78 THR CA C 167 58.750 59.954 -1.204 1
1 960 . 15 1 1 A 78 78 THR CB C 167 71.320 71.356 -0.036 1
1 962 . 15 1 1 A 78 78 THR N N 167 115.293 117.825 -2.532 1
1 963 . 15 1 1 A 79 79 ALA H H 168 9.088 9.061 0.027 1
1 964 . 15 1 1 A 79 79 ALA HA H 168 3.916 4.081 -0.165 1
1 968 . 15 1 1 A 79 79 ALA C C 168 179.770 179.475 0.295 1
1 969 . 15 1 1 A 79 79 ALA CA C 168 55.480 55.217 0.263 1
1 970 . 15 1 1 A 79 79 ALA CB C 168 17.630 18.446 -0.816 1
1 971 . 15 1 1 A 79 79 ALA N N 168 122.102 128.337 -6.235 1
1 972 . 15 1 1 A 80 80 SER H H 169 7.988 7.665 0.323 1
1 973 . 15 1 1 A 80 80 SER HA H 169 4.091 4.237 -0.146 1
1 976 . 15 1 1 A 80 80 SER C C 169 175.836 176.640 -0.804 1
1 977 . 15 1 1 A 80 80 SER CA C 169 60.750 61.434 -0.684 1
1 978 . 15 1 1 A 80 80 SER CB C 169 62.510 62.975 -0.465 1
1 979 . 15 1 1 A 80 80 SER N N 169 109.660 113.546 -3.886 1
1 980 . 15 1 1 A 81 81 ILE H H 170 7.052 7.622 -0.570 1
1 981 . 15 1 1 A 81 81 ILE HA H 170 4.344 4.080 0.264 1
1 991 . 15 1 1 A 81 81 ILE C C 170 174.236 176.493 -2.257 1
1 992 . 15 1 1 A 81 81 ILE CA C 170 61.760 63.843 -2.083 1
1 993 . 15 1 1 A 81 81 ILE CB C 170 37.950 37.603 0.347 1
1 997 . 15 1 1 A 81 81 ILE N N 170 112.623 114.275 -1.652 1
1 998 . 15 1 1 A 82 82 ILE H H 171 7.345 7.022 0.323 1
1 999 . 15 1 1 A 82 82 ILE HA H 171 4.288 4.002 0.286 1
1 1009 . 15 1 1 A 82 82 ILE C C 171 174.931 175.222 -0.291 1
1 1010 . 15 1 1 A 82 82 ILE CA C 171 61.420 62.086 -0.666 1
1 1011 . 15 1 1 A 82 82 ILE CB C 171 37.230 37.768 -0.538 1
1 1015 . 15 1 1 A 82 82 ILE N N 171 124.260 125.324 -1.064 1
1 1016 . 15 1 1 A 83 83 VAL H H 172 7.843 8.768 -0.925 1
1 1017 . 15 1 1 A 83 83 VAL HA H 172 4.818 5.061 -0.243 1
1 1025 . 15 1 1 A 83 83 VAL C C 172 174.918 175.638 -0.720 1
1 1026 . 15 1 1 A 83 83 VAL CA C 172 58.910 59.242 -0.332 1
1 1027 . 15 1 1 A 83 83 VAL CB C 172 34.570 35.218 -0.648 1
1 1030 . 15 1 1 A 83 83 VAL N N 172 118.856 122.048 -3.192 1
1 1031 . 15 1 1 A 84 84 LYS H H 173 8.347 8.791 -0.444 1
1 1032 . 15 1 1 A 84 84 LYS HA H 173 4.356 4.574 -0.218 1
1 1041 . 15 1 1 A 84 84 LYS C C 173 178.653 178.626 0.027 1
1 1042 . 15 1 1 A 84 84 LYS CA C 173 56.360 55.512 0.848 1
1 1043 . 15 1 1 A 84 84 LYS CB C 173 33.366 33.315 0.051 1
1 1047 . 15 1 1 A 84 84 LYS N N 173 119.602 121.686 -2.084 1
1 1048 . 15 1 1 A 85 85 HIS H H 174 9.143 9.025 0.118 1
1 1049 . 15 1 1 A 85 85 HIS HA H 174 4.013 4.362 -0.349 1
1 1053 . 15 1 1 A 85 85 HIS C C 174 176.606 177.152 -0.546 1
1 1054 . 15 1 1 A 85 85 HIS CA C 174 58.820 60.330 -1.510 1
1 1055 . 15 1 1 A 85 85 HIS CB C 174 28.186 29.598 -1.412 1
1 1057 . 15 1 1 A 85 85 HIS N N 174 120.022 122.573 -2.551 1
1 1058 . 15 1 1 A 86 86 GLU H H 175 8.403 8.504 -0.101 1
1 1059 . 15 1 1 A 86 86 GLU HA H 175 3.863 3.852 0.011 1
1 1064 . 15 1 1 A 86 86 GLU C C 175 177.040 178.529 -1.489 1
1 1065 . 15 1 1 A 86 86 GLU CA C 175 57.830 59.434 -1.604 1
1 1066 . 15 1 1 A 86 86 GLU CB C 175 28.690 29.271 -0.581 1
1 1068 . 15 1 1 A 86 86 GLU N N 175 116.124 119.304 -3.180 1
1 1069 . 15 1 1 A 87 87 GLU H H 176 7.669 8.079 -0.410 1
1 1070 . 15 1 1 A 87 87 GLU HA H 176 4.039 4.222 -0.183 1
1 1075 . 15 1 1 A 87 87 GLU C C 176 175.688 177.260 -1.572 1
1 1076 . 15 1 1 A 87 87 GLU CA C 176 57.906 59.091 -1.185 1
1 1077 . 15 1 1 A 87 87 GLU CB C 176 30.430 28.911 1.519 1
1 1079 . 15 1 1 A 87 87 GLU N N 176 116.183 118.513 -2.330 1
1 1080 . 15 1 1 A 88 88 CYS H H 177 6.750 7.643 -0.893 1
1 1081 . 15 1 1 A 88 88 CYS HA H 177 4.991 4.726 0.265 1
1 1084 . 15 1 1 A 88 88 CYS C C 177 172.325 173.213 -0.888 1
1 1085 . 15 1 1 A 88 88 CYS CA C 177 55.030 54.088 0.942 1
1 1086 . 15 1 1 A 88 88 CYS CB C 177 45.610 41.983 3.627 1
1 1087 . 15 1 1 A 88 88 CYS N N 177 114.838 116.618 -1.780 1
1 1088 . 15 1 1 A 89 89 ILE H H 178 9.128 8.906 0.222 1
1 1089 . 15 1 1 A 89 89 ILE HA H 178 4.536 4.982 -0.446 1
1 1099 . 15 1 1 A 89 89 ILE C C 178 174.893 174.523 0.370 1
1 1100 . 15 1 1 A 89 89 ILE CA C 178 59.160 59.497 -0.337 1
1 1101 . 15 1 1 A 89 89 ILE CB C 178 41.840 40.688 1.152 1
1 1105 . 15 1 1 A 89 89 ILE N N 178 120.564 121.337 -0.773 1
1 1106 . 15 1 1 A 90 90 TYR H H 179 9.349 9.058 0.291 1
1 1107 . 15 1 1 A 90 90 TYR HA H 179 3.568 4.174 -0.606 1
1 1112 . 15 1 1 A 90 90 TYR C C 179 173.950 173.807 0.143 1
1 1113 . 15 1 1 A 90 90 TYR CA C 179 61.180 57.985 3.195 1
1 1114 . 15 1 1 A 90 90 TYR CB C 179 37.530 38.204 -0.674 1
1 1116 . 15 1 1 A 90 90 TYR N N 179 129.033 126.881 2.152 1
1 1117 . 15 1 1 A 91 91 ASP H H 180 7.367 8.257 -0.890 1
1 1118 . 15 1 1 A 91 91 ASP HA H 180 4.662 4.532 0.130 1
1 1121 . 15 1 1 A 91 91 ASP C C 180 175.291 175.798 -0.507 1
1 1122 . 15 1 1 A 91 91 ASP CA C 180 52.230 52.458 -0.228 1
1 1123 . 15 1 1 A 91 91 ASP CB C 180 43.650 42.037 1.613 1
1 1124 . 15 1 1 A 91 91 ASP N N 180 129.305 128.721 0.584 1
1 1125 . 15 1 1 A 92 92 ASP H H 181 8.783 8.613 0.170 1
1 1126 . 15 1 1 A 92 92 ASP HA H 181 4.114 3.923 0.191 1
1 1129 . 15 1 1 A 92 92 ASP C C 181 177.573 178.272 -0.699 1
1 1130 . 15 1 1 A 92 92 ASP CA C 181 56.390 57.205 -0.815 1
1 1131 . 15 1 1 A 92 92 ASP CB C 181 41.330 40.297 1.033 1
1 1132 . 15 1 1 A 92 92 ASP N N 181 125.665 125.391 0.274 1
1 1133 . 15 1 1 A 93 93 THR H H 182 8.284 7.900 0.384 1
1 1134 . 15 1 1 A 93 93 THR HA H 182 4.037 3.790 0.247 1
1 1139 . 15 1 1 A 93 93 THR C C 182 176.333 176.383 -0.050 1
1 1140 . 15 1 1 A 93 93 THR CA C 182 65.320 66.963 -1.643 1
1 1141 . 15 1 1 A 93 93 THR CB C 182 68.560 68.453 0.107 1
1 1143 . 15 1 1 A 93 93 THR N N 182 114.688 116.256 -1.568 1
1 1144 . 15 1 1 A 94 94 ARG H H 183 7.784 7.530 0.254 1
1 1145 . 15 1 1 A 94 94 ARG HA H 183 4.142 4.231 -0.089 1
1 1152 . 15 1 1 A 94 94 ARG C C 183 177.015 177.052 -0.037 1
1 1153 . 15 1 1 A 94 94 ARG CA C 183 55.350 56.258 -0.908 1
1 1154 . 15 1 1 A 94 94 ARG CB C 183 30.930 30.818 0.112 1
1 1157 . 15 1 1 A 94 94 ARG N N 183 120.156 118.358 1.798 1
1 1158 . 15 1 1 A 95 95 GLY H H 184 8.144 8.871 -0.727 1
1 1159 . 15 1 1 A 95 95 GLY HA2 H 184 3.839 3.934 -0.095 1
1 1160 . 15 1 1 A 95 95 GLY HA3 H 184 3.681 3.968 -0.287 1
1 1161 . 15 1 1 A 95 95 GLY C C 184 173.653 173.389 0.264 1
1 1162 . 15 1 1 A 95 95 GLY CA C 184 46.160 46.192 -0.032 1
1 1163 . 15 1 1 A 95 95 GLY N N 184 107.879 108.883 -1.004 1
1 1164 . 15 1 1 A 96 96 ASN H H 185 6.855 7.319 -0.464 1
1 1165 . 15 1 1 A 96 96 ASN HA H 185 4.909 5.036 -0.127 1
1 1170 . 15 1 1 A 96 96 ASN C C 185 174.223 173.354 0.869 1
1 1171 . 15 1 1 A 96 96 ASN CA C 185 52.720 52.450 0.270 1
1 1172 . 15 1 1 A 96 96 ASN CB C 185 45.620 41.508 4.112 1
1 1173 . 15 1 1 A 96 96 ASN N N 185 113.382 116.513 -3.131 1
1 1175 . 15 1 1 A 97 97 PHE H H 186 9.228 8.605 0.623 1
1 1176 . 15 1 1 A 97 97 PHE HA H 186 4.579 4.501 0.078 1
1 1183 . 15 1 1 A 97 97 PHE C C 186 174.794 175.643 -0.849 1
1 1184 . 15 1 1 A 97 97 PHE CA C 186 59.384 59.232 0.152 1
1 1185 . 15 1 1 A 97 97 PHE CB C 186 40.450 39.252 1.198 1
1 1188 . 15 1 1 A 97 97 PHE N N 186 118.661 119.339 -0.678 1
1 1189 . 15 1 1 A 98 98 ILE H H 187 8.908 9.140 -0.232 1
1 1190 . 15 1 1 A 98 98 ILE HA H 187 5.440 4.762 0.678 1
1 1200 . 15 1 1 A 98 98 ILE C C 187 176.171 175.052 1.119 1
1 1201 . 15 1 1 A 98 98 ILE CA C 187 57.610 59.825 -2.215 1
1 1202 . 15 1 1 A 98 98 ILE CB C 187 41.280 40.528 0.752 1
1 1206 . 15 1 1 A 98 98 ILE N N 187 120.585 123.448 -2.863 1
1 1207 . 15 1 1 A 99 99 ILE H H 188 8.602 8.427 0.175 1
1 1208 . 15 1 1 A 99 99 ILE HA H 188 4.546 4.572 -0.026 1
1 1218 . 15 1 1 A 99 99 ILE C C 188 176.668 175.163 1.505 1
1 1219 . 15 1 1 A 99 99 ILE CA C 188 58.920 60.696 -1.776 1
1 1220 . 15 1 1 A 99 99 ILE CB C 188 37.960 38.371 -0.411 1
1 1224 . 15 1 1 A 99 99 ILE N N 188 124.500 124.802 -0.302 1
1 1225 . 15 1 1 A 100 100 LYS H H 189 8.449 8.292 0.157 1
1 1226 . 15 1 1 A 100 100 LYS HA H 189 4.108 4.741 -0.633 1
1 1235 . 15 1 1 A 100 100 LYS C C 189 176.866 175.104 1.762 1
1 1236 . 15 1 1 A 100 100 LYS CA C 189 56.800 55.378 1.422 1
1 1237 . 15 1 1 A 100 100 LYS CB C 189 33.400 33.242 0.158 1
1 1241 . 15 1 1 A 100 100 LYS N N 189 128.581 127.256 1.325 1
1 1242 . 15 1 1 A 101 101 GLY H H 190 8.381 8.522 -0.141 1
1 1243 . 15 1 1 A 101 101 GLY HA2 H 190 3.946 4.058 -0.112 1
1 1244 . 15 1 1 A 101 101 GLY HA3 H 190 3.828 4.060 -0.232 1
1 1245 . 15 1 1 A 101 101 GLY C C 190 172.902 173.105 -0.203 1
1 1246 . 15 1 1 A 101 101 GLY CA C 190 44.920 44.693 0.227 1
1 1247 . 15 1 1 A 101 101 GLY N N 190 111.183 113.501 -2.318 1
1 7 . 16 1 1 A 2 2 GLN H H 91 8.786 7.805 0.981 1
1 8 . 16 1 1 A 2 2 GLN HA H 91 4.005 3.970 0.035 1
1 15 . 16 1 1 A 2 2 GLN C C 91 177.270 178.115 -0.845 1
1 16 . 16 1 1 A 2 2 GLN CA C 91 58.220 58.962 -0.742 1
1 17 . 16 1 1 A 2 2 GLN CB C 91 28.650 28.362 0.288 1
1 19 . 16 1 1 A 2 2 GLN N N 91 121.993 121.053 0.940 1
1 21 . 16 1 1 A 3 3 GLU H H 92 8.430 8.249 0.181 1
1 22 . 16 1 1 A 3 3 GLU HA H 92 4.007 4.067 -0.060 1
1 27 . 16 1 1 A 3 3 GLU C C 92 178.287 178.762 -0.475 1
1 28 . 16 1 1 A 3 3 GLU CA C 92 59.490 59.606 -0.116 1
1 29 . 16 1 1 A 3 3 GLU CB C 92 29.506 29.408 0.098 1
1 31 . 16 1 1 A 3 3 GLU N N 92 120.195 121.007 -0.812 1
1 32 . 16 1 1 A 4 4 SER H H 93 8.209 7.858 0.351 1
1 33 . 16 1 1 A 4 4 SER HA H 93 4.272 4.255 0.017 1
1 36 . 16 1 1 A 4 4 SER C C 93 177.369 177.292 0.077 1
1 37 . 16 1 1 A 4 4 SER CA C 93 61.044 61.428 -0.384 1
1 38 . 16 1 1 A 4 4 SER CB C 93 62.950 62.902 0.048 1
1 39 . 16 1 1 A 4 4 SER N N 93 115.524 114.018 1.506 1
1 40 . 16 1 1 A 5 5 ILE H H 94 8.080 7.819 0.261 1
1 41 . 16 1 1 A 5 5 ILE HA H 94 3.530 3.671 -0.141 1
1 51 . 16 1 1 A 5 5 ILE C C 94 177.778 177.507 0.271 1
1 52 . 16 1 1 A 5 5 ILE CA C 94 65.710 65.285 0.425 1
1 53 . 16 1 1 A 5 5 ILE CB C 94 37.800 37.355 0.445 1
1 57 . 16 1 1 A 5 5 ILE N N 94 124.148 121.952 2.196 1
1 58 . 16 1 1 A 6 6 GLN H H 95 8.374 8.518 -0.144 1
1 59 . 16 1 1 A 6 6 GLN HA H 95 4.125 3.948 0.177 1
1 66 . 16 1 1 A 6 6 GLN C C 95 179.726 179.362 0.364 1
1 67 . 16 1 1 A 6 6 GLN CA C 95 59.190 58.943 0.247 1
1 68 . 16 1 1 A 6 6 GLN CB C 95 27.060 28.517 -1.457 1
1 70 . 16 1 1 A 6 6 GLN N N 95 118.257 119.057 -0.800 1
1 72 . 16 1 1 A 7 7 ASN H H 96 8.456 7.969 0.487 1
1 73 . 16 1 1 A 7 7 ASN HA H 96 4.446 4.471 -0.025 1
1 78 . 16 1 1 A 7 7 ASN C C 96 177.257 177.838 -0.581 1
1 79 . 16 1 1 A 7 7 ASN CA C 96 56.020 56.352 -0.332 1
1 80 . 16 1 1 A 7 7 ASN CB C 96 38.126 38.118 0.008 1
1 81 . 16 1 1 A 7 7 ASN N N 96 118.597 118.390 0.207 1
1 83 . 16 1 1 A 8 8 LYS H H 97 7.732 7.875 -0.143 1
1 84 . 16 1 1 A 8 8 LYS HA H 97 4.129 4.042 0.087 1
1 93 . 16 1 1 A 8 8 LYS C C 97 179.143 179.112 0.031 1
1 94 . 16 1 1 A 8 8 LYS CA C 97 59.126 59.809 -0.683 1
1 95 . 16 1 1 A 8 8 LYS CB C 97 32.070 32.387 -0.317 1
1 99 . 16 1 1 A 8 8 LYS N N 97 122.381 120.052 2.329 1
1 100 . 16 1 1 A 9 9 ILE H H 98 8.452 8.216 0.236 1
1 101 . 16 1 1 A 9 9 ILE HA H 98 3.480 3.818 -0.338 1
1 111 . 16 1 1 A 9 9 ILE C C 98 177.406 178.431 -1.025 1
1 112 . 16 1 1 A 9 9 ILE CA C 98 66.430 65.391 1.039 1
1 113 . 16 1 1 A 9 9 ILE CB C 98 37.980 37.558 0.422 1
1 117 . 16 1 1 A 9 9 ILE N N 98 119.950 120.546 -0.596 1
1 118 . 16 1 1 A 10 10 SER H H 99 7.924 7.750 0.174 1
1 119 . 16 1 1 A 10 10 SER HA H 99 3.983 4.223 -0.240 1
1 122 . 16 1 1 A 10 10 SER C C 99 176.327 176.344 -0.017 1
1 123 . 16 1 1 A 10 10 SER CA C 99 61.990 61.590 0.400 1
1 124 . 16 1 1 A 10 10 SER CB C 99 62.790 63.267 -0.477 1
1 125 . 16 1 1 A 10 10 SER N N 99 113.568 116.530 -2.962 1
1 126 . 16 1 1 A 11 11 GLN H H 100 7.832 7.803 0.029 1
1 127 . 16 1 1 A 11 11 GLN HA H 100 4.238 4.389 -0.151 1
1 134 . 16 1 1 A 11 11 GLN C C 100 178.088 176.928 1.160 1
1 135 . 16 1 1 A 11 11 GLN CA C 100 57.900 56.813 1.087 1
1 136 . 16 1 1 A 11 11 GLN CB C 100 29.790 29.463 0.327 1
1 138 . 16 1 1 A 11 11 GLN N N 100 117.487 117.372 0.115 1
1 140 . 16 1 1 A 12 12 CYS H H 101 7.920 8.042 -0.122 1
1 141 . 16 1 1 A 12 12 CYS HA H 101 4.657 4.718 -0.061 1
1 144 . 16 1 1 A 12 12 CYS C C 101 175.439 174.649 0.790 1
1 145 . 16 1 1 A 12 12 CYS CA C 101 60.654 58.228 2.426 1
1 146 . 16 1 1 A 12 12 CYS CB C 101 29.310 27.753 1.557 1
1 147 . 16 1 1 A 12 12 CYS N N 101 114.221 117.582 -3.361 1
1 148 . 16 1 1 A 13 13 LYS H H 102 7.993 7.068 0.925 1
1 149 . 16 1 1 A 13 13 LYS HA H 102 5.038 4.555 0.483 1
1 158 . 16 1 1 A 13 13 LYS C C 102 174.757 176.156 -1.399 1
1 159 . 16 1 1 A 13 13 LYS CA C 102 56.660 55.935 0.725 1
1 160 . 16 1 1 A 13 13 LYS CB C 102 32.970 33.540 -0.570 1
1 164 . 16 1 1 A 13 13 LYS N N 102 123.841 119.424 4.417 1
1 165 . 16 1 1 A 14 14 PHE H H 103 8.822 8.486 0.336 1
1 166 . 16 1 1 A 14 14 PHE HA H 103 5.058 5.094 -0.036 1
1 174 . 16 1 1 A 14 14 PHE C C 103 173.560 172.136 1.424 1
1 175 . 16 1 1 A 14 14 PHE CA C 103 55.470 56.016 -0.546 1
1 176 . 16 1 1 A 14 14 PHE CB C 103 41.760 40.494 1.266 1
1 180 . 16 1 1 A 14 14 PHE N N 103 118.421 116.309 2.112 1
1 181 . 16 1 1 A 15 15 SER H H 104 8.826 8.666 0.160 1
1 182 . 16 1 1 A 15 15 SER HA H 104 4.602 4.577 0.025 1
1 185 . 16 1 1 A 15 15 SER C C 104 173.851 172.607 1.244 1
1 186 . 16 1 1 A 15 15 SER CA C 104 58.610 57.647 0.963 1
1 187 . 16 1 1 A 15 15 SER CB C 104 62.690 62.925 -0.235 1
1 188 . 16 1 1 A 15 15 SER N N 104 117.781 115.805 1.976 1
1 189 . 16 1 1 A 16 16 VAL H H 105 7.839 8.107 -0.268 1
1 190 . 16 1 1 A 16 16 VAL HA H 105 3.390 4.373 -0.983 1
1 198 . 16 1 1 A 16 16 VAL C C 105 174.987 175.152 -0.165 1
1 199 . 16 1 1 A 16 16 VAL CA C 105 63.650 62.439 1.211 1
1 200 . 16 1 1 A 16 16 VAL CB C 105 31.410 30.279 1.131 1
1 203 . 16 1 1 A 16 16 VAL N N 105 129.036 127.239 1.797 1
1 204 . 16 1 1 A 17 17 CYS H H 106 8.536 8.117 0.419 1
1 205 . 16 1 1 A 17 17 CYS HA H 106 5.011 4.957 0.054 1
1 208 . 16 1 1 A 17 17 CYS CA C 106 55.260 56.338 -1.078 1
1 209 . 16 1 1 A 17 17 CYS CB C 106 28.210 30.246 -2.036 1
1 210 . 16 1 1 A 17 17 CYS N N 106 130.045 127.380 2.665 1
1 211 . 16 1 1 A 18 18 PRO HA H 107 3.991 4.396 -0.405 1
1 218 . 16 1 1 A 18 18 PRO C C 107 178.188 177.951 0.237 1
1 219 . 16 1 1 A 18 18 PRO CA C 107 65.940 64.550 1.390 1
1 220 . 16 1 1 A 18 18 PRO CB C 107 32.000 32.145 -0.145 1
1 223 . 16 1 1 A 19 19 GLU H H 108 9.260 9.003 0.257 1
1 224 . 16 1 1 A 19 19 GLU HA H 108 4.119 4.074 0.045 1
1 229 . 16 1 1 A 19 19 GLU C C 108 178.721 179.280 -0.559 1
1 230 . 16 1 1 A 19 19 GLU CA C 108 59.300 59.829 -0.529 1
1 231 . 16 1 1 A 19 19 GLU CB C 108 28.920 28.759 0.161 1
1 233 . 16 1 1 A 19 19 GLU N N 108 118.270 116.129 2.141 1
1 234 . 16 1 1 A 20 20 ARG H H 109 7.672 7.651 0.021 1
1 235 . 16 1 1 A 20 20 ARG HA H 109 4.331 4.128 0.203 1
1 242 . 16 1 1 A 20 20 ARG C C 109 177.977 178.576 -0.599 1
1 243 . 16 1 1 A 20 20 ARG CA C 109 57.350 59.303 -1.953 1
1 244 . 16 1 1 A 20 20 ARG CB C 109 30.820 30.689 0.131 1
1 247 . 16 1 1 A 20 20 ARG N N 109 118.357 119.449 -1.092 1
1 248 . 16 1 1 A 21 21 LEU H H 110 7.601 7.689 -0.088 1
1 249 . 16 1 1 A 21 21 LEU HA H 110 4.380 4.408 -0.028 1
1 259 . 16 1 1 A 21 21 LEU C C 110 176.562 176.432 0.130 1
1 260 . 16 1 1 A 21 21 LEU CA C 110 56.096 55.580 0.516 1
1 261 . 16 1 1 A 21 21 LEU CB C 110 44.016 42.180 1.836 1
1 265 . 16 1 1 A 21 21 LEU N N 110 118.626 119.192 -0.566 1
1 266 . 16 1 1 A 22 22 GLN H H 111 7.750 7.604 0.146 1
1 267 . 16 1 1 A 22 22 GLN HA H 111 3.870 4.002 -0.132 1
1 274 . 16 1 1 A 22 22 GLN C C 111 173.336 174.082 -0.746 1
1 275 . 16 1 1 A 22 22 GLN CA C 111 56.510 57.029 -0.519 1
1 276 . 16 1 1 A 22 22 GLN CB C 111 26.800 26.141 0.659 1
1 278 . 16 1 1 A 22 22 GLN N N 111 113.926 115.652 -1.726 1
1 280 . 16 1 1 A 23 23 CYS H H 112 7.407 7.890 -0.483 1
1 281 . 16 1 1 A 23 23 CYS HA H 112 4.469 4.983 -0.514 1
1 284 . 16 1 1 A 23 23 CYS CA C 112 52.650 56.581 -3.931 1
1 285 . 16 1 1 A 23 23 CYS CB C 112 29.750 29.867 -0.117 1
1 286 . 16 1 1 A 23 23 CYS N N 112 112.681 117.464 -4.783 1
1 287 . 16 1 1 A 24 24 PRO HA H 113 4.408 4.512 -0.104 1
1 294 . 16 1 1 A 24 24 PRO C C 113 178.175 177.640 0.535 1
1 295 . 16 1 1 A 24 24 PRO CA C 113 62.040 62.578 -0.538 1
1 296 . 16 1 1 A 24 24 PRO CB C 113 31.920 32.569 -0.649 1
1 299 . 16 1 1 A 25 25 LEU H H 114 8.593 8.823 -0.230 1
1 300 . 16 1 1 A 25 25 LEU HA H 114 3.765 4.060 -0.295 1
1 310 . 16 1 1 A 25 25 LEU C C 114 179.950 178.611 1.339 1
1 311 . 16 1 1 A 25 25 LEU CA C 114 57.674 58.041 -0.367 1
1 312 . 16 1 1 A 25 25 LEU CB C 114 40.690 41.400 -0.710 1
1 316 . 16 1 1 A 25 25 LEU N N 114 123.729 124.124 -0.395 1
1 317 . 16 1 1 A 26 26 GLU H H 115 9.108 8.471 0.637 1
1 318 . 16 1 1 A 26 26 GLU HA H 115 3.876 3.968 -0.092 1
1 323 . 16 1 1 A 26 26 GLU C C 115 177.505 178.990 -1.485 1
1 324 . 16 1 1 A 26 26 GLU CA C 115 59.410 59.583 -0.173 1
1 325 . 16 1 1 A 26 26 GLU CB C 115 28.460 29.288 -0.828 1
1 327 . 16 1 1 A 26 26 GLU N N 115 116.817 118.038 -1.221 1
1 328 . 16 1 1 A 27 27 ALA H H 116 7.360 7.857 -0.497 1
1 329 . 16 1 1 A 27 27 ALA HA H 116 4.408 3.874 0.534 1
1 333 . 16 1 1 A 27 27 ALA C C 116 177.046 178.662 -1.616 1
1 334 . 16 1 1 A 27 27 ALA CA C 116 52.970 54.680 -1.710 1
1 335 . 16 1 1 A 27 27 ALA CB C 116 19.916 17.895 2.021 1
1 336 . 16 1 1 A 27 27 ALA N N 116 118.966 121.956 -2.990 1
1 337 . 16 1 1 A 28 28 ILE H H 117 7.168 7.122 0.046 1
1 338 . 16 1 1 A 28 28 ILE HA H 117 4.432 4.728 -0.296 1
1 348 . 16 1 1 A 28 28 ILE C C 117 172.641 175.585 -2.944 1
1 349 . 16 1 1 A 28 28 ILE CA C 117 59.980 60.709 -0.729 1
1 350 . 16 1 1 A 28 28 ILE CB C 117 37.350 37.905 -0.555 1
1 354 . 16 1 1 A 28 28 ILE N N 117 108.913 109.158 -0.245 1
1 355 . 16 1 1 A 29 29 GLN H H 118 6.562 7.432 -0.870 1
1 356 . 16 1 1 A 29 29 GLN HA H 118 3.922 4.257 -0.335 1
1 363 . 16 1 1 A 29 29 GLN C C 118 175.049 175.670 -0.621 1
1 364 . 16 1 1 A 29 29 GLN CA C 118 54.596 55.968 -1.372 1
1 365 . 16 1 1 A 29 29 GLN CB C 118 29.570 29.205 0.365 1
1 367 . 16 1 1 A 29 29 GLN N N 118 116.455 123.261 -6.806 1
1 369 . 16 1 1 A 30 30 CYS H H 119 8.138 8.408 -0.270 1
1 370 . 16 1 1 A 30 30 CYS HA H 119 4.580 4.584 -0.004 1
1 373 . 16 1 1 A 30 30 CYS CA C 119 57.810 57.450 0.360 1
1 374 . 16 1 1 A 30 30 CYS CB C 119 30.200 28.834 1.366 1
1 375 . 16 1 1 A 30 30 CYS N N 119 134.136 125.472 8.664 1
1 376 . 16 1 1 A 31 31 PRO HA H 120 4.424 4.329 0.095 1
1 383 . 16 1 1 A 31 31 PRO C C 120 177.431 178.767 -1.336 1
1 384 . 16 1 1 A 31 31 PRO CA C 120 64.060 65.007 -0.947 1
1 385 . 16 1 1 A 31 31 PRO CB C 120 32.776 32.173 0.603 1
1 388 . 16 1 1 A 32 32 ILE H H 121 11.318 7.228 4.090 1
1 389 . 16 1 1 A 32 32 ILE HA H 121 4.038 3.942 0.096 1
1 399 . 16 1 1 A 32 32 ILE C C 121 178.485 177.626 0.859 1
1 400 . 16 1 1 A 32 32 ILE CA C 121 64.060 64.133 -0.073 1
1 401 . 16 1 1 A 32 32 ILE CB C 121 39.340 38.218 1.122 1
1 405 . 16 1 1 A 32 32 ILE N N 121 124.500 116.788 7.712 1
1 406 . 16 1 1 A 33 33 THR H H 122 9.928 7.431 2.497 1
1 407 . 16 1 1 A 33 33 THR HA H 122 4.048 4.465 -0.417 1
1 412 . 16 1 1 A 33 33 THR C C 122 175.793 174.467 1.326 1
1 413 . 16 1 1 A 33 33 THR CA C 122 62.990 61.492 1.498 1
1 414 . 16 1 1 A 33 33 THR CB C 122 70.300 69.129 1.171 1
1 416 . 16 1 1 A 33 33 THR N N 122 115.136 108.546 6.590 1
1 417 . 16 1 1 A 34 34 LEU H H 123 8.439 7.698 0.741 1
1 418 . 16 1 1 A 34 34 LEU HA H 123 3.912 4.117 -0.205 1
1 428 . 16 1 1 A 34 34 LEU C C 123 175.495 175.468 0.027 1
1 429 . 16 1 1 A 34 34 LEU CA C 123 56.290 55.751 0.539 1
1 430 . 16 1 1 A 34 34 LEU CB C 123 38.500 39.735 -1.235 1
1 434 . 16 1 1 A 34 34 LEU N N 123 117.230 121.190 -3.960 1
1 435 . 16 1 1 A 35 35 GLU H H 124 7.816 7.544 0.272 1
1 436 . 16 1 1 A 35 35 GLU HA H 124 4.634 4.746 -0.112 1
1 441 . 16 1 1 A 35 35 GLU C C 124 174.838 174.062 0.776 1
1 442 . 16 1 1 A 35 35 GLU CA C 124 53.780 54.621 -0.841 1
1 443 . 16 1 1 A 35 35 GLU CB C 124 33.710 32.322 1.388 1
1 445 . 16 1 1 A 35 35 GLU N N 124 116.577 116.459 0.118 1
1 446 . 16 1 1 A 36 36 GLN H H 125 8.532 8.559 -0.027 1
1 447 . 16 1 1 A 36 36 GLN HA H 125 4.958 4.398 0.560 1
1 454 . 16 1 1 A 36 36 GLN CA C 125 53.350 53.770 -0.420 1
1 455 . 16 1 1 A 36 36 GLN CB C 125 29.950 29.907 0.043 1
1 457 . 16 1 1 A 36 36 GLN N N 125 123.034 121.479 1.555 1
1 459 . 16 1 1 A 37 37 PRO HA H 126 4.458 4.444 0.014 1
1 466 . 16 1 1 A 37 37 PRO C C 126 176.314 177.269 -0.955 1
1 467 . 16 1 1 A 37 37 PRO CA C 126 62.816 65.574 -2.758 1
1 468 . 16 1 1 A 37 37 PRO CB C 126 33.070 31.565 1.505 1
1 471 . 16 1 1 A 38 38 GLU H H 127 8.626 7.624 1.002 1
1 472 . 16 1 1 A 38 38 GLU HA H 127 4.274 4.431 -0.157 1
1 477 . 16 1 1 A 38 38 GLU C C 127 177.809 175.048 2.761 1
1 478 . 16 1 1 A 38 38 GLU CA C 127 58.730 58.358 0.372 1
1 479 . 16 1 1 A 38 38 GLU CB C 127 30.340 29.461 0.879 1
1 481 . 16 1 1 A 38 38 GLU N N 127 120.691 118.655 2.036 1
1 482 . 16 1 1 A 39 39 LYS H H 128 7.891 8.003 -0.112 1
1 483 . 16 1 1 A 39 39 LYS HA H 128 4.870 4.874 -0.004 1
1 492 . 16 1 1 A 39 39 LYS C C 128 175.452 176.015 -0.563 1
1 493 . 16 1 1 A 39 39 LYS CA C 128 53.540 54.535 -0.995 1
1 494 . 16 1 1 A 39 39 LYS CB C 128 33.630 34.881 -1.251 1
1 498 . 16 1 1 A 39 39 LYS N N 128 118.149 118.606 -0.457 1
1 499 . 16 1 1 A 40 40 GLY H H 129 8.524 7.998 0.526 1
1 500 . 16 1 1 A 40 40 GLY HA2 H 129 4.973 4.011 0.962 1
1 501 . 16 1 1 A 40 40 GLY HA3 H 129 2.459 4.142 -1.683 1
1 502 . 16 1 1 A 40 40 GLY C C 129 169.943 171.840 -1.897 1
1 503 . 16 1 1 A 40 40 GLY CA C 129 42.910 45.135 -2.225 1
1 504 . 16 1 1 A 40 40 GLY N N 129 112.845 110.367 2.478 1
1 505 . 16 1 1 A 41 41 ILE H H 130 8.659 8.090 0.569 1
1 506 . 16 1 1 A 41 41 ILE HA H 130 4.591 4.786 -0.195 1
1 516 . 16 1 1 A 41 41 ILE C C 130 172.586 174.003 -1.417 1
1 517 . 16 1 1 A 41 41 ILE CA C 130 58.090 59.051 -0.961 1
1 518 . 16 1 1 A 41 41 ILE CB C 130 43.320 41.860 1.460 1
1 522 . 16 1 1 A 41 41 ILE N N 130 114.060 119.424 -5.364 1
1 523 . 16 1 1 A 42 42 PHE H H 131 9.206 8.742 0.464 1
1 524 . 16 1 1 A 42 42 PHE HA H 131 5.159 4.711 0.448 1
1 532 . 16 1 1 A 42 42 PHE C C 131 174.931 175.827 -0.896 1
1 533 . 16 1 1 A 42 42 PHE CA C 131 57.790 58.071 -0.281 1
1 534 . 16 1 1 A 42 42 PHE CB C 131 42.220 38.944 3.276 1
1 538 . 16 1 1 A 42 42 PHE N N 131 126.002 128.439 -2.437 1
1 539 . 16 1 1 A 43 43 VAL H H 132 8.502 8.778 -0.276 1
1 540 . 16 1 1 A 43 43 VAL HA H 132 4.921 4.702 0.219 1
1 548 . 16 1 1 A 43 43 VAL C C 132 178.219 175.278 2.941 1
1 549 . 16 1 1 A 43 43 VAL CA C 132 59.600 60.188 -0.588 1
1 550 . 16 1 1 A 43 43 VAL CB C 132 35.920 35.381 0.539 1
1 553 . 16 1 1 A 43 43 VAL N N 132 119.068 123.215 -4.147 1
1 554 . 16 1 1 A 44 44 LYS H H 133 10.036 8.727 1.309 1
1 555 . 16 1 1 A 44 44 LYS HA H 133 5.070 4.318 0.752 1
1 564 . 16 1 1 A 44 44 LYS C C 133 177.276 177.854 -0.578 1
1 565 . 16 1 1 A 44 44 LYS CA C 133 56.720 57.080 -0.360 1
1 566 . 16 1 1 A 44 44 LYS CB C 133 34.410 32.836 1.574 1
1 570 . 16 1 1 A 44 44 LYS N N 133 130.934 125.625 5.309 1
1 571 . 16 1 1 A 45 45 ASN H H 134 8.093 8.729 -0.636 1
1 572 . 16 1 1 A 45 45 ASN HA H 134 4.152 4.629 -0.477 1
1 577 . 16 1 1 A 45 45 ASN C C 134 174.087 175.025 -0.938 1
1 578 . 16 1 1 A 45 45 ASN CA C 134 55.360 55.878 -0.518 1
1 579 . 16 1 1 A 45 45 ASN CB C 134 37.530 39.049 -1.519 1
1 580 . 16 1 1 A 45 45 ASN N N 134 117.963 122.706 -4.743 1
1 582 . 16 1 1 A 46 46 SER H H 135 7.524 7.728 -0.204 1
1 583 . 16 1 1 A 46 46 SER HA H 135 4.219 4.660 -0.441 1
1 586 . 16 1 1 A 46 46 SER C C 135 174.490 174.270 0.220 1
1 587 . 16 1 1 A 46 46 SER CA C 135 57.090 55.963 1.127 1
1 588 . 16 1 1 A 46 46 SER CB C 135 63.860 66.341 -2.481 1
1 589 . 16 1 1 A 46 46 SER N N 135 105.939 108.508 -2.569 1
1 590 . 16 1 1 A 47 47 ASP H H 136 9.113 9.134 -0.021 1
1 591 . 16 1 1 A 47 47 ASP HA H 136 4.220 4.240 -0.020 1
1 594 . 16 1 1 A 47 47 ASP CA C 136 57.610 57.218 0.392 1
1 595 . 16 1 1 A 47 47 ASP CB C 136 40.810 40.732 0.078 1
1 596 . 16 1 1 A 47 47 ASP N N 136 120.995 123.928 -2.933 1
1 597 . 16 1 1 A 48 48 GLY H H 137 8.181 8.177 0.004 1
1 598 . 16 1 1 A 48 48 GLY HA2 H 137 4.120 3.889 0.231 1
1 599 . 16 1 1 A 48 48 GLY HA3 H 137 3.659 3.891 -0.232 1
1 600 . 16 1 1 A 48 48 GLY C C 137 174.062 173.553 0.509 1
1 601 . 16 1 1 A 48 48 GLY CA C 137 45.130 45.742 -0.612 1
1 602 . 16 1 1 A 48 48 GLY N N 137 106.197 106.485 -0.288 1
1 603 . 16 1 1 A 49 49 SER H H 138 7.179 7.579 -0.400 1
1 604 . 16 1 1 A 49 49 SER HA H 138 4.383 4.879 -0.496 1
1 607 . 16 1 1 A 49 49 SER C C 138 173.864 173.369 0.495 1
1 608 . 16 1 1 A 49 49 SER CA C 138 57.614 57.247 0.367 1
1 609 . 16 1 1 A 49 49 SER CB C 138 65.100 67.182 -2.082 1
1 610 . 16 1 1 A 49 49 SER N N 138 115.015 114.461 0.554 1
1 611 . 16 1 1 A 50 50 ASP H H 139 8.078 8.480 -0.402 1
1 612 . 16 1 1 A 50 50 ASP HA H 139 4.642 4.940 -0.298 1
1 615 . 16 1 1 A 50 50 ASP C C 139 174.261 175.853 -1.592 1
1 616 . 16 1 1 A 50 50 ASP CA C 139 52.406 53.998 -1.592 1
1 617 . 16 1 1 A 50 50 ASP CB C 139 40.254 42.065 -1.811 1
1 618 . 16 1 1 A 50 50 ASP N N 139 122.400 120.548 1.852 1
1 619 . 16 1 1 A 51 51 VAL H H 140 8.111 7.449 0.662 1
1 620 . 16 1 1 A 51 51 VAL HA H 140 4.360 4.309 0.051 1
1 628 . 16 1 1 A 51 51 VAL C C 140 176.147 174.446 1.701 1
1 629 . 16 1 1 A 51 51 VAL CA C 140 62.670 61.599 1.071 1
1 630 . 16 1 1 A 51 51 VAL CB C 140 33.930 32.100 1.830 1
1 632 . 16 1 1 A 51 51 VAL N N 140 120.374 120.648 -0.274 1
1 633 . 16 1 1 A 52 52 CYS H H 141 8.358 9.253 -0.895 1
1 634 . 16 1 1 A 52 52 CYS HA H 141 4.957 5.439 -0.482 1
1 637 . 16 1 1 A 52 52 CYS C C 141 173.070 172.984 0.086 1
1 638 . 16 1 1 A 52 52 CYS CA C 141 53.380 54.463 -1.083 1
1 639 . 16 1 1 A 52 52 CYS CB C 141 46.110 45.319 0.791 1
1 640 . 16 1 1 A 52 52 CYS N N 141 121.305 129.135 -7.830 1
1 641 . 16 1 1 A 53 53 THR H H 142 8.929 8.820 0.109 1
1 642 . 16 1 1 A 53 53 THR HA H 142 4.498 4.955 -0.457 1
1 648 . 16 1 1 A 53 53 THR C C 142 172.151 172.259 -0.108 1
1 649 . 16 1 1 A 53 53 THR CA C 142 62.960 61.169 1.791 1
1 650 . 16 1 1 A 53 53 THR CB C 142 70.540 72.980 -2.440 1
1 652 . 16 1 1 A 53 53 THR N N 142 120.105 119.434 0.671 1
1 653 . 16 1 1 A 54 54 LEU H H 143 8.448 8.833 -0.385 1
1 654 . 16 1 1 A 54 54 LEU HA H 143 4.322 4.794 -0.472 1
1 664 . 16 1 1 A 54 54 LEU C C 143 174.484 174.392 0.092 1
1 665 . 16 1 1 A 54 54 LEU CA C 143 54.596 53.398 1.198 1
1 666 . 16 1 1 A 54 54 LEU CB C 143 42.396 43.722 -1.326 1
1 670 . 16 1 1 A 54 54 LEU N N 143 128.819 128.816 0.003 1
1 671 . 16 1 1 A 55 55 PHE H H 144 8.661 8.697 -0.036 1
1 672 . 16 1 1 A 55 55 PHE HA H 144 5.459 4.993 0.466 1
1 680 . 16 1 1 A 55 55 PHE C C 144 176.035 174.754 1.281 1
1 681 . 16 1 1 A 55 55 PHE CA C 144 55.020 56.593 -1.573 1
1 682 . 16 1 1 A 55 55 PHE CB C 144 44.100 42.486 1.614 1
1 686 . 16 1 1 A 55 55 PHE N N 144 121.897 126.263 -4.366 1
1 687 . 16 1 1 A 56 56 ASP H H 145 11.616 8.545 3.071 1
1 688 . 16 1 1 A 56 56 ASP HA H 145 4.417 4.523 -0.106 1
1 691 . 16 1 1 A 56 56 ASP C C 145 176.748 177.386 -0.638 1
1 692 . 16 1 1 A 56 56 ASP CA C 145 55.844 54.420 1.424 1
1 693 . 16 1 1 A 56 56 ASP CB C 145 44.390 42.263 2.127 1
1 694 . 16 1 1 A 56 56 ASP N N 145 122.131 122.266 -0.135 1
1 695 . 16 1 1 A 57 57 ALA H H 146 8.508 8.916 -0.408 1
1 696 . 16 1 1 A 57 57 ALA HA H 146 3.797 4.031 -0.234 1
1 700 . 16 1 1 A 57 57 ALA C C 146 178.696 180.144 -1.448 1
1 701 . 16 1 1 A 57 57 ALA CA C 146 55.990 55.496 0.494 1
1 702 . 16 1 1 A 57 57 ALA CB C 146 18.840 18.038 0.802 1
1 703 . 16 1 1 A 57 57 ALA N N 146 130.243 129.119 1.124 1
1 704 . 16 1 1 A 58 58 ALA H H 147 8.378 7.909 0.469 1
1 705 . 16 1 1 A 58 58 ALA HA H 147 4.078 4.165 -0.087 1
1 709 . 16 1 1 A 58 58 ALA C C 147 181.091 179.557 1.534 1
1 710 . 16 1 1 A 58 58 ALA CA C 147 54.770 55.122 -0.352 1
1 711 . 16 1 1 A 58 58 ALA CB C 147 17.700 18.588 -0.888 1
1 712 . 16 1 1 A 58 58 ALA N N 147 121.997 119.419 2.578 1
1 713 . 16 1 1 A 59 59 ALA H H 148 9.138 8.023 1.115 1
1 714 . 16 1 1 A 59 59 ALA HA H 148 3.975 4.048 -0.073 1
1 718 . 16 1 1 A 59 59 ALA C C 148 180.508 180.034 0.474 1
1 719 . 16 1 1 A 59 59 ALA CA C 148 54.840 55.030 -0.190 1
1 720 . 16 1 1 A 59 59 ALA CB C 148 18.600 18.580 0.020 1
1 721 . 16 1 1 A 59 59 ALA N N 148 123.595 120.687 2.908 1
1 722 . 16 1 1 A 60 60 PHE H H 149 8.814 8.144 0.670 1
1 723 . 16 1 1 A 60 60 PHE HA H 149 3.722 3.965 -0.243 1
1 731 . 16 1 1 A 60 60 PHE C C 149 176.773 177.502 -0.729 1
1 732 . 16 1 1 A 60 60 PHE CA C 149 62.030 61.446 0.584 1
1 733 . 16 1 1 A 60 60 PHE CB C 149 39.960 38.927 1.033 1
1 737 . 16 1 1 A 60 60 PHE N N 149 120.354 120.024 0.330 1
1 738 . 16 1 1 A 61 61 SER H H 150 8.276 8.106 0.170 1
1 739 . 16 1 1 A 61 61 SER HA H 150 3.880 4.045 -0.165 1
1 742 . 16 1 1 A 61 61 SER C C 150 177.691 176.506 1.185 1
1 743 . 16 1 1 A 61 61 SER CA C 150 62.190 61.489 0.701 1
1 744 . 16 1 1 A 61 61 SER CB C 150 63.016 62.912 0.104 1
1 745 . 16 1 1 A 61 61 SER N N 150 112.086 114.067 -1.981 1
1 746 . 16 1 1 A 62 62 ARG H H 151 7.829 7.853 -0.024 1
1 747 . 16 1 1 A 62 62 ARG HA H 151 3.971 4.076 -0.105 1
1 754 . 16 1 1 A 62 62 ARG C C 151 178.287 178.352 -0.065 1
1 755 . 16 1 1 A 62 62 ARG CA C 151 59.340 59.013 0.327 1
1 756 . 16 1 1 A 62 62 ARG CB C 151 29.760 29.644 0.116 1
1 759 . 16 1 1 A 62 62 ARG N N 151 121.090 119.401 1.689 1
1 760 . 16 1 1 A 63 63 LEU H H 152 7.390 7.627 -0.237 1
1 761 . 16 1 1 A 63 63 LEU HA H 152 3.791 3.905 -0.114 1
1 771 . 16 1 1 A 63 63 LEU C C 152 179.106 178.317 0.789 1
1 772 . 16 1 1 A 63 63 LEU CA C 152 58.900 58.208 0.692 1
1 773 . 16 1 1 A 63 63 LEU CB C 152 41.140 41.463 -0.323 1
1 777 . 16 1 1 A 63 63 LEU N N 152 121.129 122.381 -1.252 1
1 778 . 16 1 1 A 64 64 VAL H H 153 7.552 7.964 -0.412 1
1 779 . 16 1 1 A 64 64 VAL HA H 153 3.411 3.461 -0.050 1
1 787 . 16 1 1 A 64 64 VAL C C 153 180.595 178.026 2.569 1
1 788 . 16 1 1 A 64 64 VAL CA C 153 65.644 66.195 -0.551 1
1 789 . 16 1 1 A 64 64 VAL CB C 153 31.410 31.401 0.009 1
1 792 . 16 1 1 A 64 64 VAL N N 153 118.280 118.879 -0.599 1
1 793 . 16 1 1 A 65 65 GLY H H 154 8.061 8.115 -0.054 1
1 794 . 16 1 1 A 65 65 GLY HA2 H 154 3.846 3.707 0.139 1
1 795 . 16 1 1 A 65 65 GLY HA3 H 154 3.809 3.707 0.102 1
1 796 . 16 1 1 A 65 65 GLY C C 154 175.235 176.020 -0.785 1
1 797 . 16 1 1 A 65 65 GLY CA C 154 46.630 47.148 -0.518 1
1 798 . 16 1 1 A 65 65 GLY N N 154 108.622 107.614 1.008 1
1 799 . 16 1 1 A 66 66 GLU H H 155 7.528 7.539 -0.011 1
1 800 . 16 1 1 A 66 66 GLU HA H 155 4.228 4.177 0.051 1
1 805 . 16 1 1 A 66 66 GLU C C 155 176.761 176.919 -0.158 1
1 806 . 16 1 1 A 66 66 GLU CA C 155 56.590 57.035 -0.445 1
1 807 . 16 1 1 A 66 66 GLU CB C 155 30.490 29.890 0.600 1
1 809 . 16 1 1 A 66 66 GLU N N 155 118.361 119.623 -1.262 1
1 810 . 16 1 1 A 67 67 GLY H H 156 7.884 7.869 0.015 1
1 811 . 16 1 1 A 67 67 GLY HA2 H 156 3.918 3.908 0.010 1
1 812 . 16 1 1 A 67 67 GLY HA3 H 156 3.747 3.923 -0.176 1
1 813 . 16 1 1 A 67 67 GLY C C 156 174.788 174.471 0.317 1
1 814 . 16 1 1 A 67 67 GLY CA C 156 45.890 45.701 0.189 1
1 815 . 16 1 1 A 67 67 GLY N N 156 108.465 107.790 0.675 1
1 816 . 16 1 1 A 68 68 LEU H H 157 7.332 7.784 -0.452 1
1 817 . 16 1 1 A 68 68 LEU HA H 157 4.361 4.633 -0.272 1
1 827 . 16 1 1 A 68 68 LEU CA C 157 53.060 52.211 0.849 1
1 828 . 16 1 1 A 68 68 LEU CB C 157 41.100 41.598 -0.498 1
1 832 . 16 1 1 A 68 68 LEU N N 157 121.920 121.570 0.350 1
1 833 . 16 1 1 A 69 69 PRO HA H 158 4.485 4.549 -0.064 1
1 840 . 16 1 1 A 69 69 PRO C C 158 174.602 176.217 -1.615 1
1 841 . 16 1 1 A 69 69 PRO CA C 158 61.556 62.249 -0.693 1
1 842 . 16 1 1 A 69 69 PRO CB C 158 32.370 32.470 -0.100 1
1 845 . 16 1 1 A 70 70 HIS H H 159 8.734 8.410 0.324 1
1 846 . 16 1 1 A 70 70 HIS HA H 159 3.947 4.475 -0.528 1
1 852 . 16 1 1 A 70 70 HIS CA C 159 56.250 55.251 0.999 1
1 853 . 16 1 1 A 70 70 HIS CB C 159 32.280 30.984 1.296 1
1 856 . 16 1 1 A 70 70 HIS N N 159 119.423 121.790 -2.367 1
1 857 . 16 1 1 A 71 71 PRO HA H 160 4.424 4.201 0.223 1
1 864 . 16 1 1 A 71 71 PRO C C 160 177.567 178.610 -1.043 1
1 865 . 16 1 1 A 71 71 PRO CA C 160 64.574 65.433 -0.859 1
1 866 . 16 1 1 A 71 71 PRO CB C 160 32.340 31.826 0.514 1
1 869 . 16 1 1 A 72 72 LEU H H 161 10.123 7.531 2.592 1
1 870 . 16 1 1 A 72 72 LEU HA H 161 4.778 4.282 0.496 1
1 880 . 16 1 1 A 72 72 LEU C C 161 178.721 177.967 0.754 1
1 881 . 16 1 1 A 72 72 LEU CA C 161 55.800 57.128 -1.328 1
1 882 . 16 1 1 A 72 72 LEU CB C 161 42.440 42.401 0.039 1
1 886 . 16 1 1 A 72 72 LEU N N 161 117.374 117.637 -0.263 1
1 887 . 16 1 1 A 73 73 THR H H 162 7.523 7.764 -0.241 1
1 888 . 16 1 1 A 73 73 THR HA H 162 4.291 4.519 -0.228 1
1 893 . 16 1 1 A 73 73 THR C C 162 175.557 174.362 1.195 1
1 894 . 16 1 1 A 73 73 THR CA C 162 61.440 62.384 -0.944 1
1 895 . 16 1 1 A 73 73 THR CB C 162 70.500 69.820 0.680 1
1 897 . 16 1 1 A 73 73 THR N N 162 107.787 111.554 -3.767 1
1 898 . 16 1 1 A 74 74 ARG H H 163 8.361 7.846 0.515 1
1 899 . 16 1 1 A 74 74 ARG HA H 163 3.836 4.262 -0.426 1
1 906 . 16 1 1 A 74 74 ARG C C 163 174.701 175.221 -0.520 1
1 907 . 16 1 1 A 74 74 ARG CA C 163 57.980 57.346 0.634 1
1 908 . 16 1 1 A 74 74 ARG CB C 163 26.770 26.963 -0.193 1
1 911 . 16 1 1 A 74 74 ARG N N 163 115.130 118.741 -3.611 1
1 912 . 16 1 1 A 75 75 GLU H H 164 7.430 8.110 -0.680 1
1 913 . 16 1 1 A 75 75 GLU HA H 164 4.636 4.448 0.188 1
1 918 . 16 1 1 A 75 75 GLU CA C 164 53.699 55.282 -1.583 1
1 919 . 16 1 1 A 75 75 GLU CB C 164 29.550 28.762 0.788 1
1 921 . 16 1 1 A 75 75 GLU N N 164 120.076 118.764 1.312 1
1 922 . 16 1 1 A 76 76 PRO HA H 165 4.272 4.597 -0.325 1
1 929 . 16 1 1 A 76 76 PRO C C 165 176.649 176.769 -0.120 1
1 930 . 16 1 1 A 76 76 PRO CA C 165 63.204 62.953 0.251 1
1 931 . 16 1 1 A 76 76 PRO CB C 165 31.680 31.553 0.127 1
1 934 . 16 1 1 A 77 77 ILE H H 166 8.812 8.154 0.658 1
1 935 . 16 1 1 A 77 77 ILE HA H 166 3.838 4.314 -0.476 1
1 945 . 16 1 1 A 77 77 ILE C C 166 175.235 175.824 -0.589 1
1 946 . 16 1 1 A 77 77 ILE CA C 166 62.816 61.220 1.596 1
1 947 . 16 1 1 A 77 77 ILE CB C 166 37.750 37.016 0.734 1
1 951 . 16 1 1 A 77 77 ILE N N 166 123.831 124.071 -0.240 1
1 952 . 16 1 1 A 78 78 THR H H 167 6.625 8.602 -1.977 1
1 953 . 16 1 1 A 78 78 THR HA H 167 4.632 5.037 -0.405 1
1 958 . 16 1 1 A 78 78 THR C C 167 174.143 174.595 -0.452 1
1 959 . 16 1 1 A 78 78 THR CA C 167 58.750 59.773 -1.023 1
1 960 . 16 1 1 A 78 78 THR CB C 167 71.320 71.349 -0.029 1
1 962 . 16 1 1 A 78 78 THR N N 167 115.293 119.302 -4.009 1
1 963 . 16 1 1 A 79 79 ALA H H 168 9.088 9.032 0.056 1
1 964 . 16 1 1 A 79 79 ALA HA H 168 3.916 4.102 -0.186 1
1 968 . 16 1 1 A 79 79 ALA C C 168 179.770 179.546 0.224 1
1 969 . 16 1 1 A 79 79 ALA CA C 168 55.480 55.119 0.361 1
1 970 . 16 1 1 A 79 79 ALA CB C 168 17.630 18.348 -0.718 1
1 971 . 16 1 1 A 79 79 ALA N N 168 122.102 127.438 -5.336 1
1 972 . 16 1 1 A 80 80 SER H H 169 7.988 7.580 0.408 1
1 973 . 16 1 1 A 80 80 SER HA H 169 4.091 4.235 -0.144 1
1 976 . 16 1 1 A 80 80 SER C C 169 175.836 176.593 -0.757 1
1 977 . 16 1 1 A 80 80 SER CA C 169 60.750 61.410 -0.660 1
1 978 . 16 1 1 A 80 80 SER CB C 169 62.510 63.018 -0.508 1
1 979 . 16 1 1 A 80 80 SER N N 169 109.660 113.541 -3.881 1
1 980 . 16 1 1 A 81 81 ILE H H 170 7.052 7.682 -0.630 1
1 981 . 16 1 1 A 81 81 ILE HA H 170 4.344 4.115 0.229 1
1 991 . 16 1 1 A 81 81 ILE C C 170 174.236 176.516 -2.280 1
1 992 . 16 1 1 A 81 81 ILE CA C 170 61.760 63.957 -2.197 1
1 993 . 16 1 1 A 81 81 ILE CB C 170 37.950 37.645 0.305 1
1 997 . 16 1 1 A 81 81 ILE N N 170 112.623 114.472 -1.849 1
1 998 . 16 1 1 A 82 82 ILE H H 171 7.345 7.607 -0.262 1
1 999 . 16 1 1 A 82 82 ILE HA H 171 4.288 4.022 0.266 1
1 1009 . 16 1 1 A 82 82 ILE C C 171 174.931 175.508 -0.577 1
1 1010 . 16 1 1 A 82 82 ILE CA C 171 61.420 61.861 -0.441 1
1 1011 . 16 1 1 A 82 82 ILE CB C 171 37.230 37.667 -0.437 1
1 1015 . 16 1 1 A 82 82 ILE N N 171 124.260 124.672 -0.412 1
1 1016 . 16 1 1 A 83 83 VAL H H 172 7.843 8.759 -0.916 1
1 1017 . 16 1 1 A 83 83 VAL HA H 172 4.818 5.133 -0.315 1
1 1025 . 16 1 1 A 83 83 VAL C C 172 174.918 175.380 -0.462 1
1 1026 . 16 1 1 A 83 83 VAL CA C 172 58.910 58.974 -0.064 1
1 1027 . 16 1 1 A 83 83 VAL CB C 172 34.570 35.560 -0.990 1
1 1030 . 16 1 1 A 83 83 VAL N N 172 118.856 121.396 -2.540 1
1 1031 . 16 1 1 A 84 84 LYS H H 173 8.347 8.692 -0.345 1
1 1032 . 16 1 1 A 84 84 LYS HA H 173 4.356 4.765 -0.409 1
1 1041 . 16 1 1 A 84 84 LYS C C 173 178.653 178.479 0.174 1
1 1042 . 16 1 1 A 84 84 LYS CA C 173 56.360 54.766 1.594 1
1 1043 . 16 1 1 A 84 84 LYS CB C 173 33.366 34.643 -1.277 1
1 1047 . 16 1 1 A 84 84 LYS N N 173 119.602 120.917 -1.315 1
1 1048 . 16 1 1 A 85 85 HIS H H 174 9.143 9.021 0.122 1
1 1049 . 16 1 1 A 85 85 HIS HA H 174 4.013 4.168 -0.155 1
1 1053 . 16 1 1 A 85 85 HIS C C 174 176.606 176.981 -0.375 1
1 1054 . 16 1 1 A 85 85 HIS CA C 174 58.820 60.164 -1.344 1
1 1055 . 16 1 1 A 85 85 HIS CB C 174 28.186 29.732 -1.546 1
1 1057 . 16 1 1 A 85 85 HIS N N 174 120.022 122.268 -2.246 1
1 1058 . 16 1 1 A 86 86 GLU H H 175 8.403 8.197 0.206 1
1 1059 . 16 1 1 A 86 86 GLU HA H 175 3.863 3.710 0.153 1
1 1064 . 16 1 1 A 86 86 GLU C C 175 177.040 178.900 -1.860 1
1 1065 . 16 1 1 A 86 86 GLU CA C 175 57.830 60.023 -2.193 1
1 1066 . 16 1 1 A 86 86 GLU CB C 175 28.690 29.235 -0.545 1
1 1068 . 16 1 1 A 86 86 GLU N N 175 116.124 118.394 -2.270 1
1 1069 . 16 1 1 A 87 87 GLU H H 176 7.669 7.979 -0.310 1
1 1070 . 16 1 1 A 87 87 GLU HA H 176 4.039 4.147 -0.108 1
1 1075 . 16 1 1 A 87 87 GLU C C 176 175.688 177.262 -1.574 1
1 1076 . 16 1 1 A 87 87 GLU CA C 176 57.906 59.175 -1.269 1
1 1077 . 16 1 1 A 87 87 GLU CB C 176 30.430 29.000 1.430 1
1 1079 . 16 1 1 A 87 87 GLU N N 176 116.183 119.450 -3.267 1
1 1080 . 16 1 1 A 88 88 CYS H H 177 6.750 7.439 -0.689 1
1 1081 . 16 1 1 A 88 88 CYS HA H 177 4.991 4.523 0.468 1
1 1084 . 16 1 1 A 88 88 CYS C C 177 172.325 173.437 -1.112 1
1 1085 . 16 1 1 A 88 88 CYS CA C 177 55.030 54.316 0.714 1
1 1086 . 16 1 1 A 88 88 CYS CB C 177 45.610 41.939 3.671 1
1 1087 . 16 1 1 A 88 88 CYS N N 177 114.838 116.952 -2.114 1
1 1088 . 16 1 1 A 89 89 ILE H H 178 9.128 8.814 0.314 1
1 1089 . 16 1 1 A 89 89 ILE HA H 178 4.536 4.841 -0.305 1
1 1099 . 16 1 1 A 89 89 ILE C C 178 174.893 174.453 0.440 1
1 1100 . 16 1 1 A 89 89 ILE CA C 178 59.160 59.260 -0.100 1
1 1101 . 16 1 1 A 89 89 ILE CB C 178 41.840 40.802 1.038 1
1 1105 . 16 1 1 A 89 89 ILE N N 178 120.564 121.335 -0.771 1
1 1106 . 16 1 1 A 90 90 TYR H H 179 9.349 9.022 0.327 1
1 1107 . 16 1 1 A 90 90 TYR HA H 179 3.568 4.120 -0.552 1
1 1112 . 16 1 1 A 90 90 TYR C C 179 173.950 173.940 0.010 1
1 1113 . 16 1 1 A 90 90 TYR CA C 179 61.180 57.561 3.619 1
1 1114 . 16 1 1 A 90 90 TYR CB C 179 37.530 38.196 -0.666 1
1 1116 . 16 1 1 A 90 90 TYR N N 179 129.033 126.481 2.552 1
1 1117 . 16 1 1 A 91 91 ASP H H 180 7.367 8.364 -0.997 1
1 1118 . 16 1 1 A 91 91 ASP HA H 180 4.662 4.486 0.176 1
1 1121 . 16 1 1 A 91 91 ASP C C 180 175.291 175.267 0.024 1
1 1122 . 16 1 1 A 91 91 ASP CA C 180 52.230 52.459 -0.229 1
1 1123 . 16 1 1 A 91 91 ASP CB C 180 43.650 40.970 2.680 1
1 1124 . 16 1 1 A 91 91 ASP N N 180 129.305 128.797 0.508 1
1 1125 . 16 1 1 A 92 92 ASP H H 181 8.783 8.479 0.304 1
1 1126 . 16 1 1 A 92 92 ASP HA H 181 4.114 3.526 0.588 1
1 1129 . 16 1 1 A 92 92 ASP C C 181 177.573 177.631 -0.058 1
1 1130 . 16 1 1 A 92 92 ASP CA C 181 56.390 56.987 -0.597 1
1 1131 . 16 1 1 A 92 92 ASP CB C 181 41.330 40.442 0.888 1
1 1132 . 16 1 1 A 92 92 ASP N N 181 125.665 127.333 -1.668 1
1 1133 . 16 1 1 A 93 93 THR H H 182 8.284 7.804 0.480 1
1 1134 . 16 1 1 A 93 93 THR HA H 182 4.037 3.950 0.087 1
1 1139 . 16 1 1 A 93 93 THR C C 182 176.333 176.087 0.246 1
1 1140 . 16 1 1 A 93 93 THR CA C 182 65.320 66.511 -1.191 1
1 1141 . 16 1 1 A 93 93 THR CB C 182 68.560 68.243 0.317 1
1 1143 . 16 1 1 A 93 93 THR N N 182 114.688 115.936 -1.248 1
1 1144 . 16 1 1 A 94 94 ARG H H 183 7.784 7.523 0.261 1
1 1145 . 16 1 1 A 94 94 ARG HA H 183 4.142 4.307 -0.165 1
1 1152 . 16 1 1 A 94 94 ARG C C 183 177.015 176.923 0.092 1
1 1153 . 16 1 1 A 94 94 ARG CA C 183 55.350 55.856 -0.506 1
1 1154 . 16 1 1 A 94 94 ARG CB C 183 30.930 31.096 -0.166 1
1 1157 . 16 1 1 A 94 94 ARG N N 183 120.156 118.455 1.701 1
1 1158 . 16 1 1 A 95 95 GLY H H 184 8.144 9.044 -0.900 1
1 1159 . 16 1 1 A 95 95 GLY HA2 H 184 3.839 3.903 -0.064 1
1 1160 . 16 1 1 A 95 95 GLY HA3 H 184 3.681 3.977 -0.296 1
1 1161 . 16 1 1 A 95 95 GLY C C 184 173.653 173.478 0.175 1
1 1162 . 16 1 1 A 95 95 GLY CA C 184 46.160 45.912 0.248 1
1 1163 . 16 1 1 A 95 95 GLY N N 184 107.879 109.455 -1.576 1
1 1164 . 16 1 1 A 96 96 ASN H H 185 6.855 7.408 -0.553 1
1 1165 . 16 1 1 A 96 96 ASN HA H 185 4.909 5.293 -0.384 1
1 1170 . 16 1 1 A 96 96 ASN C C 185 174.223 173.990 0.233 1
1 1171 . 16 1 1 A 96 96 ASN CA C 185 52.720 51.764 0.956 1
1 1172 . 16 1 1 A 96 96 ASN CB C 185 45.620 42.717 2.903 1
1 1173 . 16 1 1 A 96 96 ASN N N 185 113.382 117.363 -3.981 1
1 1175 . 16 1 1 A 97 97 PHE H H 186 9.228 8.855 0.373 1
1 1176 . 16 1 1 A 97 97 PHE HA H 186 4.579 5.043 -0.464 1
1 1183 . 16 1 1 A 97 97 PHE C C 186 174.794 175.797 -1.003 1
1 1184 . 16 1 1 A 97 97 PHE CA C 186 59.384 58.105 1.279 1
1 1185 . 16 1 1 A 97 97 PHE CB C 186 40.450 40.097 0.353 1
1 1188 . 16 1 1 A 97 97 PHE N N 186 118.661 119.424 -0.763 1
1 1189 . 16 1 1 A 98 98 ILE H H 187 8.908 9.168 -0.260 1
1 1190 . 16 1 1 A 98 98 ILE HA H 187 5.440 5.070 0.370 1
1 1200 . 16 1 1 A 98 98 ILE C C 187 176.171 174.841 1.330 1
1 1201 . 16 1 1 A 98 98 ILE CA C 187 57.610 59.768 -2.158 1
1 1202 . 16 1 1 A 98 98 ILE CB C 187 41.280 41.153 0.127 1
1 1206 . 16 1 1 A 98 98 ILE N N 187 120.585 122.994 -2.409 1
1 1207 . 16 1 1 A 99 99 ILE H H 188 8.602 8.272 0.330 1
1 1208 . 16 1 1 A 99 99 ILE HA H 188 4.546 4.660 -0.114 1
1 1218 . 16 1 1 A 99 99 ILE C C 188 176.668 175.491 1.177 1
1 1219 . 16 1 1 A 99 99 ILE CA C 188 58.920 61.039 -2.119 1
1 1220 . 16 1 1 A 99 99 ILE CB C 188 37.960 38.194 -0.234 1
1 1224 . 16 1 1 A 99 99 ILE N N 188 124.500 125.884 -1.384 1
1 1225 . 16 1 1 A 100 100 LYS H H 189 8.449 8.166 0.283 1
1 1226 . 16 1 1 A 100 100 LYS HA H 189 4.108 4.702 -0.594 1
1 1235 . 16 1 1 A 100 100 LYS C C 189 176.866 176.207 0.659 1
1 1236 . 16 1 1 A 100 100 LYS CA C 189 56.800 55.180 1.620 1
1 1237 . 16 1 1 A 100 100 LYS CB C 189 33.400 34.830 -1.430 1
1 1241 . 16 1 1 A 100 100 LYS N N 189 128.581 127.021 1.560 1
1 1242 . 16 1 1 A 101 101 GLY H H 190 8.381 8.645 -0.264 1
1 1243 . 16 1 1 A 101 101 GLY HA2 H 190 3.946 3.798 0.148 1
1 1244 . 16 1 1 A 101 101 GLY HA3 H 190 3.828 3.800 0.028 1
1 1245 . 16 1 1 A 101 101 GLY C C 190 172.902 175.694 -2.792 1
1 1246 . 16 1 1 A 101 101 GLY CA C 190 44.920 46.744 -1.824 1
1 1247 . 16 1 1 A 101 101 GLY N N 190 111.183 113.758 -2.575 1
1 7 . 17 1 1 A 2 2 GLN H H 91 8.786 8.742 0.044 1
1 8 . 17 1 1 A 2 2 GLN HA H 91 4.005 3.916 0.089 1
1 15 . 17 1 1 A 2 2 GLN C C 91 177.270 177.285 -0.015 1
1 16 . 17 1 1 A 2 2 GLN CA C 91 58.220 59.276 -1.056 1
1 17 . 17 1 1 A 2 2 GLN CB C 91 28.650 28.452 0.198 1
1 19 . 17 1 1 A 2 2 GLN N N 91 121.993 126.798 -4.805 1
1 21 . 17 1 1 A 3 3 GLU H H 92 8.430 8.450 -0.020 1
1 22 . 17 1 1 A 3 3 GLU HA H 92 4.007 4.069 -0.062 1
1 27 . 17 1 1 A 3 3 GLU C C 92 178.287 179.049 -0.762 1
1 28 . 17 1 1 A 3 3 GLU CA C 92 59.490 59.566 -0.076 1
1 29 . 17 1 1 A 3 3 GLU CB C 92 29.506 29.129 0.377 1
1 31 . 17 1 1 A 3 3 GLU N N 92 120.195 119.813 0.382 1
1 32 . 17 1 1 A 4 4 SER H H 93 8.209 7.766 0.443 1
1 33 . 17 1 1 A 4 4 SER HA H 93 4.272 4.230 0.042 1
1 36 . 17 1 1 A 4 4 SER C C 93 177.369 176.646 0.723 1
1 37 . 17 1 1 A 4 4 SER CA C 93 61.044 62.264 -1.220 1
1 38 . 17 1 1 A 4 4 SER CB C 93 62.950 63.005 -0.055 1
1 39 . 17 1 1 A 4 4 SER N N 93 115.524 116.221 -0.697 1
1 40 . 17 1 1 A 5 5 ILE H H 94 8.080 7.763 0.317 1
1 41 . 17 1 1 A 5 5 ILE HA H 94 3.530 3.650 -0.120 1
1 51 . 17 1 1 A 5 5 ILE C C 94 177.778 177.530 0.248 1
1 52 . 17 1 1 A 5 5 ILE CA C 94 65.710 65.245 0.465 1
1 53 . 17 1 1 A 5 5 ILE CB C 94 37.800 37.434 0.366 1
1 57 . 17 1 1 A 5 5 ILE N N 94 124.148 121.647 2.501 1
1 58 . 17 1 1 A 6 6 GLN H H 95 8.374 8.235 0.139 1
1 59 . 17 1 1 A 6 6 GLN HA H 95 4.125 3.935 0.190 1
1 66 . 17 1 1 A 6 6 GLN C C 95 179.726 179.336 0.390 1
1 67 . 17 1 1 A 6 6 GLN CA C 95 59.190 58.991 0.199 1
1 68 . 17 1 1 A 6 6 GLN CB C 95 27.060 28.606 -1.546 1
1 70 . 17 1 1 A 6 6 GLN N N 95 118.257 118.680 -0.423 1
1 72 . 17 1 1 A 7 7 ASN H H 96 8.456 8.228 0.228 1
1 73 . 17 1 1 A 7 7 ASN HA H 96 4.446 4.542 -0.096 1
1 78 . 17 1 1 A 7 7 ASN C C 96 177.257 178.094 -0.837 1
1 79 . 17 1 1 A 7 7 ASN CA C 96 56.020 56.109 -0.089 1
1 80 . 17 1 1 A 7 7 ASN CB C 96 38.126 37.772 0.354 1
1 81 . 17 1 1 A 7 7 ASN N N 96 118.597 118.353 0.244 1
1 83 . 17 1 1 A 8 8 LYS H H 97 7.732 7.846 -0.114 1
1 84 . 17 1 1 A 8 8 LYS HA H 97 4.129 4.173 -0.044 1
1 93 . 17 1 1 A 8 8 LYS C C 97 179.143 179.570 -0.427 1
1 94 . 17 1 1 A 8 8 LYS CA C 97 59.126 59.472 -0.346 1
1 95 . 17 1 1 A 8 8 LYS CB C 97 32.070 32.272 -0.202 1
1 99 . 17 1 1 A 8 8 LYS N N 97 122.381 119.386 2.995 1
1 100 . 17 1 1 A 9 9 ILE H H 98 8.452 8.283 0.169 1
1 101 . 17 1 1 A 9 9 ILE HA H 98 3.480 3.914 -0.434 1
1 111 . 17 1 1 A 9 9 ILE C C 98 177.406 178.568 -1.162 1
1 112 . 17 1 1 A 9 9 ILE CA C 98 66.430 64.559 1.871 1
1 113 . 17 1 1 A 9 9 ILE CB C 98 37.980 37.103 0.877 1
1 117 . 17 1 1 A 9 9 ILE N N 98 119.950 120.597 -0.647 1
1 118 . 17 1 1 A 10 10 SER H H 99 7.924 7.884 0.040 1
1 119 . 17 1 1 A 10 10 SER HA H 99 3.983 4.324 -0.341 1
1 122 . 17 1 1 A 10 10 SER C C 99 176.327 176.151 0.176 1
1 123 . 17 1 1 A 10 10 SER CA C 99 61.990 61.293 0.697 1
1 124 . 17 1 1 A 10 10 SER CB C 99 62.790 63.688 -0.898 1
1 125 . 17 1 1 A 10 10 SER N N 99 113.568 118.675 -5.107 1
1 126 . 17 1 1 A 11 11 GLN H H 100 7.832 7.916 -0.084 1
1 127 . 17 1 1 A 11 11 GLN HA H 100 4.238 4.326 -0.088 1
1 134 . 17 1 1 A 11 11 GLN C C 100 178.088 178.293 -0.205 1
1 135 . 17 1 1 A 11 11 GLN CA C 100 57.900 57.465 0.435 1
1 136 . 17 1 1 A 11 11 GLN CB C 100 29.790 29.669 0.121 1
1 138 . 17 1 1 A 11 11 GLN N N 100 117.487 117.628 -0.141 1
1 140 . 17 1 1 A 12 12 CYS H H 101 7.920 7.821 0.099 1
1 141 . 17 1 1 A 12 12 CYS HA H 101 4.657 4.526 0.131 1
1 144 . 17 1 1 A 12 12 CYS C C 101 175.439 174.539 0.900 1
1 145 . 17 1 1 A 12 12 CYS CA C 101 60.654 59.687 0.967 1
1 146 . 17 1 1 A 12 12 CYS CB C 101 29.310 28.334 0.976 1
1 147 . 17 1 1 A 12 12 CYS N N 101 114.221 118.631 -4.410 1
1 148 . 17 1 1 A 13 13 LYS H H 102 7.993 7.447 0.546 1
1 149 . 17 1 1 A 13 13 LYS HA H 102 5.038 4.453 0.585 1
1 158 . 17 1 1 A 13 13 LYS C C 102 174.757 176.206 -1.449 1
1 159 . 17 1 1 A 13 13 LYS CA C 102 56.660 56.014 0.646 1
1 160 . 17 1 1 A 13 13 LYS CB C 102 32.970 33.428 -0.458 1
1 164 . 17 1 1 A 13 13 LYS N N 102 123.841 118.412 5.429 1
1 165 . 17 1 1 A 14 14 PHE H H 103 8.822 8.568 0.254 1
1 166 . 17 1 1 A 14 14 PHE HA H 103 5.058 5.078 -0.020 1
1 174 . 17 1 1 A 14 14 PHE C C 103 173.560 173.461 0.099 1
1 175 . 17 1 1 A 14 14 PHE CA C 103 55.470 56.003 -0.533 1
1 176 . 17 1 1 A 14 14 PHE CB C 103 41.760 40.313 1.447 1
1 180 . 17 1 1 A 14 14 PHE N N 103 118.421 116.487 1.934 1
1 181 . 17 1 1 A 15 15 SER H H 104 8.826 8.508 0.318 1
1 182 . 17 1 1 A 15 15 SER HA H 104 4.602 4.635 -0.033 1
1 185 . 17 1 1 A 15 15 SER C C 104 173.851 173.617 0.234 1
1 186 . 17 1 1 A 15 15 SER CA C 104 58.610 57.914 0.696 1
1 187 . 17 1 1 A 15 15 SER CB C 104 62.690 62.474 0.216 1
1 188 . 17 1 1 A 15 15 SER N N 104 117.781 114.885 2.896 1
1 189 . 17 1 1 A 16 16 VAL H H 105 7.839 8.294 -0.455 1
1 190 . 17 1 1 A 16 16 VAL HA H 105 3.390 4.381 -0.991 1
1 198 . 17 1 1 A 16 16 VAL C C 105 174.987 175.099 -0.112 1
1 199 . 17 1 1 A 16 16 VAL CA C 105 63.650 62.186 1.464 1
1 200 . 17 1 1 A 16 16 VAL CB C 105 31.410 30.257 1.153 1
1 203 . 17 1 1 A 16 16 VAL N N 105 129.036 126.083 2.953 1
1 204 . 17 1 1 A 17 17 CYS H H 106 8.536 8.105 0.431 1
1 205 . 17 1 1 A 17 17 CYS HA H 106 5.011 4.937 0.074 1
1 208 . 17 1 1 A 17 17 CYS CA C 106 55.260 56.451 -1.191 1
1 209 . 17 1 1 A 17 17 CYS CB C 106 28.210 30.615 -2.405 1
1 210 . 17 1 1 A 17 17 CYS N N 106 130.045 127.153 2.892 1
1 211 . 17 1 1 A 18 18 PRO HA H 107 3.991 4.442 -0.451 1
1 218 . 17 1 1 A 18 18 PRO C C 107 178.188 178.004 0.184 1
1 219 . 17 1 1 A 18 18 PRO CA C 107 65.940 64.544 1.396 1
1 220 . 17 1 1 A 18 18 PRO CB C 107 32.000 32.122 -0.122 1
1 223 . 17 1 1 A 19 19 GLU H H 108 9.260 9.040 0.220 1
1 224 . 17 1 1 A 19 19 GLU HA H 108 4.119 4.086 0.033 1
1 229 . 17 1 1 A 19 19 GLU C C 108 178.721 179.168 -0.447 1
1 230 . 17 1 1 A 19 19 GLU CA C 108 59.300 59.503 -0.203 1
1 231 . 17 1 1 A 19 19 GLU CB C 108 28.920 29.061 -0.141 1
1 233 . 17 1 1 A 19 19 GLU N N 108 118.270 116.259 2.011 1
1 234 . 17 1 1 A 20 20 ARG H H 109 7.672 7.672 0.000 1
1 235 . 17 1 1 A 20 20 ARG HA H 109 4.331 4.145 0.186 1
1 242 . 17 1 1 A 20 20 ARG C C 109 177.977 178.487 -0.510 1
1 243 . 17 1 1 A 20 20 ARG CA C 109 57.350 59.247 -1.897 1
1 244 . 17 1 1 A 20 20 ARG CB C 109 30.820 30.684 0.136 1
1 247 . 17 1 1 A 20 20 ARG N N 109 118.357 119.892 -1.535 1
1 248 . 17 1 1 A 21 21 LEU H H 110 7.601 7.726 -0.125 1
1 249 . 17 1 1 A 21 21 LEU HA H 110 4.380 4.349 0.031 1
1 259 . 17 1 1 A 21 21 LEU C C 110 176.562 176.323 0.239 1
1 260 . 17 1 1 A 21 21 LEU CA C 110 56.096 55.502 0.594 1
1 261 . 17 1 1 A 21 21 LEU CB C 110 44.016 42.315 1.701 1
1 265 . 17 1 1 A 21 21 LEU N N 110 118.626 118.974 -0.348 1
1 266 . 17 1 1 A 22 22 GLN H H 111 7.750 7.920 -0.170 1
1 267 . 17 1 1 A 22 22 GLN HA H 111 3.870 4.023 -0.153 1
1 274 . 17 1 1 A 22 22 GLN C C 111 173.336 174.797 -1.461 1
1 275 . 17 1 1 A 22 22 GLN CA C 111 56.510 57.687 -1.177 1
1 276 . 17 1 1 A 22 22 GLN CB C 111 26.800 26.531 0.269 1
1 278 . 17 1 1 A 22 22 GLN N N 111 113.926 115.665 -1.739 1
1 280 . 17 1 1 A 23 23 CYS H H 112 7.407 7.887 -0.480 1
1 281 . 17 1 1 A 23 23 CYS HA H 112 4.469 4.845 -0.376 1
1 284 . 17 1 1 A 23 23 CYS CA C 112 52.650 57.521 -4.871 1
1 285 . 17 1 1 A 23 23 CYS CB C 112 29.750 28.193 1.557 1
1 286 . 17 1 1 A 23 23 CYS N N 112 112.681 118.363 -5.682 1
1 287 . 17 1 1 A 24 24 PRO HA H 113 4.408 4.461 -0.053 1
1 294 . 17 1 1 A 24 24 PRO C C 113 178.175 177.414 0.761 1
1 295 . 17 1 1 A 24 24 PRO CA C 113 62.040 62.539 -0.499 1
1 296 . 17 1 1 A 24 24 PRO CB C 113 31.920 32.899 -0.979 1
1 299 . 17 1 1 A 25 25 LEU H H 114 8.593 8.825 -0.232 1
1 300 . 17 1 1 A 25 25 LEU HA H 114 3.765 4.060 -0.295 1
1 310 . 17 1 1 A 25 25 LEU C C 114 179.950 178.707 1.243 1
1 311 . 17 1 1 A 25 25 LEU CA C 114 57.674 57.920 -0.246 1
1 312 . 17 1 1 A 25 25 LEU CB C 114 40.690 41.450 -0.760 1
1 316 . 17 1 1 A 25 25 LEU N N 114 123.729 123.714 0.015 1
1 317 . 17 1 1 A 26 26 GLU H H 115 9.108 8.503 0.605 1
1 318 . 17 1 1 A 26 26 GLU HA H 115 3.876 3.955 -0.079 1
1 323 . 17 1 1 A 26 26 GLU C C 115 177.505 178.949 -1.444 1
1 324 . 17 1 1 A 26 26 GLU CA C 115 59.410 59.621 -0.211 1
1 325 . 17 1 1 A 26 26 GLU CB C 115 28.460 29.207 -0.747 1
1 327 . 17 1 1 A 26 26 GLU N N 115 116.817 118.006 -1.189 1
1 328 . 17 1 1 A 27 27 ALA H H 116 7.360 7.866 -0.506 1
1 329 . 17 1 1 A 27 27 ALA HA H 116 4.408 3.661 0.747 1
1 333 . 17 1 1 A 27 27 ALA C C 116 177.046 178.582 -1.536 1
1 334 . 17 1 1 A 27 27 ALA CA C 116 52.970 54.576 -1.606 1
1 335 . 17 1 1 A 27 27 ALA CB C 116 19.916 17.882 2.034 1
1 336 . 17 1 1 A 27 27 ALA N N 116 118.966 121.795 -2.829 1
1 337 . 17 1 1 A 28 28 ILE H H 117 7.168 7.145 0.023 1
1 338 . 17 1 1 A 28 28 ILE HA H 117 4.432 4.654 -0.222 1
1 348 . 17 1 1 A 28 28 ILE C C 117 172.641 175.652 -3.011 1
1 349 . 17 1 1 A 28 28 ILE CA C 117 59.980 60.641 -0.661 1
1 350 . 17 1 1 A 28 28 ILE CB C 117 37.350 37.840 -0.490 1
1 354 . 17 1 1 A 28 28 ILE N N 117 108.913 109.097 -0.184 1
1 355 . 17 1 1 A 29 29 GLN H H 118 6.562 7.337 -0.775 1
1 356 . 17 1 1 A 29 29 GLN HA H 118 3.922 4.190 -0.268 1
1 363 . 17 1 1 A 29 29 GLN C C 118 175.049 175.449 -0.400 1
1 364 . 17 1 1 A 29 29 GLN CA C 118 54.596 56.044 -1.448 1
1 365 . 17 1 1 A 29 29 GLN CB C 118 29.570 29.013 0.557 1
1 367 . 17 1 1 A 29 29 GLN N N 118 116.455 123.011 -6.556 1
1 369 . 17 1 1 A 30 30 CYS H H 119 8.138 8.410 -0.272 1
1 370 . 17 1 1 A 30 30 CYS HA H 119 4.580 4.503 0.077 1
1 373 . 17 1 1 A 30 30 CYS CA C 119 57.810 57.482 0.328 1
1 374 . 17 1 1 A 30 30 CYS CB C 119 30.200 28.823 1.377 1
1 375 . 17 1 1 A 30 30 CYS N N 119 134.136 125.186 8.950 1
1 376 . 17 1 1 A 31 31 PRO HA H 120 4.424 4.462 -0.038 1
1 383 . 17 1 1 A 31 31 PRO C C 120 177.431 178.313 -0.882 1
1 384 . 17 1 1 A 31 31 PRO CA C 120 64.060 64.393 -0.333 1
1 385 . 17 1 1 A 31 31 PRO CB C 120 32.776 32.096 0.680 1
1 388 . 17 1 1 A 32 32 ILE H H 121 11.318 7.181 4.137 1
1 389 . 17 1 1 A 32 32 ILE HA H 121 4.038 3.968 0.070 1
1 399 . 17 1 1 A 32 32 ILE C C 121 178.485 177.758 0.727 1
1 400 . 17 1 1 A 32 32 ILE CA C 121 64.060 64.119 -0.059 1
1 401 . 17 1 1 A 32 32 ILE CB C 121 39.340 38.523 0.817 1
1 405 . 17 1 1 A 32 32 ILE N N 121 124.500 116.766 7.734 1
1 406 . 17 1 1 A 33 33 THR H H 122 9.928 7.413 2.515 1
1 407 . 17 1 1 A 33 33 THR HA H 122 4.048 4.481 -0.433 1
1 412 . 17 1 1 A 33 33 THR C C 122 175.793 174.384 1.409 1
1 413 . 17 1 1 A 33 33 THR CA C 122 62.990 61.348 1.642 1
1 414 . 17 1 1 A 33 33 THR CB C 122 70.300 69.028 1.272 1
1 416 . 17 1 1 A 33 33 THR N N 122 115.136 108.633 6.503 1
1 417 . 17 1 1 A 34 34 LEU H H 123 8.439 7.818 0.621 1
1 418 . 17 1 1 A 34 34 LEU HA H 123 3.912 4.008 -0.096 1
1 428 . 17 1 1 A 34 34 LEU C C 123 175.495 175.504 -0.009 1
1 429 . 17 1 1 A 34 34 LEU CA C 123 56.290 55.986 0.304 1
1 430 . 17 1 1 A 34 34 LEU CB C 123 38.500 39.729 -1.229 1
1 434 . 17 1 1 A 34 34 LEU N N 123 117.230 121.058 -3.828 1
1 435 . 17 1 1 A 35 35 GLU H H 124 7.816 7.497 0.319 1
1 436 . 17 1 1 A 35 35 GLU HA H 124 4.634 4.707 -0.073 1
1 441 . 17 1 1 A 35 35 GLU C C 124 174.838 174.149 0.689 1
1 442 . 17 1 1 A 35 35 GLU CA C 124 53.780 54.676 -0.896 1
1 443 . 17 1 1 A 35 35 GLU CB C 124 33.710 32.305 1.405 1
1 445 . 17 1 1 A 35 35 GLU N N 124 116.577 116.507 0.070 1
1 446 . 17 1 1 A 36 36 GLN H H 125 8.532 8.577 -0.045 1
1 447 . 17 1 1 A 36 36 GLN HA H 125 4.958 4.377 0.581 1
1 454 . 17 1 1 A 36 36 GLN CA C 125 53.350 53.896 -0.546 1
1 455 . 17 1 1 A 36 36 GLN CB C 125 29.950 29.955 -0.005 1
1 457 . 17 1 1 A 36 36 GLN N N 125 123.034 121.505 1.529 1
1 459 . 17 1 1 A 37 37 PRO HA H 126 4.458 4.475 -0.017 1
1 466 . 17 1 1 A 37 37 PRO C C 126 176.314 177.332 -1.018 1
1 467 . 17 1 1 A 37 37 PRO CA C 126 62.816 65.771 -2.955 1
1 468 . 17 1 1 A 37 37 PRO CB C 126 33.070 31.596 1.474 1
1 471 . 17 1 1 A 38 38 GLU H H 127 8.626 7.676 0.950 1
1 472 . 17 1 1 A 38 38 GLU HA H 127 4.274 4.557 -0.283 1
1 477 . 17 1 1 A 38 38 GLU C C 127 177.809 174.966 2.843 1
1 478 . 17 1 1 A 38 38 GLU CA C 127 58.730 58.294 0.436 1
1 479 . 17 1 1 A 38 38 GLU CB C 127 30.340 29.444 0.896 1
1 481 . 17 1 1 A 38 38 GLU N N 127 120.691 119.278 1.413 1
1 482 . 17 1 1 A 39 39 LYS H H 128 7.891 7.801 0.090 1
1 483 . 17 1 1 A 39 39 LYS HA H 128 4.870 4.701 0.169 1
1 492 . 17 1 1 A 39 39 LYS C C 128 175.452 175.690 -0.238 1
1 493 . 17 1 1 A 39 39 LYS CA C 128 53.540 54.718 -1.178 1
1 494 . 17 1 1 A 39 39 LYS CB C 128 33.630 34.573 -0.943 1
1 498 . 17 1 1 A 39 39 LYS N N 128 118.149 118.013 0.136 1
1 499 . 17 1 1 A 40 40 GLY H H 129 8.524 7.958 0.566 1
1 500 . 17 1 1 A 40 40 GLY HA2 H 129 4.973 4.047 0.926 1
1 501 . 17 1 1 A 40 40 GLY HA3 H 129 2.459 4.175 -1.716 1
1 502 . 17 1 1 A 40 40 GLY C C 129 169.943 171.868 -1.925 1
1 503 . 17 1 1 A 40 40 GLY CA C 129 42.910 44.987 -2.077 1
1 504 . 17 1 1 A 40 40 GLY N N 129 112.845 110.434 2.411 1
1 505 . 17 1 1 A 41 41 ILE H H 130 8.659 8.173 0.486 1
1 506 . 17 1 1 A 41 41 ILE HA H 130 4.591 4.746 -0.155 1
1 516 . 17 1 1 A 41 41 ILE C C 130 172.586 173.991 -1.405 1
1 517 . 17 1 1 A 41 41 ILE CA C 130 58.090 59.155 -1.065 1
1 518 . 17 1 1 A 41 41 ILE CB C 130 43.320 42.019 1.301 1
1 522 . 17 1 1 A 41 41 ILE N N 130 114.060 119.382 -5.322 1
1 523 . 17 1 1 A 42 42 PHE H H 131 9.206 8.737 0.469 1
1 524 . 17 1 1 A 42 42 PHE HA H 131 5.159 4.666 0.493 1
1 532 . 17 1 1 A 42 42 PHE C C 131 174.931 175.812 -0.881 1
1 533 . 17 1 1 A 42 42 PHE CA C 131 57.790 58.309 -0.519 1
1 534 . 17 1 1 A 42 42 PHE CB C 131 42.220 39.352 2.868 1
1 538 . 17 1 1 A 42 42 PHE N N 131 126.002 128.225 -2.223 1
1 539 . 17 1 1 A 43 43 VAL H H 132 8.502 8.949 -0.447 1
1 540 . 17 1 1 A 43 43 VAL HA H 132 4.921 4.748 0.173 1
1 548 . 17 1 1 A 43 43 VAL C C 132 178.219 175.510 2.709 1
1 549 . 17 1 1 A 43 43 VAL CA C 132 59.600 59.967 -0.367 1
1 550 . 17 1 1 A 43 43 VAL CB C 132 35.920 35.778 0.142 1
1 553 . 17 1 1 A 43 43 VAL N N 132 119.068 122.690 -3.622 1
1 554 . 17 1 1 A 44 44 LYS H H 133 10.036 8.784 1.252 1
1 555 . 17 1 1 A 44 44 LYS HA H 133 5.070 4.349 0.721 1
1 564 . 17 1 1 A 44 44 LYS C C 133 177.276 177.985 -0.709 1
1 565 . 17 1 1 A 44 44 LYS CA C 133 56.720 56.893 -0.173 1
1 566 . 17 1 1 A 44 44 LYS CB C 133 34.410 32.962 1.448 1
1 570 . 17 1 1 A 44 44 LYS N N 133 130.934 125.066 5.868 1
1 571 . 17 1 1 A 45 45 ASN H H 134 8.093 8.807 -0.714 1
1 572 . 17 1 1 A 45 45 ASN HA H 134 4.152 4.550 -0.398 1
1 577 . 17 1 1 A 45 45 ASN C C 134 174.087 175.001 -0.914 1
1 578 . 17 1 1 A 45 45 ASN CA C 134 55.360 55.837 -0.477 1
1 579 . 17 1 1 A 45 45 ASN CB C 134 37.530 39.160 -1.630 1
1 580 . 17 1 1 A 45 45 ASN N N 134 117.963 121.935 -3.972 1
1 582 . 17 1 1 A 46 46 SER H H 135 7.524 7.866 -0.342 1
1 583 . 17 1 1 A 46 46 SER HA H 135 4.219 4.627 -0.408 1
1 586 . 17 1 1 A 46 46 SER C C 135 174.490 174.123 0.367 1
1 587 . 17 1 1 A 46 46 SER CA C 135 57.090 56.282 0.808 1
1 588 . 17 1 1 A 46 46 SER CB C 135 63.860 65.954 -2.094 1
1 589 . 17 1 1 A 46 46 SER N N 135 105.939 108.701 -2.762 1
1 590 . 17 1 1 A 47 47 ASP H H 136 9.113 8.790 0.323 1
1 591 . 17 1 1 A 47 47 ASP HA H 136 4.220 4.345 -0.125 1
1 594 . 17 1 1 A 47 47 ASP CA C 136 57.610 57.158 0.452 1
1 595 . 17 1 1 A 47 47 ASP CB C 136 40.810 40.575 0.235 1
1 596 . 17 1 1 A 47 47 ASP N N 136 120.995 122.394 -1.399 1
1 597 . 17 1 1 A 48 48 GLY H H 137 8.181 8.183 -0.002 1
1 598 . 17 1 1 A 48 48 GLY HA2 H 137 4.120 3.891 0.229 1
1 599 . 17 1 1 A 48 48 GLY HA3 H 137 3.659 3.892 -0.233 1
1 600 . 17 1 1 A 48 48 GLY C C 137 174.062 173.092 0.970 1
1 601 . 17 1 1 A 48 48 GLY CA C 137 45.130 45.701 -0.571 1
1 602 . 17 1 1 A 48 48 GLY N N 137 106.197 106.254 -0.057 1
1 603 . 17 1 1 A 49 49 SER H H 138 7.179 7.564 -0.385 1
1 604 . 17 1 1 A 49 49 SER HA H 138 4.383 4.963 -0.580 1
1 607 . 17 1 1 A 49 49 SER C C 138 173.864 173.434 0.430 1
1 608 . 17 1 1 A 49 49 SER CA C 138 57.614 57.477 0.137 1
1 609 . 17 1 1 A 49 49 SER CB C 138 65.100 65.919 -0.819 1
1 610 . 17 1 1 A 49 49 SER N N 138 115.015 114.443 0.572 1
1 611 . 17 1 1 A 50 50 ASP H H 139 8.078 8.518 -0.440 1
1 612 . 17 1 1 A 50 50 ASP HA H 139 4.642 4.745 -0.103 1
1 615 . 17 1 1 A 50 50 ASP C C 139 174.261 175.174 -0.913 1
1 616 . 17 1 1 A 50 50 ASP CA C 139 52.406 54.161 -1.755 1
1 617 . 17 1 1 A 50 50 ASP CB C 139 40.254 40.522 -0.268 1
1 618 . 17 1 1 A 50 50 ASP N N 139 122.400 125.731 -3.331 1
1 619 . 17 1 1 A 51 51 VAL H H 140 8.111 7.556 0.555 1
1 620 . 17 1 1 A 51 51 VAL HA H 140 4.360 4.586 -0.226 1
1 628 . 17 1 1 A 51 51 VAL C C 140 176.147 174.110 2.037 1
1 629 . 17 1 1 A 51 51 VAL CA C 140 62.670 60.841 1.829 1
1 630 . 17 1 1 A 51 51 VAL CB C 140 33.930 33.569 0.361 1
1 632 . 17 1 1 A 51 51 VAL N N 140 120.374 119.632 0.742 1
1 633 . 17 1 1 A 52 52 CYS H H 141 8.358 9.164 -0.806 1
1 634 . 17 1 1 A 52 52 CYS HA H 141 4.957 5.401 -0.444 1
1 637 . 17 1 1 A 52 52 CYS C C 141 173.070 173.203 -0.133 1
1 638 . 17 1 1 A 52 52 CYS CA C 141 53.380 54.842 -1.462 1
1 639 . 17 1 1 A 52 52 CYS CB C 141 46.110 44.890 1.220 1
1 640 . 17 1 1 A 52 52 CYS N N 141 121.305 129.164 -7.859 1
1 641 . 17 1 1 A 53 53 THR H H 142 8.929 8.672 0.257 1
1 642 . 17 1 1 A 53 53 THR HA H 142 4.498 4.965 -0.467 1
1 648 . 17 1 1 A 53 53 THR C C 142 172.151 172.119 0.032 1
1 649 . 17 1 1 A 53 53 THR CA C 142 62.960 61.130 1.830 1
1 650 . 17 1 1 A 53 53 THR CB C 142 70.540 72.762 -2.222 1
1 652 . 17 1 1 A 53 53 THR N N 142 120.105 118.945 1.160 1
1 653 . 17 1 1 A 54 54 LEU H H 143 8.448 8.658 -0.210 1
1 654 . 17 1 1 A 54 54 LEU HA H 143 4.322 4.683 -0.361 1
1 664 . 17 1 1 A 54 54 LEU C C 143 174.484 174.381 0.103 1
1 665 . 17 1 1 A 54 54 LEU CA C 143 54.596 53.313 1.283 1
1 666 . 17 1 1 A 54 54 LEU CB C 143 42.396 43.746 -1.350 1
1 670 . 17 1 1 A 54 54 LEU N N 143 128.819 128.130 0.689 1
1 671 . 17 1 1 A 55 55 PHE H H 144 8.661 8.773 -0.112 1
1 672 . 17 1 1 A 55 55 PHE HA H 144 5.459 4.999 0.460 1
1 680 . 17 1 1 A 55 55 PHE C C 144 176.035 174.690 1.345 1
1 681 . 17 1 1 A 55 55 PHE CA C 144 55.020 56.528 -1.508 1
1 682 . 17 1 1 A 55 55 PHE CB C 144 44.100 42.807 1.293 1
1 686 . 17 1 1 A 55 55 PHE N N 144 121.897 125.701 -3.804 1
1 687 . 17 1 1 A 56 56 ASP H H 145 11.616 8.539 3.077 1
1 688 . 17 1 1 A 56 56 ASP HA H 145 4.417 4.635 -0.218 1
1 691 . 17 1 1 A 56 56 ASP C C 145 176.748 177.332 -0.584 1
1 692 . 17 1 1 A 56 56 ASP CA C 145 55.844 54.153 1.691 1
1 693 . 17 1 1 A 56 56 ASP CB C 145 44.390 43.146 1.244 1
1 694 . 17 1 1 A 56 56 ASP N N 145 122.131 122.005 0.126 1
1 695 . 17 1 1 A 57 57 ALA H H 146 8.508 8.960 -0.452 1
1 696 . 17 1 1 A 57 57 ALA HA H 146 3.797 4.068 -0.271 1
1 700 . 17 1 1 A 57 57 ALA C C 146 178.696 180.029 -1.333 1
1 701 . 17 1 1 A 57 57 ALA CA C 146 55.990 55.320 0.670 1
1 702 . 17 1 1 A 57 57 ALA CB C 146 18.840 18.080 0.760 1
1 703 . 17 1 1 A 57 57 ALA N N 146 130.243 128.594 1.649 1
1 704 . 17 1 1 A 58 58 ALA H H 147 8.378 7.816 0.562 1
1 705 . 17 1 1 A 58 58 ALA HA H 147 4.078 4.167 -0.089 1
1 709 . 17 1 1 A 58 58 ALA C C 147 181.091 179.659 1.432 1
1 710 . 17 1 1 A 58 58 ALA CA C 147 54.770 54.844 -0.074 1
1 711 . 17 1 1 A 58 58 ALA CB C 147 17.700 18.344 -0.644 1
1 712 . 17 1 1 A 58 58 ALA N N 147 121.997 119.745 2.252 1
1 713 . 17 1 1 A 59 59 ALA H H 148 9.138 8.002 1.136 1
1 714 . 17 1 1 A 59 59 ALA HA H 148 3.975 4.086 -0.111 1
1 718 . 17 1 1 A 59 59 ALA C C 148 180.508 179.701 0.807 1
1 719 . 17 1 1 A 59 59 ALA CA C 148 54.840 55.025 -0.185 1
1 720 . 17 1 1 A 59 59 ALA CB C 148 18.600 18.671 -0.071 1
1 721 . 17 1 1 A 59 59 ALA N N 148 123.595 120.493 3.102 1
1 722 . 17 1 1 A 60 60 PHE H H 149 8.814 8.075 0.739 1
1 723 . 17 1 1 A 60 60 PHE HA H 149 3.722 4.056 -0.334 1
1 731 . 17 1 1 A 60 60 PHE C C 149 176.773 177.605 -0.832 1
1 732 . 17 1 1 A 60 60 PHE CA C 149 62.030 61.482 0.548 1
1 733 . 17 1 1 A 60 60 PHE CB C 149 39.960 38.689 1.271 1
1 737 . 17 1 1 A 60 60 PHE N N 149 120.354 119.939 0.415 1
1 738 . 17 1 1 A 61 61 SER H H 150 8.276 8.117 0.159 1
1 739 . 17 1 1 A 61 61 SER HA H 150 3.880 4.090 -0.210 1
1 742 . 17 1 1 A 61 61 SER C C 150 177.691 176.581 1.110 1
1 743 . 17 1 1 A 61 61 SER CA C 150 62.190 61.486 0.704 1
1 744 . 17 1 1 A 61 61 SER CB C 150 63.016 62.901 0.115 1
1 745 . 17 1 1 A 61 61 SER N N 150 112.086 114.066 -1.980 1
1 746 . 17 1 1 A 62 62 ARG H H 151 7.829 7.746 0.083 1
1 747 . 17 1 1 A 62 62 ARG HA H 151 3.971 4.029 -0.058 1
1 754 . 17 1 1 A 62 62 ARG C C 151 178.287 178.385 -0.098 1
1 755 . 17 1 1 A 62 62 ARG CA C 151 59.340 58.899 0.441 1
1 756 . 17 1 1 A 62 62 ARG CB C 151 29.760 29.784 -0.024 1
1 759 . 17 1 1 A 62 62 ARG N N 151 121.090 119.249 1.841 1
1 760 . 17 1 1 A 63 63 LEU H H 152 7.390 7.636 -0.246 1
1 761 . 17 1 1 A 63 63 LEU HA H 152 3.791 3.902 -0.111 1
1 771 . 17 1 1 A 63 63 LEU C C 152 179.106 178.277 0.829 1
1 772 . 17 1 1 A 63 63 LEU CA C 152 58.900 58.176 0.724 1
1 773 . 17 1 1 A 63 63 LEU CB C 152 41.140 41.417 -0.277 1
1 777 . 17 1 1 A 63 63 LEU N N 152 121.129 122.172 -1.043 1
1 778 . 17 1 1 A 64 64 VAL H H 153 7.552 7.893 -0.341 1
1 779 . 17 1 1 A 64 64 VAL HA H 153 3.411 3.499 -0.088 1
1 787 . 17 1 1 A 64 64 VAL C C 153 180.595 178.307 2.288 1
1 788 . 17 1 1 A 64 64 VAL CA C 153 65.644 66.076 -0.432 1
1 789 . 17 1 1 A 64 64 VAL CB C 153 31.410 31.321 0.089 1
1 792 . 17 1 1 A 64 64 VAL N N 153 118.280 118.779 -0.499 1
1 793 . 17 1 1 A 65 65 GLY H H 154 8.061 8.294 -0.233 1
1 794 . 17 1 1 A 65 65 GLY HA2 H 154 3.846 3.710 0.136 1
1 795 . 17 1 1 A 65 65 GLY HA3 H 154 3.809 3.712 0.097 1
1 796 . 17 1 1 A 65 65 GLY C C 154 175.235 176.287 -1.052 1
1 797 . 17 1 1 A 65 65 GLY CA C 154 46.630 47.199 -0.569 1
1 798 . 17 1 1 A 65 65 GLY N N 154 108.622 107.440 1.182 1
1 799 . 17 1 1 A 66 66 GLU H H 155 7.528 7.673 -0.145 1
1 800 . 17 1 1 A 66 66 GLU HA H 155 4.228 4.238 -0.010 1
1 805 . 17 1 1 A 66 66 GLU C C 155 176.761 177.245 -0.484 1
1 806 . 17 1 1 A 66 66 GLU CA C 155 56.590 56.722 -0.132 1
1 807 . 17 1 1 A 66 66 GLU CB C 155 30.490 30.076 0.414 1
1 809 . 17 1 1 A 66 66 GLU N N 155 118.361 120.025 -1.664 1
1 810 . 17 1 1 A 67 67 GLY H H 156 7.884 7.428 0.456 1
1 811 . 17 1 1 A 67 67 GLY HA2 H 156 3.918 3.848 0.070 1
1 812 . 17 1 1 A 67 67 GLY HA3 H 156 3.747 3.866 -0.119 1
1 813 . 17 1 1 A 67 67 GLY C C 156 174.788 174.791 -0.003 1
1 814 . 17 1 1 A 67 67 GLY CA C 156 45.890 46.035 -0.145 1
1 815 . 17 1 1 A 67 67 GLY N N 156 108.465 108.204 0.261 1
1 816 . 17 1 1 A 68 68 LEU H H 157 7.332 8.063 -0.731 1
1 817 . 17 1 1 A 68 68 LEU HA H 157 4.361 4.527 -0.166 1
1 827 . 17 1 1 A 68 68 LEU CA C 157 53.060 52.329 0.731 1
1 828 . 17 1 1 A 68 68 LEU CB C 157 41.100 41.521 -0.421 1
1 832 . 17 1 1 A 68 68 LEU N N 157 121.920 121.582 0.338 1
1 833 . 17 1 1 A 69 69 PRO HA H 158 4.485 4.555 -0.070 1
1 840 . 17 1 1 A 69 69 PRO C C 158 174.602 176.384 -1.782 1
1 841 . 17 1 1 A 69 69 PRO CA C 158 61.556 62.272 -0.716 1
1 842 . 17 1 1 A 69 69 PRO CB C 158 32.370 32.425 -0.055 1
1 845 . 17 1 1 A 70 70 HIS H H 159 8.734 8.569 0.165 1
1 846 . 17 1 1 A 70 70 HIS HA H 159 3.947 4.425 -0.478 1
1 852 . 17 1 1 A 70 70 HIS CA C 159 56.250 55.225 1.025 1
1 853 . 17 1 1 A 70 70 HIS CB C 159 32.280 30.962 1.318 1
1 856 . 17 1 1 A 70 70 HIS N N 159 119.423 121.824 -2.401 1
1 857 . 17 1 1 A 71 71 PRO HA H 160 4.424 4.167 0.257 1
1 864 . 17 1 1 A 71 71 PRO C C 160 177.567 178.470 -0.903 1
1 865 . 17 1 1 A 71 71 PRO CA C 160 64.574 65.268 -0.694 1
1 866 . 17 1 1 A 71 71 PRO CB C 160 32.340 31.826 0.514 1
1 869 . 17 1 1 A 72 72 LEU H H 161 10.123 7.321 2.802 1
1 870 . 17 1 1 A 72 72 LEU HA H 161 4.778 4.302 0.476 1
1 880 . 17 1 1 A 72 72 LEU C C 161 178.721 178.265 0.456 1
1 881 . 17 1 1 A 72 72 LEU CA C 161 55.800 57.019 -1.219 1
1 882 . 17 1 1 A 72 72 LEU CB C 161 42.440 42.135 0.305 1
1 886 . 17 1 1 A 72 72 LEU N N 161 117.374 117.448 -0.074 1
1 887 . 17 1 1 A 73 73 THR H H 162 7.523 7.799 -0.276 1
1 888 . 17 1 1 A 73 73 THR HA H 162 4.291 4.543 -0.252 1
1 893 . 17 1 1 A 73 73 THR C C 162 175.557 174.251 1.306 1
1 894 . 17 1 1 A 73 73 THR CA C 162 61.440 62.647 -1.207 1
1 895 . 17 1 1 A 73 73 THR CB C 162 70.500 69.346 1.154 1
1 897 . 17 1 1 A 73 73 THR N N 162 107.787 111.863 -4.076 1
1 898 . 17 1 1 A 74 74 ARG H H 163 8.361 7.916 0.445 1
1 899 . 17 1 1 A 74 74 ARG HA H 163 3.836 4.145 -0.309 1
1 906 . 17 1 1 A 74 74 ARG C C 163 174.701 175.344 -0.643 1
1 907 . 17 1 1 A 74 74 ARG CA C 163 57.980 57.660 0.320 1
1 908 . 17 1 1 A 74 74 ARG CB C 163 26.770 27.069 -0.299 1
1 911 . 17 1 1 A 74 74 ARG N N 163 115.130 118.309 -3.179 1
1 912 . 17 1 1 A 75 75 GLU H H 164 7.430 8.080 -0.650 1
1 913 . 17 1 1 A 75 75 GLU HA H 164 4.636 4.448 0.188 1
1 918 . 17 1 1 A 75 75 GLU CA C 164 53.699 55.125 -1.426 1
1 919 . 17 1 1 A 75 75 GLU CB C 164 29.550 28.797 0.753 1
1 921 . 17 1 1 A 75 75 GLU N N 164 120.076 119.111 0.965 1
1 922 . 17 1 1 A 76 76 PRO HA H 165 4.272 4.465 -0.193 1
1 929 . 17 1 1 A 76 76 PRO C C 165 176.649 177.028 -0.379 1
1 930 . 17 1 1 A 76 76 PRO CA C 165 63.204 63.031 0.173 1
1 931 . 17 1 1 A 76 76 PRO CB C 165 31.680 31.607 0.073 1
1 934 . 17 1 1 A 77 77 ILE H H 166 8.812 8.242 0.570 1
1 935 . 17 1 1 A 77 77 ILE HA H 166 3.838 4.310 -0.472 1
1 945 . 17 1 1 A 77 77 ILE C C 166 175.235 175.918 -0.683 1
1 946 . 17 1 1 A 77 77 ILE CA C 166 62.816 61.302 1.514 1
1 947 . 17 1 1 A 77 77 ILE CB C 166 37.750 37.894 -0.144 1
1 951 . 17 1 1 A 77 77 ILE N N 166 123.831 124.040 -0.209 1
1 952 . 17 1 1 A 78 78 THR H H 167 6.625 8.552 -1.927 1
1 953 . 17 1 1 A 78 78 THR HA H 167 4.632 5.061 -0.429 1
1 958 . 17 1 1 A 78 78 THR C C 167 174.143 174.823 -0.680 1
1 959 . 17 1 1 A 78 78 THR CA C 167 58.750 60.009 -1.259 1
1 960 . 17 1 1 A 78 78 THR CB C 167 71.320 71.372 -0.052 1
1 962 . 17 1 1 A 78 78 THR N N 167 115.293 117.772 -2.479 1
1 963 . 17 1 1 A 79 79 ALA H H 168 9.088 9.030 0.058 1
1 964 . 17 1 1 A 79 79 ALA HA H 168 3.916 4.108 -0.192 1
1 968 . 17 1 1 A 79 79 ALA C C 168 179.770 179.469 0.301 1
1 969 . 17 1 1 A 79 79 ALA CA C 168 55.480 55.081 0.399 1
1 970 . 17 1 1 A 79 79 ALA CB C 168 17.630 18.404 -0.774 1
1 971 . 17 1 1 A 79 79 ALA N N 168 122.102 127.945 -5.843 1
1 972 . 17 1 1 A 80 80 SER H H 169 7.988 7.744 0.244 1
1 973 . 17 1 1 A 80 80 SER HA H 169 4.091 4.237 -0.146 1
1 976 . 17 1 1 A 80 80 SER C C 169 175.836 176.054 -0.218 1
1 977 . 17 1 1 A 80 80 SER CA C 169 60.750 61.211 -0.461 1
1 978 . 17 1 1 A 80 80 SER CB C 169 62.510 63.349 -0.839 1
1 979 . 17 1 1 A 80 80 SER N N 169 109.660 113.117 -3.457 1
1 980 . 17 1 1 A 81 81 ILE H H 170 7.052 7.576 -0.524 1
1 981 . 17 1 1 A 81 81 ILE HA H 170 4.344 4.488 -0.144 1
1 991 . 17 1 1 A 81 81 ILE C C 170 174.236 175.951 -1.715 1
1 992 . 17 1 1 A 81 81 ILE CA C 170 61.760 61.472 0.288 1
1 993 . 17 1 1 A 81 81 ILE CB C 170 37.950 38.165 -0.215 1
1 997 . 17 1 1 A 81 81 ILE N N 170 112.623 112.008 0.615 1
1 998 . 17 1 1 A 82 82 ILE H H 171 7.345 7.291 0.054 1
1 999 . 17 1 1 A 82 82 ILE HA H 171 4.288 4.105 0.183 1
1 1009 . 17 1 1 A 82 82 ILE C C 171 174.931 175.387 -0.456 1
1 1010 . 17 1 1 A 82 82 ILE CA C 171 61.420 61.524 -0.104 1
1 1011 . 17 1 1 A 82 82 ILE CB C 171 37.230 37.742 -0.512 1
1 1015 . 17 1 1 A 82 82 ILE N N 171 124.260 124.464 -0.204 1
1 1016 . 17 1 1 A 83 83 VAL H H 172 7.843 8.719 -0.876 1
1 1017 . 17 1 1 A 83 83 VAL HA H 172 4.818 5.063 -0.245 1
1 1025 . 17 1 1 A 83 83 VAL C C 172 174.918 175.678 -0.760 1
1 1026 . 17 1 1 A 83 83 VAL CA C 172 58.910 59.322 -0.412 1
1 1027 . 17 1 1 A 83 83 VAL CB C 172 34.570 34.962 -0.392 1
1 1030 . 17 1 1 A 83 83 VAL N N 172 118.856 122.298 -3.442 1
1 1031 . 17 1 1 A 84 84 LYS H H 173 8.347 8.816 -0.469 1
1 1032 . 17 1 1 A 84 84 LYS HA H 173 4.356 4.793 -0.437 1
1 1041 . 17 1 1 A 84 84 LYS C C 173 178.653 178.596 0.057 1
1 1042 . 17 1 1 A 84 84 LYS CA C 173 56.360 54.926 1.434 1
1 1043 . 17 1 1 A 84 84 LYS CB C 173 33.366 34.266 -0.900 1
1 1047 . 17 1 1 A 84 84 LYS N N 173 119.602 121.429 -1.827 1
1 1048 . 17 1 1 A 85 85 HIS H H 174 9.143 9.012 0.131 1
1 1049 . 17 1 1 A 85 85 HIS HA H 174 4.013 4.168 -0.155 1
1 1053 . 17 1 1 A 85 85 HIS C C 174 176.606 177.065 -0.459 1
1 1054 . 17 1 1 A 85 85 HIS CA C 174 58.820 60.266 -1.446 1
1 1055 . 17 1 1 A 85 85 HIS CB C 174 28.186 29.914 -1.728 1
1 1057 . 17 1 1 A 85 85 HIS N N 174 120.022 122.506 -2.484 1
1 1058 . 17 1 1 A 86 86 GLU H H 175 8.403 8.404 -0.001 1
1 1059 . 17 1 1 A 86 86 GLU HA H 175 3.863 3.731 0.132 1
1 1064 . 17 1 1 A 86 86 GLU C C 175 177.040 178.999 -1.959 1
1 1065 . 17 1 1 A 86 86 GLU CA C 175 57.830 59.794 -1.964 1
1 1066 . 17 1 1 A 86 86 GLU CB C 175 28.690 28.916 -0.226 1
1 1068 . 17 1 1 A 86 86 GLU N N 175 116.124 118.032 -1.908 1
1 1069 . 17 1 1 A 87 87 GLU H H 176 7.669 7.875 -0.206 1
1 1070 . 17 1 1 A 87 87 GLU HA H 176 4.039 4.353 -0.314 1
1 1075 . 17 1 1 A 87 87 GLU C C 176 175.688 175.686 0.002 1
1 1076 . 17 1 1 A 87 87 GLU CA C 176 57.906 58.147 -0.241 1
1 1077 . 17 1 1 A 87 87 GLU CB C 176 30.430 29.347 1.083 1
1 1079 . 17 1 1 A 87 87 GLU N N 176 116.183 117.070 -0.887 1
1 1080 . 17 1 1 A 88 88 CYS H H 177 6.750 6.870 -0.120 1
1 1081 . 17 1 1 A 88 88 CYS HA H 177 4.991 5.310 -0.319 1
1 1084 . 17 1 1 A 88 88 CYS C C 177 172.325 172.215 0.110 1
1 1085 . 17 1 1 A 88 88 CYS CA C 177 55.030 54.492 0.538 1
1 1086 . 17 1 1 A 88 88 CYS CB C 177 45.610 44.487 1.123 1
1 1087 . 17 1 1 A 88 88 CYS N N 177 114.838 115.515 -0.677 1
1 1088 . 17 1 1 A 89 89 ILE H H 178 9.128 8.588 0.540 1
1 1089 . 17 1 1 A 89 89 ILE HA H 178 4.536 4.907 -0.371 1
1 1099 . 17 1 1 A 89 89 ILE C C 178 174.893 174.474 0.419 1
1 1100 . 17 1 1 A 89 89 ILE CA C 178 59.160 59.100 0.060 1
1 1101 . 17 1 1 A 89 89 ILE CB C 178 41.840 41.018 0.822 1
1 1105 . 17 1 1 A 89 89 ILE N N 178 120.564 121.657 -1.093 1
1 1106 . 17 1 1 A 90 90 TYR H H 179 9.349 9.025 0.324 1
1 1107 . 17 1 1 A 90 90 TYR HA H 179 3.568 4.113 -0.545 1
1 1112 . 17 1 1 A 90 90 TYR C C 179 173.950 173.788 0.162 1
1 1113 . 17 1 1 A 90 90 TYR CA C 179 61.180 58.828 2.352 1
1 1114 . 17 1 1 A 90 90 TYR CB C 179 37.530 38.644 -1.114 1
1 1116 . 17 1 1 A 90 90 TYR N N 179 129.033 126.541 2.492 1
1 1117 . 17 1 1 A 91 91 ASP H H 180 7.367 8.027 -0.660 1
1 1118 . 17 1 1 A 91 91 ASP HA H 180 4.662 4.617 0.045 1
1 1121 . 17 1 1 A 91 91 ASP C C 180 175.291 175.240 0.051 1
1 1122 . 17 1 1 A 91 91 ASP CA C 180 52.230 52.004 0.226 1
1 1123 . 17 1 1 A 91 91 ASP CB C 180 43.650 41.406 2.244 1
1 1124 . 17 1 1 A 91 91 ASP N N 180 129.305 128.479 0.826 1
1 1125 . 17 1 1 A 92 92 ASP H H 181 8.783 8.446 0.337 1
1 1126 . 17 1 1 A 92 92 ASP HA H 181 4.114 3.741 0.373 1
1 1129 . 17 1 1 A 92 92 ASP C C 181 177.573 177.465 0.108 1
1 1130 . 17 1 1 A 92 92 ASP CA C 181 56.390 56.179 0.211 1
1 1131 . 17 1 1 A 92 92 ASP CB C 181 41.330 40.320 1.010 1
1 1132 . 17 1 1 A 92 92 ASP N N 181 125.665 126.000 -0.335 1
1 1133 . 17 1 1 A 93 93 THR H H 182 8.284 7.847 0.437 1
1 1134 . 17 1 1 A 93 93 THR HA H 182 4.037 3.809 0.228 1
1 1139 . 17 1 1 A 93 93 THR C C 182 176.333 176.130 0.203 1
1 1140 . 17 1 1 A 93 93 THR CA C 182 65.320 66.901 -1.581 1
1 1141 . 17 1 1 A 93 93 THR CB C 182 68.560 68.237 0.323 1
1 1143 . 17 1 1 A 93 93 THR N N 182 114.688 115.798 -1.110 1
1 1144 . 17 1 1 A 94 94 ARG H H 183 7.784 7.458 0.326 1
1 1145 . 17 1 1 A 94 94 ARG HA H 183 4.142 4.194 -0.052 1
1 1152 . 17 1 1 A 94 94 ARG C C 183 177.015 177.033 -0.018 1
1 1153 . 17 1 1 A 94 94 ARG CA C 183 55.350 56.285 -0.935 1
1 1154 . 17 1 1 A 94 94 ARG CB C 183 30.930 30.836 0.094 1
1 1157 . 17 1 1 A 94 94 ARG N N 183 120.156 118.327 1.829 1
1 1158 . 17 1 1 A 95 95 GLY H H 184 8.144 8.721 -0.577 1
1 1159 . 17 1 1 A 95 95 GLY HA2 H 184 3.839 3.852 -0.013 1
1 1160 . 17 1 1 A 95 95 GLY HA3 H 184 3.681 3.869 -0.188 1
1 1161 . 17 1 1 A 95 95 GLY C C 184 173.653 173.445 0.208 1
1 1162 . 17 1 1 A 95 95 GLY CA C 184 46.160 45.798 0.362 1
1 1163 . 17 1 1 A 95 95 GLY N N 184 107.879 108.567 -0.688 1
1 1164 . 17 1 1 A 96 96 ASN H H 185 6.855 7.304 -0.449 1
1 1165 . 17 1 1 A 96 96 ASN HA H 185 4.909 5.310 -0.401 1
1 1170 . 17 1 1 A 96 96 ASN C C 185 174.223 173.798 0.425 1
1 1171 . 17 1 1 A 96 96 ASN CA C 185 52.720 51.221 1.499 1
1 1172 . 17 1 1 A 96 96 ASN CB C 185 45.620 42.618 3.002 1
1 1173 . 17 1 1 A 96 96 ASN N N 185 113.382 117.447 -4.065 1
1 1175 . 17 1 1 A 97 97 PHE H H 186 9.228 8.688 0.540 1
1 1176 . 17 1 1 A 97 97 PHE HA H 186 4.579 5.025 -0.446 1
1 1183 . 17 1 1 A 97 97 PHE C C 186 174.794 175.534 -0.740 1
1 1184 . 17 1 1 A 97 97 PHE CA C 186 59.384 57.749 1.635 1
1 1185 . 17 1 1 A 97 97 PHE CB C 186 40.450 40.358 0.092 1
1 1188 . 17 1 1 A 97 97 PHE N N 186 118.661 119.593 -0.932 1
1 1189 . 17 1 1 A 98 98 ILE H H 187 8.908 9.175 -0.267 1
1 1190 . 17 1 1 A 98 98 ILE HA H 187 5.440 4.705 0.735 1
1 1200 . 17 1 1 A 98 98 ILE C C 187 176.171 175.571 0.600 1
1 1201 . 17 1 1 A 98 98 ILE CA C 187 57.610 59.856 -2.246 1
1 1202 . 17 1 1 A 98 98 ILE CB C 187 41.280 41.079 0.201 1
1 1206 . 17 1 1 A 98 98 ILE N N 187 120.585 122.293 -1.708 1
1 1207 . 17 1 1 A 99 99 ILE H H 188 8.602 8.455 0.147 1
1 1208 . 17 1 1 A 99 99 ILE HA H 188 4.546 4.766 -0.220 1
1 1218 . 17 1 1 A 99 99 ILE C C 188 176.668 175.280 1.388 1
1 1219 . 17 1 1 A 99 99 ILE CA C 188 58.920 61.862 -2.942 1
1 1220 . 17 1 1 A 99 99 ILE CB C 188 37.960 37.919 0.041 1
1 1224 . 17 1 1 A 99 99 ILE N N 188 124.500 126.902 -2.402 1
1 1225 . 17 1 1 A 100 100 LYS H H 189 8.449 8.525 -0.076 1
1 1226 . 17 1 1 A 100 100 LYS HA H 189 4.108 4.888 -0.780 1
1 1235 . 17 1 1 A 100 100 LYS C C 189 176.866 175.899 0.967 1
1 1236 . 17 1 1 A 100 100 LYS CA C 189 56.800 55.191 1.609 1
1 1237 . 17 1 1 A 100 100 LYS CB C 189 33.400 34.784 -1.384 1
1 1241 . 17 1 1 A 100 100 LYS N N 189 128.581 128.732 -0.151 1
1 1242 . 17 1 1 A 101 101 GLY H H 190 8.381 8.717 -0.336 1
1 1243 . 17 1 1 A 101 101 GLY HA2 H 190 3.946 4.167 -0.221 1
1 1244 . 17 1 1 A 101 101 GLY HA3 H 190 3.828 4.171 -0.343 1
1 1245 . 17 1 1 A 101 101 GLY C C 190 172.902 173.549 -0.647 1
1 1246 . 17 1 1 A 101 101 GLY CA C 190 44.920 45.698 -0.778 1
1 1247 . 17 1 1 A 101 101 GLY N N 190 111.183 114.142 -2.959 1
1 7 . 18 1 1 A 2 2 GLN H H 91 8.786 7.971 0.815 1
1 8 . 18 1 1 A 2 2 GLN HA H 91 4.005 3.888 0.117 1
1 15 . 18 1 1 A 2 2 GLN C C 91 177.270 178.656 -1.386 1
1 16 . 18 1 1 A 2 2 GLN CA C 91 58.220 59.223 -1.003 1
1 17 . 18 1 1 A 2 2 GLN CB C 91 28.650 28.298 0.352 1
1 19 . 18 1 1 A 2 2 GLN N N 91 121.993 122.483 -0.490 1
1 21 . 18 1 1 A 3 3 GLU H H 92 8.430 8.222 0.208 1
1 22 . 18 1 1 A 3 3 GLU HA H 92 4.007 4.123 -0.116 1
1 27 . 18 1 1 A 3 3 GLU C C 92 178.287 179.236 -0.949 1
1 28 . 18 1 1 A 3 3 GLU CA C 92 59.490 59.147 0.343 1
1 29 . 18 1 1 A 3 3 GLU CB C 92 29.506 29.207 0.299 1
1 31 . 18 1 1 A 3 3 GLU N N 92 120.195 119.462 0.733 1
1 32 . 18 1 1 A 4 4 SER H H 93 8.209 7.875 0.334 1
1 33 . 18 1 1 A 4 4 SER HA H 93 4.272 4.223 0.049 1
1 36 . 18 1 1 A 4 4 SER C C 93 177.369 176.377 0.992 1
1 37 . 18 1 1 A 4 4 SER CA C 93 61.044 62.335 -1.291 1
1 38 . 18 1 1 A 4 4 SER CB C 93 62.950 63.088 -0.138 1
1 39 . 18 1 1 A 4 4 SER N N 93 115.524 116.901 -1.377 1
1 40 . 18 1 1 A 5 5 ILE H H 94 8.080 7.853 0.227 1
1 41 . 18 1 1 A 5 5 ILE HA H 94 3.530 3.613 -0.083 1
1 51 . 18 1 1 A 5 5 ILE C C 94 177.778 177.480 0.298 1
1 52 . 18 1 1 A 5 5 ILE CA C 94 65.710 65.307 0.403 1
1 53 . 18 1 1 A 5 5 ILE CB C 94 37.800 37.490 0.310 1
1 57 . 18 1 1 A 5 5 ILE N N 94 124.148 121.304 2.844 1
1 58 . 18 1 1 A 6 6 GLN H H 95 8.374 8.077 0.297 1
1 59 . 18 1 1 A 6 6 GLN HA H 95 4.125 4.056 0.069 1
1 66 . 18 1 1 A 6 6 GLN C C 95 179.726 179.222 0.504 1
1 67 . 18 1 1 A 6 6 GLN CA C 95 59.190 59.243 -0.053 1
1 68 . 18 1 1 A 6 6 GLN CB C 95 27.060 27.990 -0.930 1
1 70 . 18 1 1 A 6 6 GLN N N 95 118.257 118.345 -0.088 1
1 72 . 18 1 1 A 7 7 ASN H H 96 8.456 8.210 0.246 1
1 73 . 18 1 1 A 7 7 ASN HA H 96 4.446 4.521 -0.075 1
1 78 . 18 1 1 A 7 7 ASN C C 96 177.257 178.375 -1.118 1
1 79 . 18 1 1 A 7 7 ASN CA C 96 56.020 56.152 -0.132 1
1 80 . 18 1 1 A 7 7 ASN CB C 96 38.126 37.799 0.327 1
1 81 . 18 1 1 A 7 7 ASN N N 96 118.597 118.535 0.062 1
1 83 . 18 1 1 A 8 8 LYS H H 97 7.732 7.521 0.211 1
1 84 . 18 1 1 A 8 8 LYS HA H 97 4.129 4.167 -0.038 1
1 93 . 18 1 1 A 8 8 LYS C C 97 179.143 179.550 -0.407 1
1 94 . 18 1 1 A 8 8 LYS CA C 97 59.126 59.315 -0.189 1
1 95 . 18 1 1 A 8 8 LYS CB C 97 32.070 32.143 -0.073 1
1 99 . 18 1 1 A 8 8 LYS N N 97 122.381 118.810 3.571 1
1 100 . 18 1 1 A 9 9 ILE H H 98 8.452 7.954 0.498 1
1 101 . 18 1 1 A 9 9 ILE HA H 98 3.480 3.959 -0.479 1
1 111 . 18 1 1 A 9 9 ILE C C 98 177.406 178.008 -0.602 1
1 112 . 18 1 1 A 9 9 ILE CA C 98 66.430 63.630 2.800 1
1 113 . 18 1 1 A 9 9 ILE CB C 98 37.980 37.246 0.734 1
1 117 . 18 1 1 A 9 9 ILE N N 98 119.950 120.860 -0.910 1
1 118 . 18 1 1 A 10 10 SER H H 99 7.924 7.575 0.349 1
1 119 . 18 1 1 A 10 10 SER HA H 99 3.983 4.358 -0.375 1
1 122 . 18 1 1 A 10 10 SER C C 99 176.327 176.307 0.020 1
1 123 . 18 1 1 A 10 10 SER CA C 99 61.990 61.276 0.714 1
1 124 . 18 1 1 A 10 10 SER CB C 99 62.790 63.260 -0.470 1
1 125 . 18 1 1 A 10 10 SER N N 99 113.568 117.867 -4.299 1
1 126 . 18 1 1 A 11 11 GLN H H 100 7.832 8.012 -0.180 1
1 127 . 18 1 1 A 11 11 GLN HA H 100 4.238 4.324 -0.086 1
1 134 . 18 1 1 A 11 11 GLN C C 100 178.088 178.379 -0.291 1
1 135 . 18 1 1 A 11 11 GLN CA C 100 57.900 58.323 -0.423 1
1 136 . 18 1 1 A 11 11 GLN CB C 100 29.790 29.395 0.395 1
1 138 . 18 1 1 A 11 11 GLN N N 100 117.487 118.238 -0.751 1
1 140 . 18 1 1 A 12 12 CYS H H 101 7.920 7.958 -0.038 1
1 141 . 18 1 1 A 12 12 CYS HA H 101 4.657 4.471 0.186 1
1 144 . 18 1 1 A 12 12 CYS C C 101 175.439 174.584 0.855 1
1 145 . 18 1 1 A 12 12 CYS CA C 101 60.654 61.267 -0.613 1
1 146 . 18 1 1 A 12 12 CYS CB C 101 29.310 28.092 1.218 1
1 147 . 18 1 1 A 12 12 CYS N N 101 114.221 118.801 -4.580 1
1 148 . 18 1 1 A 13 13 LYS H H 102 7.993 7.457 0.536 1
1 149 . 18 1 1 A 13 13 LYS HA H 102 5.038 4.595 0.443 1
1 158 . 18 1 1 A 13 13 LYS C C 102 174.757 176.306 -1.549 1
1 159 . 18 1 1 A 13 13 LYS CA C 102 56.660 56.191 0.469 1
1 160 . 18 1 1 A 13 13 LYS CB C 102 32.970 33.465 -0.495 1
1 164 . 18 1 1 A 13 13 LYS N N 102 123.841 118.415 5.426 1
1 165 . 18 1 1 A 14 14 PHE H H 103 8.822 8.581 0.241 1
1 166 . 18 1 1 A 14 14 PHE HA H 103 5.058 5.108 -0.050 1
1 174 . 18 1 1 A 14 14 PHE C C 103 173.560 172.772 0.788 1
1 175 . 18 1 1 A 14 14 PHE CA C 103 55.470 55.989 -0.519 1
1 176 . 18 1 1 A 14 14 PHE CB C 103 41.760 40.684 1.076 1
1 180 . 18 1 1 A 14 14 PHE N N 103 118.421 116.458 1.963 1
1 181 . 18 1 1 A 15 15 SER H H 104 8.826 8.848 -0.022 1
1 182 . 18 1 1 A 15 15 SER HA H 104 4.602 4.660 -0.058 1
1 185 . 18 1 1 A 15 15 SER C C 104 173.851 173.565 0.286 1
1 186 . 18 1 1 A 15 15 SER CA C 104 58.610 58.746 -0.136 1
1 187 . 18 1 1 A 15 15 SER CB C 104 62.690 62.295 0.395 1
1 188 . 18 1 1 A 15 15 SER N N 104 117.781 116.807 0.974 1
1 189 . 18 1 1 A 16 16 VAL H H 105 7.839 8.121 -0.282 1
1 190 . 18 1 1 A 16 16 VAL HA H 105 3.390 4.350 -0.960 1
1 198 . 18 1 1 A 16 16 VAL C C 105 174.987 175.645 -0.658 1
1 199 . 18 1 1 A 16 16 VAL CA C 105 63.650 62.508 1.142 1
1 200 . 18 1 1 A 16 16 VAL CB C 105 31.410 30.612 0.798 1
1 203 . 18 1 1 A 16 16 VAL N N 105 129.036 126.504 2.532 1
1 204 . 18 1 1 A 17 17 CYS H H 106 8.536 8.551 -0.015 1
1 205 . 18 1 1 A 17 17 CYS HA H 106 5.011 4.963 0.048 1
1 208 . 18 1 1 A 17 17 CYS CA C 106 55.260 56.630 -1.370 1
1 209 . 18 1 1 A 17 17 CYS CB C 106 28.210 30.843 -2.633 1
1 210 . 18 1 1 A 17 17 CYS N N 106 130.045 126.944 3.101 1
1 211 . 18 1 1 A 18 18 PRO HA H 107 3.991 4.344 -0.353 1
1 218 . 18 1 1 A 18 18 PRO C C 107 178.188 178.567 -0.379 1
1 219 . 18 1 1 A 18 18 PRO CA C 107 65.940 64.991 0.949 1
1 220 . 18 1 1 A 18 18 PRO CB C 107 32.000 31.919 0.081 1
1 223 . 18 1 1 A 19 19 GLU H H 108 9.260 8.976 0.284 1
1 224 . 18 1 1 A 19 19 GLU HA H 108 4.119 4.098 0.021 1
1 229 . 18 1 1 A 19 19 GLU C C 108 178.721 179.245 -0.524 1
1 230 . 18 1 1 A 19 19 GLU CA C 108 59.300 59.191 0.109 1
1 231 . 18 1 1 A 19 19 GLU CB C 108 28.920 28.873 0.047 1
1 233 . 18 1 1 A 19 19 GLU N N 108 118.270 116.532 1.738 1
1 234 . 18 1 1 A 20 20 ARG H H 109 7.672 7.951 -0.279 1
1 235 . 18 1 1 A 20 20 ARG HA H 109 4.331 4.113 0.218 1
1 242 . 18 1 1 A 20 20 ARG C C 109 177.977 178.669 -0.692 1
1 243 . 18 1 1 A 20 20 ARG CA C 109 57.350 59.163 -1.813 1
1 244 . 18 1 1 A 20 20 ARG CB C 109 30.820 30.291 0.529 1
1 247 . 18 1 1 A 20 20 ARG N N 109 118.357 119.665 -1.308 1
1 248 . 18 1 1 A 21 21 LEU H H 110 7.601 7.753 -0.152 1
1 249 . 18 1 1 A 21 21 LEU HA H 110 4.380 4.336 0.044 1
1 259 . 18 1 1 A 21 21 LEU C C 110 176.562 176.327 0.235 1
1 260 . 18 1 1 A 21 21 LEU CA C 110 56.096 55.426 0.670 1
1 261 . 18 1 1 A 21 21 LEU CB C 110 44.016 42.145 1.871 1
1 265 . 18 1 1 A 21 21 LEU N N 110 118.626 118.799 -0.173 1
1 266 . 18 1 1 A 22 22 GLN H H 111 7.750 7.612 0.138 1
1 267 . 18 1 1 A 22 22 GLN HA H 111 3.870 3.954 -0.084 1
1 274 . 18 1 1 A 22 22 GLN C C 111 173.336 174.060 -0.724 1
1 275 . 18 1 1 A 22 22 GLN CA C 111 56.510 57.323 -0.813 1
1 276 . 18 1 1 A 22 22 GLN CB C 111 26.800 26.430 0.370 1
1 278 . 18 1 1 A 22 22 GLN N N 111 113.926 115.782 -1.856 1
1 280 . 18 1 1 A 23 23 CYS H H 112 7.407 7.652 -0.245 1
1 281 . 18 1 1 A 23 23 CYS HA H 112 4.469 4.619 -0.150 1
1 284 . 18 1 1 A 23 23 CYS CA C 112 52.650 56.358 -3.708 1
1 285 . 18 1 1 A 23 23 CYS CB C 112 29.750 28.758 0.992 1
1 286 . 18 1 1 A 23 23 CYS N N 112 112.681 117.285 -4.604 1
1 287 . 18 1 1 A 24 24 PRO HA H 113 4.408 4.470 -0.062 1
1 294 . 18 1 1 A 24 24 PRO C C 113 178.175 177.637 0.538 1
1 295 . 18 1 1 A 24 24 PRO CA C 113 62.040 62.514 -0.474 1
1 296 . 18 1 1 A 24 24 PRO CB C 113 31.920 32.425 -0.505 1
1 299 . 18 1 1 A 25 25 LEU H H 114 8.593 8.762 -0.169 1
1 300 . 18 1 1 A 25 25 LEU HA H 114 3.765 4.056 -0.291 1
1 310 . 18 1 1 A 25 25 LEU C C 114 179.950 178.650 1.300 1
1 311 . 18 1 1 A 25 25 LEU CA C 114 57.674 58.115 -0.441 1
1 312 . 18 1 1 A 25 25 LEU CB C 114 40.690 41.443 -0.753 1
1 316 . 18 1 1 A 25 25 LEU N N 114 123.729 124.126 -0.397 1
1 317 . 18 1 1 A 26 26 GLU H H 115 9.108 8.291 0.817 1
1 318 . 18 1 1 A 26 26 GLU HA H 115 3.876 4.026 -0.150 1
1 323 . 18 1 1 A 26 26 GLU C C 115 177.505 179.323 -1.818 1
1 324 . 18 1 1 A 26 26 GLU CA C 115 59.410 59.569 -0.159 1
1 325 . 18 1 1 A 26 26 GLU CB C 115 28.460 29.177 -0.717 1
1 327 . 18 1 1 A 26 26 GLU N N 115 116.817 118.104 -1.287 1
1 328 . 18 1 1 A 27 27 ALA H H 116 7.360 7.750 -0.390 1
1 329 . 18 1 1 A 27 27 ALA HA H 116 4.408 4.083 0.325 1
1 333 . 18 1 1 A 27 27 ALA C C 116 177.046 178.869 -1.823 1
1 334 . 18 1 1 A 27 27 ALA CA C 116 52.970 54.825 -1.855 1
1 335 . 18 1 1 A 27 27 ALA CB C 116 19.916 18.547 1.369 1
1 336 . 18 1 1 A 27 27 ALA N N 116 118.966 121.659 -2.693 1
1 337 . 18 1 1 A 28 28 ILE H H 117 7.168 7.211 -0.043 1
1 338 . 18 1 1 A 28 28 ILE HA H 117 4.432 4.749 -0.317 1
1 348 . 18 1 1 A 28 28 ILE C C 117 172.641 175.706 -3.065 1
1 349 . 18 1 1 A 28 28 ILE CA C 117 59.980 60.822 -0.842 1
1 350 . 18 1 1 A 28 28 ILE CB C 117 37.350 37.873 -0.523 1
1 354 . 18 1 1 A 28 28 ILE N N 117 108.913 109.371 -0.458 1
1 355 . 18 1 1 A 29 29 GLN H H 118 6.562 7.772 -1.210 1
1 356 . 18 1 1 A 29 29 GLN HA H 118 3.922 4.214 -0.292 1
1 363 . 18 1 1 A 29 29 GLN C C 118 175.049 175.629 -0.580 1
1 364 . 18 1 1 A 29 29 GLN CA C 118 54.596 55.978 -1.382 1
1 365 . 18 1 1 A 29 29 GLN CB C 118 29.570 29.179 0.391 1
1 367 . 18 1 1 A 29 29 GLN N N 118 116.455 123.286 -6.831 1
1 369 . 18 1 1 A 30 30 CYS H H 119 8.138 8.464 -0.326 1
1 370 . 18 1 1 A 30 30 CYS HA H 119 4.580 4.613 -0.033 1
1 373 . 18 1 1 A 30 30 CYS CA C 119 57.810 57.434 0.376 1
1 374 . 18 1 1 A 30 30 CYS CB C 119 30.200 28.799 1.401 1
1 375 . 18 1 1 A 30 30 CYS N N 119 134.136 125.293 8.843 1
1 376 . 18 1 1 A 31 31 PRO HA H 120 4.424 4.328 0.096 1
1 383 . 18 1 1 A 31 31 PRO C C 120 177.431 179.012 -1.581 1
1 384 . 18 1 1 A 31 31 PRO CA C 120 64.060 65.085 -1.025 1
1 385 . 18 1 1 A 31 31 PRO CB C 120 32.776 32.159 0.617 1
1 388 . 18 1 1 A 32 32 ILE H H 121 11.318 7.746 3.572 1
1 389 . 18 1 1 A 32 32 ILE HA H 121 4.038 3.934 0.104 1
1 399 . 18 1 1 A 32 32 ILE C C 121 178.485 177.582 0.903 1
1 400 . 18 1 1 A 32 32 ILE CA C 121 64.060 64.162 -0.102 1
1 401 . 18 1 1 A 32 32 ILE CB C 121 39.340 38.230 1.110 1
1 405 . 18 1 1 A 32 32 ILE N N 121 124.500 116.696 7.804 1
1 406 . 18 1 1 A 33 33 THR H H 122 9.928 7.355 2.573 1
1 407 . 18 1 1 A 33 33 THR HA H 122 4.048 4.466 -0.418 1
1 412 . 18 1 1 A 33 33 THR C C 122 175.793 174.477 1.316 1
1 413 . 18 1 1 A 33 33 THR CA C 122 62.990 61.374 1.616 1
1 414 . 18 1 1 A 33 33 THR CB C 122 70.300 69.248 1.052 1
1 416 . 18 1 1 A 33 33 THR N N 122 115.136 108.547 6.589 1
1 417 . 18 1 1 A 34 34 LEU H H 123 8.439 7.835 0.604 1
1 418 . 18 1 1 A 34 34 LEU HA H 123 3.912 4.007 -0.095 1
1 428 . 18 1 1 A 34 34 LEU C C 123 175.495 175.475 0.020 1
1 429 . 18 1 1 A 34 34 LEU CA C 123 56.290 55.758 0.532 1
1 430 . 18 1 1 A 34 34 LEU CB C 123 38.500 39.733 -1.233 1
1 434 . 18 1 1 A 34 34 LEU N N 123 117.230 121.190 -3.960 1
1 435 . 18 1 1 A 35 35 GLU H H 124 7.816 7.518 0.298 1
1 436 . 18 1 1 A 35 35 GLU HA H 124 4.634 4.718 -0.084 1
1 441 . 18 1 1 A 35 35 GLU C C 124 174.838 174.067 0.771 1
1 442 . 18 1 1 A 35 35 GLU CA C 124 53.780 54.696 -0.916 1
1 443 . 18 1 1 A 35 35 GLU CB C 124 33.710 32.348 1.362 1
1 445 . 18 1 1 A 35 35 GLU N N 124 116.577 116.463 0.114 1
1 446 . 18 1 1 A 36 36 GLN H H 125 8.532 8.567 -0.035 1
1 447 . 18 1 1 A 36 36 GLN HA H 125 4.958 4.409 0.549 1
1 454 . 18 1 1 A 36 36 GLN CA C 125 53.350 53.777 -0.427 1
1 455 . 18 1 1 A 36 36 GLN CB C 125 29.950 29.877 0.073 1
1 457 . 18 1 1 A 36 36 GLN N N 125 123.034 121.490 1.544 1
1 459 . 18 1 1 A 37 37 PRO HA H 126 4.458 4.272 0.186 1
1 466 . 18 1 1 A 37 37 PRO C C 126 176.314 177.260 -0.946 1
1 467 . 18 1 1 A 37 37 PRO CA C 126 62.816 65.701 -2.885 1
1 468 . 18 1 1 A 37 37 PRO CB C 126 33.070 31.551 1.519 1
1 471 . 18 1 1 A 38 38 GLU H H 127 8.626 7.628 0.998 1
1 472 . 18 1 1 A 38 38 GLU HA H 127 4.274 4.494 -0.220 1
1 477 . 18 1 1 A 38 38 GLU C C 127 177.809 174.853 2.956 1
1 478 . 18 1 1 A 38 38 GLU CA C 127 58.730 58.316 0.414 1
1 479 . 18 1 1 A 38 38 GLU CB C 127 30.340 29.458 0.882 1
1 481 . 18 1 1 A 38 38 GLU N N 127 120.691 119.242 1.449 1
1 482 . 18 1 1 A 39 39 LYS H H 128 7.891 7.914 -0.023 1
1 483 . 18 1 1 A 39 39 LYS HA H 128 4.870 4.781 0.089 1
1 492 . 18 1 1 A 39 39 LYS C C 128 175.452 175.770 -0.318 1
1 493 . 18 1 1 A 39 39 LYS CA C 128 53.540 54.761 -1.221 1
1 494 . 18 1 1 A 39 39 LYS CB C 128 33.630 34.503 -0.873 1
1 498 . 18 1 1 A 39 39 LYS N N 128 118.149 118.005 0.144 1
1 499 . 18 1 1 A 40 40 GLY H H 129 8.524 8.061 0.463 1
1 500 . 18 1 1 A 40 40 GLY HA2 H 129 4.973 4.043 0.930 1
1 501 . 18 1 1 A 40 40 GLY HA3 H 129 2.459 4.175 -1.716 1
1 502 . 18 1 1 A 40 40 GLY C C 129 169.943 171.926 -1.983 1
1 503 . 18 1 1 A 40 40 GLY CA C 129 42.910 44.843 -1.933 1
1 504 . 18 1 1 A 40 40 GLY N N 129 112.845 110.488 2.357 1
1 505 . 18 1 1 A 41 41 ILE H H 130 8.659 8.184 0.475 1
1 506 . 18 1 1 A 41 41 ILE HA H 130 4.591 4.775 -0.184 1
1 516 . 18 1 1 A 41 41 ILE C C 130 172.586 173.943 -1.357 1
1 517 . 18 1 1 A 41 41 ILE CA C 130 58.090 58.845 -0.755 1
1 518 . 18 1 1 A 41 41 ILE CB C 130 43.320 41.771 1.549 1
1 522 . 18 1 1 A 41 41 ILE N N 130 114.060 119.265 -5.205 1
1 523 . 18 1 1 A 42 42 PHE H H 131 9.206 8.788 0.418 1
1 524 . 18 1 1 A 42 42 PHE HA H 131 5.159 4.694 0.465 1
1 532 . 18 1 1 A 42 42 PHE C C 131 174.931 175.667 -0.736 1
1 533 . 18 1 1 A 42 42 PHE CA C 131 57.790 57.963 -0.173 1
1 534 . 18 1 1 A 42 42 PHE CB C 131 42.220 38.940 3.280 1
1 538 . 18 1 1 A 42 42 PHE N N 131 126.002 128.442 -2.440 1
1 539 . 18 1 1 A 43 43 VAL H H 132 8.502 9.017 -0.515 1
1 540 . 18 1 1 A 43 43 VAL HA H 132 4.921 4.718 0.203 1
1 548 . 18 1 1 A 43 43 VAL C C 132 178.219 175.418 2.801 1
1 549 . 18 1 1 A 43 43 VAL CA C 132 59.600 60.283 -0.683 1
1 550 . 18 1 1 A 43 43 VAL CB C 132 35.920 35.190 0.730 1
1 553 . 18 1 1 A 43 43 VAL N N 132 119.068 123.199 -4.131 1
1 554 . 18 1 1 A 44 44 LYS H H 133 10.036 8.784 1.252 1
1 555 . 18 1 1 A 44 44 LYS HA H 133 5.070 4.342 0.728 1
1 564 . 18 1 1 A 44 44 LYS C C 133 177.276 177.730 -0.454 1
1 565 . 18 1 1 A 44 44 LYS CA C 133 56.720 56.673 0.047 1
1 566 . 18 1 1 A 44 44 LYS CB C 133 34.410 33.054 1.356 1
1 570 . 18 1 1 A 44 44 LYS N N 133 130.934 125.509 5.425 1
1 571 . 18 1 1 A 45 45 ASN H H 134 8.093 8.928 -0.835 1
1 572 . 18 1 1 A 45 45 ASN HA H 134 4.152 4.366 -0.214 1
1 577 . 18 1 1 A 45 45 ASN C C 134 174.087 175.233 -1.146 1
1 578 . 18 1 1 A 45 45 ASN CA C 134 55.360 55.390 -0.030 1
1 579 . 18 1 1 A 45 45 ASN CB C 134 37.530 39.320 -1.790 1
1 580 . 18 1 1 A 45 45 ASN N N 134 117.963 121.696 -3.733 1
1 582 . 18 1 1 A 46 46 SER H H 135 7.524 7.865 -0.341 1
1 583 . 18 1 1 A 46 46 SER HA H 135 4.219 4.721 -0.502 1
1 586 . 18 1 1 A 46 46 SER C C 135 174.490 174.277 0.213 1
1 587 . 18 1 1 A 46 46 SER CA C 135 57.090 55.614 1.476 1
1 588 . 18 1 1 A 46 46 SER CB C 135 63.860 66.866 -3.006 1
1 589 . 18 1 1 A 46 46 SER N N 135 105.939 108.681 -2.742 1
1 590 . 18 1 1 A 47 47 ASP H H 136 9.113 8.896 0.217 1
1 591 . 18 1 1 A 47 47 ASP HA H 136 4.220 4.270 -0.050 1
1 594 . 18 1 1 A 47 47 ASP CA C 136 57.610 57.139 0.471 1
1 595 . 18 1 1 A 47 47 ASP CB C 136 40.810 40.610 0.200 1
1 596 . 18 1 1 A 47 47 ASP N N 136 120.995 122.863 -1.868 1
1 597 . 18 1 1 A 48 48 GLY H H 137 8.181 8.072 0.109 1
1 598 . 18 1 1 A 48 48 GLY HA2 H 137 4.120 3.914 0.206 1
1 599 . 18 1 1 A 48 48 GLY HA3 H 137 3.659 3.915 -0.256 1
1 600 . 18 1 1 A 48 48 GLY C C 137 174.062 174.911 -0.849 1
1 601 . 18 1 1 A 48 48 GLY CA C 137 45.130 47.449 -2.319 1
1 602 . 18 1 1 A 48 48 GLY N N 137 106.197 107.423 -1.226 1
1 603 . 18 1 1 A 49 49 SER H H 138 7.179 7.966 -0.787 1
1 604 . 18 1 1 A 49 49 SER HA H 138 4.383 4.515 -0.132 1
1 607 . 18 1 1 A 49 49 SER C C 138 173.864 174.135 -0.271 1
1 608 . 18 1 1 A 49 49 SER CA C 138 57.614 58.688 -1.074 1
1 609 . 18 1 1 A 49 49 SER CB C 138 65.100 64.378 0.722 1
1 610 . 18 1 1 A 49 49 SER N N 138 115.015 116.021 -1.006 1
1 611 . 18 1 1 A 50 50 ASP H H 139 8.078 9.119 -1.041 1
1 612 . 18 1 1 A 50 50 ASP HA H 139 4.642 4.868 -0.226 1
1 615 . 18 1 1 A 50 50 ASP C C 139 174.261 175.196 -0.935 1
1 616 . 18 1 1 A 50 50 ASP CA C 139 52.406 54.091 -1.685 1
1 617 . 18 1 1 A 50 50 ASP CB C 139 40.254 41.117 -0.863 1
1 618 . 18 1 1 A 50 50 ASP N N 139 122.400 121.979 0.421 1
1 619 . 18 1 1 A 51 51 VAL H H 140 8.111 7.543 0.568 1
1 620 . 18 1 1 A 51 51 VAL HA H 140 4.360 4.417 -0.057 1
1 628 . 18 1 1 A 51 51 VAL C C 140 176.147 174.235 1.912 1
1 629 . 18 1 1 A 51 51 VAL CA C 140 62.670 61.580 1.090 1
1 630 . 18 1 1 A 51 51 VAL CB C 140 33.930 32.737 1.193 1
1 632 . 18 1 1 A 51 51 VAL N N 140 120.374 120.181 0.193 1
1 633 . 18 1 1 A 52 52 CYS H H 141 8.358 9.151 -0.793 1
1 634 . 18 1 1 A 52 52 CYS HA H 141 4.957 5.387 -0.430 1
1 637 . 18 1 1 A 52 52 CYS C C 141 173.070 173.169 -0.099 1
1 638 . 18 1 1 A 52 52 CYS CA C 141 53.380 54.598 -1.218 1
1 639 . 18 1 1 A 52 52 CYS CB C 141 46.110 44.969 1.141 1
1 640 . 18 1 1 A 52 52 CYS N N 141 121.305 129.235 -7.930 1
1 641 . 18 1 1 A 53 53 THR H H 142 8.929 8.764 0.165 1
1 642 . 18 1 1 A 53 53 THR HA H 142 4.498 5.051 -0.553 1
1 648 . 18 1 1 A 53 53 THR C C 142 172.151 172.802 -0.651 1
1 649 . 18 1 1 A 53 53 THR CA C 142 62.960 61.604 1.356 1
1 650 . 18 1 1 A 53 53 THR CB C 142 70.540 71.332 -0.792 1
1 652 . 18 1 1 A 53 53 THR N N 142 120.105 120.248 -0.143 1
1 653 . 18 1 1 A 54 54 LEU H H 143 8.448 8.861 -0.413 1
1 654 . 18 1 1 A 54 54 LEU HA H 143 4.322 4.772 -0.450 1
1 664 . 18 1 1 A 54 54 LEU C C 143 174.484 174.414 0.070 1
1 665 . 18 1 1 A 54 54 LEU CA C 143 54.596 53.375 1.221 1
1 666 . 18 1 1 A 54 54 LEU CB C 143 42.396 43.413 -1.017 1
1 670 . 18 1 1 A 54 54 LEU N N 143 128.819 129.438 -0.619 1
1 671 . 18 1 1 A 55 55 PHE H H 144 8.661 8.657 0.004 1
1 672 . 18 1 1 A 55 55 PHE HA H 144 5.459 5.005 0.454 1
1 680 . 18 1 1 A 55 55 PHE C C 144 176.035 174.898 1.137 1
1 681 . 18 1 1 A 55 55 PHE CA C 144 55.020 56.792 -1.772 1
1 682 . 18 1 1 A 55 55 PHE CB C 144 44.100 42.541 1.559 1
1 686 . 18 1 1 A 55 55 PHE N N 144 121.897 126.494 -4.597 1
1 687 . 18 1 1 A 56 56 ASP H H 145 11.616 8.621 2.995 1
1 688 . 18 1 1 A 56 56 ASP HA H 145 4.417 4.644 -0.227 1
1 691 . 18 1 1 A 56 56 ASP C C 145 176.748 177.460 -0.712 1
1 692 . 18 1 1 A 56 56 ASP CA C 145 55.844 54.377 1.467 1
1 693 . 18 1 1 A 56 56 ASP CB C 145 44.390 42.862 1.528 1
1 694 . 18 1 1 A 56 56 ASP N N 145 122.131 121.590 0.541 1
1 695 . 18 1 1 A 57 57 ALA H H 146 8.508 8.926 -0.418 1
1 696 . 18 1 1 A 57 57 ALA HA H 146 3.797 4.062 -0.265 1
1 700 . 18 1 1 A 57 57 ALA C C 146 178.696 180.078 -1.382 1
1 701 . 18 1 1 A 57 57 ALA CA C 146 55.990 55.347 0.643 1
1 702 . 18 1 1 A 57 57 ALA CB C 146 18.840 18.091 0.749 1
1 703 . 18 1 1 A 57 57 ALA N N 146 130.243 128.778 1.465 1
1 704 . 18 1 1 A 58 58 ALA H H 147 8.378 7.603 0.775 1
1 705 . 18 1 1 A 58 58 ALA HA H 147 4.078 4.223 -0.145 1
1 709 . 18 1 1 A 58 58 ALA C C 147 181.091 179.460 1.631 1
1 710 . 18 1 1 A 58 58 ALA CA C 147 54.770 54.965 -0.195 1
1 711 . 18 1 1 A 58 58 ALA CB C 147 17.700 18.429 -0.729 1
1 712 . 18 1 1 A 58 58 ALA N N 147 121.997 119.376 2.621 1
1 713 . 18 1 1 A 59 59 ALA H H 148 9.138 8.103 1.035 1
1 714 . 18 1 1 A 59 59 ALA HA H 148 3.975 4.046 -0.071 1
1 718 . 18 1 1 A 59 59 ALA C C 148 180.508 180.061 0.447 1
1 719 . 18 1 1 A 59 59 ALA CA C 148 54.840 55.005 -0.165 1
1 720 . 18 1 1 A 59 59 ALA CB C 148 18.600 18.569 0.031 1
1 721 . 18 1 1 A 59 59 ALA N N 148 123.595 120.656 2.939 1
1 722 . 18 1 1 A 60 60 PHE H H 149 8.814 8.045 0.769 1
1 723 . 18 1 1 A 60 60 PHE HA H 149 3.722 3.936 -0.214 1
1 731 . 18 1 1 A 60 60 PHE C C 149 176.773 177.436 -0.663 1
1 732 . 18 1 1 A 60 60 PHE CA C 149 62.030 61.461 0.569 1
1 733 . 18 1 1 A 60 60 PHE CB C 149 39.960 39.025 0.935 1
1 737 . 18 1 1 A 60 60 PHE N N 149 120.354 120.168 0.186 1
1 738 . 18 1 1 A 61 61 SER H H 150 8.276 8.303 -0.027 1
1 739 . 18 1 1 A 61 61 SER HA H 150 3.880 4.012 -0.132 1
1 742 . 18 1 1 A 61 61 SER C C 150 177.691 176.433 1.258 1
1 743 . 18 1 1 A 61 61 SER CA C 150 62.190 61.550 0.640 1
1 744 . 18 1 1 A 61 61 SER CB C 150 63.016 62.887 0.129 1
1 745 . 18 1 1 A 61 61 SER N N 150 112.086 114.089 -2.003 1
1 746 . 18 1 1 A 62 62 ARG H H 151 7.829 7.851 -0.022 1
1 747 . 18 1 1 A 62 62 ARG HA H 151 3.971 4.058 -0.087 1
1 754 . 18 1 1 A 62 62 ARG C C 151 178.287 178.352 -0.065 1
1 755 . 18 1 1 A 62 62 ARG CA C 151 59.340 58.920 0.420 1
1 756 . 18 1 1 A 62 62 ARG CB C 151 29.760 29.736 0.024 1
1 759 . 18 1 1 A 62 62 ARG N N 151 121.090 119.218 1.872 1
1 760 . 18 1 1 A 63 63 LEU H H 152 7.390 7.466 -0.076 1
1 761 . 18 1 1 A 63 63 LEU HA H 152 3.791 3.921 -0.130 1
1 771 . 18 1 1 A 63 63 LEU C C 152 179.106 178.252 0.854 1
1 772 . 18 1 1 A 63 63 LEU CA C 152 58.900 58.217 0.683 1
1 773 . 18 1 1 A 63 63 LEU CB C 152 41.140 41.442 -0.302 1
1 777 . 18 1 1 A 63 63 LEU N N 152 121.129 122.067 -0.938 1
1 778 . 18 1 1 A 64 64 VAL H H 153 7.552 7.955 -0.403 1
1 779 . 18 1 1 A 64 64 VAL HA H 153 3.411 3.468 -0.057 1
1 787 . 18 1 1 A 64 64 VAL C C 153 180.595 178.916 1.679 1
1 788 . 18 1 1 A 64 64 VAL CA C 153 65.644 66.090 -0.446 1
1 789 . 18 1 1 A 64 64 VAL CB C 153 31.410 31.328 0.082 1
1 792 . 18 1 1 A 64 64 VAL N N 153 118.280 118.955 -0.675 1
1 793 . 18 1 1 A 65 65 GLY H H 154 8.061 8.189 -0.128 1
1 794 . 18 1 1 A 65 65 GLY HA2 H 154 3.846 3.824 0.022 1
1 795 . 18 1 1 A 65 65 GLY HA3 H 154 3.809 3.826 -0.017 1
1 796 . 18 1 1 A 65 65 GLY C C 154 175.235 176.203 -0.968 1
1 797 . 18 1 1 A 65 65 GLY CA C 154 46.630 46.698 -0.068 1
1 798 . 18 1 1 A 65 65 GLY N N 154 108.622 107.628 0.994 1
1 799 . 18 1 1 A 66 66 GLU H H 155 7.528 7.528 0.000 1
1 800 . 18 1 1 A 66 66 GLU HA H 155 4.228 4.254 -0.026 1
1 805 . 18 1 1 A 66 66 GLU C C 155 176.761 177.087 -0.326 1
1 806 . 18 1 1 A 66 66 GLU CA C 155 56.590 56.511 0.079 1
1 807 . 18 1 1 A 66 66 GLU CB C 155 30.490 30.222 0.268 1
1 809 . 18 1 1 A 66 66 GLU N N 155 118.361 118.470 -0.109 1
1 810 . 18 1 1 A 67 67 GLY H H 156 7.884 7.827 0.057 1
1 811 . 18 1 1 A 67 67 GLY HA2 H 156 3.918 3.878 0.040 1
1 812 . 18 1 1 A 67 67 GLY HA3 H 156 3.747 3.892 -0.145 1
1 813 . 18 1 1 A 67 67 GLY C C 156 174.788 174.409 0.379 1
1 814 . 18 1 1 A 67 67 GLY CA C 156 45.890 46.215 -0.325 1
1 815 . 18 1 1 A 67 67 GLY N N 156 108.465 108.063 0.402 1
1 816 . 18 1 1 A 68 68 LEU H H 157 7.332 7.577 -0.245 1
1 817 . 18 1 1 A 68 68 LEU HA H 157 4.361 4.660 -0.299 1
1 827 . 18 1 1 A 68 68 LEU CA C 157 53.060 52.094 0.966 1
1 828 . 18 1 1 A 68 68 LEU CB C 157 41.100 42.104 -1.004 1
1 832 . 18 1 1 A 68 68 LEU N N 157 121.920 121.380 0.540 1
1 833 . 18 1 1 A 69 69 PRO HA H 158 4.485 4.620 -0.135 1
1 840 . 18 1 1 A 69 69 PRO C C 158 174.602 176.257 -1.655 1
1 841 . 18 1 1 A 69 69 PRO CA C 158 61.556 62.254 -0.698 1
1 842 . 18 1 1 A 69 69 PRO CB C 158 32.370 32.821 -0.451 1
1 845 . 18 1 1 A 70 70 HIS H H 159 8.734 8.516 0.218 1
1 846 . 18 1 1 A 70 70 HIS HA H 159 3.947 4.583 -0.636 1
1 852 . 18 1 1 A 70 70 HIS CA C 159 56.250 55.252 0.998 1
1 853 . 18 1 1 A 70 70 HIS CB C 159 32.280 31.112 1.168 1
1 856 . 18 1 1 A 70 70 HIS N N 159 119.423 120.807 -1.384 1
1 857 . 18 1 1 A 71 71 PRO HA H 160 4.424 4.207 0.217 1
1 864 . 18 1 1 A 71 71 PRO C C 160 177.567 178.570 -1.003 1
1 865 . 18 1 1 A 71 71 PRO CA C 160 64.574 65.219 -0.645 1
1 866 . 18 1 1 A 71 71 PRO CB C 160 32.340 31.909 0.431 1
1 869 . 18 1 1 A 72 72 LEU H H 161 10.123 7.392 2.731 1
1 870 . 18 1 1 A 72 72 LEU HA H 161 4.778 4.269 0.509 1
1 880 . 18 1 1 A 72 72 LEU C C 161 178.721 177.938 0.783 1
1 881 . 18 1 1 A 72 72 LEU CA C 161 55.800 57.294 -1.494 1
1 882 . 18 1 1 A 72 72 LEU CB C 161 42.440 42.521 -0.081 1
1 886 . 18 1 1 A 72 72 LEU N N 161 117.374 117.461 -0.087 1
1 887 . 18 1 1 A 73 73 THR H H 162 7.523 7.729 -0.206 1
1 888 . 18 1 1 A 73 73 THR HA H 162 4.291 4.551 -0.260 1
1 893 . 18 1 1 A 73 73 THR C C 162 175.557 174.426 1.131 1
1 894 . 18 1 1 A 73 73 THR CA C 162 61.440 62.272 -0.832 1
1 895 . 18 1 1 A 73 73 THR CB C 162 70.500 70.018 0.482 1
1 897 . 18 1 1 A 73 73 THR N N 162 107.787 111.088 -3.301 1
1 898 . 18 1 1 A 74 74 ARG H H 163 8.361 7.976 0.385 1
1 899 . 18 1 1 A 74 74 ARG HA H 163 3.836 4.170 -0.334 1
1 906 . 18 1 1 A 74 74 ARG C C 163 174.701 175.206 -0.505 1
1 907 . 18 1 1 A 74 74 ARG CA C 163 57.980 57.410 0.570 1
1 908 . 18 1 1 A 74 74 ARG CB C 163 26.770 26.977 -0.207 1
1 911 . 18 1 1 A 74 74 ARG N N 163 115.130 118.762 -3.632 1
1 912 . 18 1 1 A 75 75 GLU H H 164 7.430 8.096 -0.666 1
1 913 . 18 1 1 A 75 75 GLU HA H 164 4.636 4.464 0.172 1
1 918 . 18 1 1 A 75 75 GLU CA C 164 53.699 55.259 -1.560 1
1 919 . 18 1 1 A 75 75 GLU CB C 164 29.550 28.823 0.727 1
1 921 . 18 1 1 A 75 75 GLU N N 164 120.076 118.771 1.305 1
1 922 . 18 1 1 A 76 76 PRO HA H 165 4.272 4.631 -0.359 1
1 929 . 18 1 1 A 76 76 PRO C C 165 176.649 176.789 -0.140 1
1 930 . 18 1 1 A 76 76 PRO CA C 165 63.204 62.943 0.261 1
1 931 . 18 1 1 A 76 76 PRO CB C 165 31.680 31.567 0.113 1
1 934 . 18 1 1 A 77 77 ILE H H 166 8.812 8.194 0.618 1
1 935 . 18 1 1 A 77 77 ILE HA H 166 3.838 4.373 -0.535 1
1 945 . 18 1 1 A 77 77 ILE C C 166 175.235 175.836 -0.601 1
1 946 . 18 1 1 A 77 77 ILE CA C 166 62.816 61.180 1.636 1
1 947 . 18 1 1 A 77 77 ILE CB C 166 37.750 36.654 1.096 1
1 951 . 18 1 1 A 77 77 ILE N N 166 123.831 123.969 -0.138 1
1 952 . 18 1 1 A 78 78 THR H H 167 6.625 8.600 -1.975 1
1 953 . 18 1 1 A 78 78 THR HA H 167 4.632 4.884 -0.252 1
1 958 . 18 1 1 A 78 78 THR C C 167 174.143 174.058 0.085 1
1 959 . 18 1 1 A 78 78 THR CA C 167 58.750 60.059 -1.309 1
1 960 . 18 1 1 A 78 78 THR CB C 167 71.320 70.584 0.736 1
1 962 . 18 1 1 A 78 78 THR N N 167 115.293 119.980 -4.687 1
1 963 . 18 1 1 A 79 79 ALA H H 168 9.088 8.967 0.121 1
1 964 . 18 1 1 A 79 79 ALA HA H 168 3.916 4.065 -0.149 1
1 968 . 18 1 1 A 79 79 ALA C C 168 179.770 179.516 0.254 1
1 969 . 18 1 1 A 79 79 ALA CA C 168 55.480 55.322 0.158 1
1 970 . 18 1 1 A 79 79 ALA CB C 168 17.630 18.410 -0.780 1
1 971 . 18 1 1 A 79 79 ALA N N 168 122.102 127.147 -5.045 1
1 972 . 18 1 1 A 80 80 SER H H 169 7.988 8.144 -0.156 1
1 973 . 18 1 1 A 80 80 SER HA H 169 4.091 4.199 -0.108 1
1 976 . 18 1 1 A 80 80 SER C C 169 175.836 176.389 -0.553 1
1 977 . 18 1 1 A 80 80 SER CA C 169 60.750 61.383 -0.633 1
1 978 . 18 1 1 A 80 80 SER CB C 169 62.510 63.077 -0.567 1
1 979 . 18 1 1 A 80 80 SER N N 169 109.660 113.413 -3.753 1
1 980 . 18 1 1 A 81 81 ILE H H 170 7.052 7.350 -0.298 1
1 981 . 18 1 1 A 81 81 ILE HA H 170 4.344 4.338 0.006 1
1 991 . 18 1 1 A 81 81 ILE C C 170 174.236 176.226 -1.990 1
1 992 . 18 1 1 A 81 81 ILE CA C 170 61.760 62.767 -1.007 1
1 993 . 18 1 1 A 81 81 ILE CB C 170 37.950 38.517 -0.567 1
1 997 . 18 1 1 A 81 81 ILE N N 170 112.623 113.049 -0.426 1
1 998 . 18 1 1 A 82 82 ILE H H 171 7.345 7.034 0.311 1
1 999 . 18 1 1 A 82 82 ILE HA H 171 4.288 4.022 0.266 1
1 1009 . 18 1 1 A 82 82 ILE C C 171 174.931 175.435 -0.504 1
1 1010 . 18 1 1 A 82 82 ILE CA C 171 61.420 62.141 -0.721 1
1 1011 . 18 1 1 A 82 82 ILE CB C 171 37.230 37.760 -0.530 1
1 1015 . 18 1 1 A 82 82 ILE N N 171 124.260 125.101 -0.841 1
1 1016 . 18 1 1 A 83 83 VAL H H 172 7.843 8.653 -0.810 1
1 1017 . 18 1 1 A 83 83 VAL HA H 172 4.818 5.039 -0.221 1
1 1025 . 18 1 1 A 83 83 VAL C C 172 174.918 175.568 -0.650 1
1 1026 . 18 1 1 A 83 83 VAL CA C 172 58.910 59.112 -0.202 1
1 1027 . 18 1 1 A 83 83 VAL CB C 172 34.570 35.256 -0.686 1
1 1030 . 18 1 1 A 83 83 VAL N N 172 118.856 122.103 -3.247 1
1 1031 . 18 1 1 A 84 84 LYS H H 173 8.347 8.808 -0.461 1
1 1032 . 18 1 1 A 84 84 LYS HA H 173 4.356 4.844 -0.488 1
1 1041 . 18 1 1 A 84 84 LYS C C 173 178.653 178.612 0.041 1
1 1042 . 18 1 1 A 84 84 LYS CA C 173 56.360 55.508 0.852 1
1 1043 . 18 1 1 A 84 84 LYS CB C 173 33.366 33.538 -0.172 1
1 1047 . 18 1 1 A 84 84 LYS N N 173 119.602 121.710 -2.108 1
1 1048 . 18 1 1 A 85 85 HIS H H 174 9.143 9.025 0.118 1
1 1049 . 18 1 1 A 85 85 HIS HA H 174 4.013 4.363 -0.350 1
1 1053 . 18 1 1 A 85 85 HIS C C 174 176.606 177.144 -0.538 1
1 1054 . 18 1 1 A 85 85 HIS CA C 174 58.820 60.496 -1.676 1
1 1055 . 18 1 1 A 85 85 HIS CB C 174 28.186 29.810 -1.624 1
1 1057 . 18 1 1 A 85 85 HIS N N 174 120.022 122.524 -2.502 1
1 1058 . 18 1 1 A 86 86 GLU H H 175 8.403 8.330 0.073 1
1 1059 . 18 1 1 A 86 86 GLU HA H 175 3.863 3.918 -0.055 1
1 1064 . 18 1 1 A 86 86 GLU C C 175 177.040 179.250 -2.210 1
1 1065 . 18 1 1 A 86 86 GLU CA C 175 57.830 59.883 -2.053 1
1 1066 . 18 1 1 A 86 86 GLU CB C 175 28.690 28.997 -0.307 1
1 1068 . 18 1 1 A 86 86 GLU N N 175 116.124 118.568 -2.444 1
1 1069 . 18 1 1 A 87 87 GLU H H 176 7.669 7.965 -0.296 1
1 1070 . 18 1 1 A 87 87 GLU HA H 176 4.039 4.359 -0.320 1
1 1075 . 18 1 1 A 87 87 GLU C C 176 175.688 177.367 -1.679 1
1 1076 . 18 1 1 A 87 87 GLU CA C 176 57.906 58.949 -1.043 1
1 1077 . 18 1 1 A 87 87 GLU CB C 176 30.430 28.857 1.573 1
1 1079 . 18 1 1 A 87 87 GLU N N 176 116.183 118.625 -2.442 1
1 1080 . 18 1 1 A 88 88 CYS H H 177 6.750 7.544 -0.794 1
1 1081 . 18 1 1 A 88 88 CYS HA H 177 4.991 4.775 0.216 1
1 1084 . 18 1 1 A 88 88 CYS C C 177 172.325 173.377 -1.052 1
1 1085 . 18 1 1 A 88 88 CYS CA C 177 55.030 54.062 0.968 1
1 1086 . 18 1 1 A 88 88 CYS CB C 177 45.610 41.927 3.683 1
1 1087 . 18 1 1 A 88 88 CYS N N 177 114.838 117.064 -2.226 1
1 1088 . 18 1 1 A 89 89 ILE H H 178 9.128 8.912 0.216 1
1 1089 . 18 1 1 A 89 89 ILE HA H 178 4.536 4.913 -0.377 1
1 1099 . 18 1 1 A 89 89 ILE C C 178 174.893 174.503 0.390 1
1 1100 . 18 1 1 A 89 89 ILE CA C 178 59.160 59.119 0.041 1
1 1101 . 18 1 1 A 89 89 ILE CB C 178 41.840 40.942 0.898 1
1 1105 . 18 1 1 A 89 89 ILE N N 178 120.564 121.398 -0.834 1
1 1106 . 18 1 1 A 90 90 TYR H H 179 9.349 9.089 0.260 1
1 1107 . 18 1 1 A 90 90 TYR HA H 179 3.568 4.425 -0.857 1
1 1112 . 18 1 1 A 90 90 TYR C C 179 173.950 174.033 -0.083 1
1 1113 . 18 1 1 A 90 90 TYR CA C 179 61.180 59.071 2.109 1
1 1114 . 18 1 1 A 90 90 TYR CB C 179 37.530 39.041 -1.511 1
1 1116 . 18 1 1 A 90 90 TYR N N 179 129.033 126.378 2.655 1
1 1117 . 18 1 1 A 91 91 ASP H H 180 7.367 8.048 -0.681 1
1 1118 . 18 1 1 A 91 91 ASP HA H 180 4.662 4.717 -0.055 1
1 1121 . 18 1 1 A 91 91 ASP C C 180 175.291 175.514 -0.223 1
1 1122 . 18 1 1 A 91 91 ASP CA C 180 52.230 52.201 0.029 1
1 1123 . 18 1 1 A 91 91 ASP CB C 180 43.650 42.431 1.219 1
1 1124 . 18 1 1 A 91 91 ASP N N 180 129.305 128.311 0.994 1
1 1125 . 18 1 1 A 92 92 ASP H H 181 8.783 8.496 0.287 1
1 1126 . 18 1 1 A 92 92 ASP HA H 181 4.114 3.846 0.268 1
1 1129 . 18 1 1 A 92 92 ASP C C 181 177.573 177.711 -0.138 1
1 1130 . 18 1 1 A 92 92 ASP CA C 181 56.390 57.121 -0.731 1
1 1131 . 18 1 1 A 92 92 ASP CB C 181 41.330 40.674 0.656 1
1 1132 . 18 1 1 A 92 92 ASP N N 181 125.665 126.621 -0.956 1
1 1133 . 18 1 1 A 93 93 THR H H 182 8.284 8.014 0.270 1
1 1134 . 18 1 1 A 93 93 THR HA H 182 4.037 3.753 0.284 1
1 1139 . 18 1 1 A 93 93 THR C C 182 176.333 176.201 0.132 1
1 1140 . 18 1 1 A 93 93 THR CA C 182 65.320 66.960 -1.640 1
1 1141 . 18 1 1 A 93 93 THR CB C 182 68.560 68.446 0.114 1
1 1143 . 18 1 1 A 93 93 THR N N 182 114.688 116.537 -1.849 1
1 1144 . 18 1 1 A 94 94 ARG H H 183 7.784 7.543 0.241 1
1 1145 . 18 1 1 A 94 94 ARG HA H 183 4.142 4.215 -0.073 1
1 1152 . 18 1 1 A 94 94 ARG C C 183 177.015 177.183 -0.168 1
1 1153 . 18 1 1 A 94 94 ARG CA C 183 55.350 56.259 -0.909 1
1 1154 . 18 1 1 A 94 94 ARG CB C 183 30.930 30.919 0.011 1
1 1157 . 18 1 1 A 94 94 ARG N N 183 120.156 118.358 1.798 1
1 1158 . 18 1 1 A 95 95 GLY H H 184 8.144 8.706 -0.562 1
1 1159 . 18 1 1 A 95 95 GLY HA2 H 184 3.839 3.869 -0.030 1
1 1160 . 18 1 1 A 95 95 GLY HA3 H 184 3.681 3.897 -0.216 1
1 1161 . 18 1 1 A 95 95 GLY C C 184 173.653 173.233 0.420 1
1 1162 . 18 1 1 A 95 95 GLY CA C 184 46.160 46.239 -0.079 1
1 1163 . 18 1 1 A 95 95 GLY N N 184 107.879 108.493 -0.614 1
1 1164 . 18 1 1 A 96 96 ASN H H 185 6.855 7.326 -0.471 1
1 1165 . 18 1 1 A 96 96 ASN HA H 185 4.909 4.925 -0.016 1
1 1170 . 18 1 1 A 96 96 ASN C C 185 174.223 173.284 0.939 1
1 1171 . 18 1 1 A 96 96 ASN CA C 185 52.720 52.219 0.501 1
1 1172 . 18 1 1 A 96 96 ASN CB C 185 45.620 41.878 3.742 1
1 1173 . 18 1 1 A 96 96 ASN N N 185 113.382 116.364 -2.982 1
1 1175 . 18 1 1 A 97 97 PHE H H 186 9.228 8.591 0.637 1
1 1176 . 18 1 1 A 97 97 PHE HA H 186 4.579 4.979 -0.400 1
1 1183 . 18 1 1 A 97 97 PHE C C 186 174.794 175.522 -0.728 1
1 1184 . 18 1 1 A 97 97 PHE CA C 186 59.384 58.245 1.139 1
1 1185 . 18 1 1 A 97 97 PHE CB C 186 40.450 39.872 0.578 1
1 1188 . 18 1 1 A 97 97 PHE N N 186 118.661 119.571 -0.910 1
1 1189 . 18 1 1 A 98 98 ILE H H 187 8.908 9.204 -0.296 1
1 1190 . 18 1 1 A 98 98 ILE HA H 187 5.440 4.999 0.441 1
1 1200 . 18 1 1 A 98 98 ILE C C 187 176.171 174.570 1.601 1
1 1201 . 18 1 1 A 98 98 ILE CA C 187 57.610 59.759 -2.149 1
1 1202 . 18 1 1 A 98 98 ILE CB C 187 41.280 40.714 0.566 1
1 1206 . 18 1 1 A 98 98 ILE N N 187 120.585 123.095 -2.510 1
1 1207 . 18 1 1 A 99 99 ILE H H 188 8.602 8.405 0.197 1
1 1208 . 18 1 1 A 99 99 ILE HA H 188 4.546 4.757 -0.211 1
1 1218 . 18 1 1 A 99 99 ILE C C 188 176.668 175.092 1.576 1
1 1219 . 18 1 1 A 99 99 ILE CA C 188 58.920 60.553 -1.633 1
1 1220 . 18 1 1 A 99 99 ILE CB C 188 37.960 38.572 -0.612 1
1 1224 . 18 1 1 A 99 99 ILE N N 188 124.500 125.388 -0.888 1
1 1225 . 18 1 1 A 100 100 LYS H H 189 8.449 8.438 0.011 1
1 1226 . 18 1 1 A 100 100 LYS HA H 189 4.108 4.722 -0.614 1
1 1235 . 18 1 1 A 100 100 LYS C C 189 176.866 176.462 0.404 1
1 1236 . 18 1 1 A 100 100 LYS CA C 189 56.800 55.334 1.466 1
1 1237 . 18 1 1 A 100 100 LYS CB C 189 33.400 34.079 -0.679 1
1 1241 . 18 1 1 A 100 100 LYS N N 189 128.581 127.202 1.379 1
1 1242 . 18 1 1 A 101 101 GLY H H 190 8.381 8.806 -0.425 1
1 1243 . 18 1 1 A 101 101 GLY HA2 H 190 3.946 4.148 -0.202 1
1 1244 . 18 1 1 A 101 101 GLY HA3 H 190 3.828 4.148 -0.320 1
1 1245 . 18 1 1 A 101 101 GLY C C 190 172.902 173.322 -0.420 1
1 1246 . 18 1 1 A 101 101 GLY CA C 190 44.920 45.408 -0.488 1
1 1247 . 18 1 1 A 101 101 GLY N N 190 111.183 114.679 -3.496 1
1 7 . 19 1 1 A 2 2 GLN H H 91 8.786 8.765 0.021 1
1 8 . 19 1 1 A 2 2 GLN HA H 91 4.005 3.982 0.023 1
1 15 . 19 1 1 A 2 2 GLN C C 91 177.270 177.355 -0.085 1
1 16 . 19 1 1 A 2 2 GLN CA C 91 58.220 59.204 -0.984 1
1 17 . 19 1 1 A 2 2 GLN CB C 91 28.650 28.635 0.015 1
1 19 . 19 1 1 A 2 2 GLN N N 91 121.993 124.862 -2.869 1
1 21 . 19 1 1 A 3 3 GLU H H 92 8.430 8.408 0.022 1
1 22 . 19 1 1 A 3 3 GLU HA H 92 4.007 4.082 -0.075 1
1 27 . 19 1 1 A 3 3 GLU C C 92 178.287 178.865 -0.578 1
1 28 . 19 1 1 A 3 3 GLU CA C 92 59.490 59.601 -0.111 1
1 29 . 19 1 1 A 3 3 GLU CB C 92 29.506 29.468 0.038 1
1 31 . 19 1 1 A 3 3 GLU N N 92 120.195 119.635 0.560 1
1 32 . 19 1 1 A 4 4 SER H H 93 8.209 7.554 0.655 1
1 33 . 19 1 1 A 4 4 SER HA H 93 4.272 4.274 -0.002 1
1 36 . 19 1 1 A 4 4 SER C C 93 177.369 177.424 -0.055 1
1 37 . 19 1 1 A 4 4 SER CA C 93 61.044 61.224 -0.180 1
1 38 . 19 1 1 A 4 4 SER CB C 93 62.950 62.845 0.105 1
1 39 . 19 1 1 A 4 4 SER N N 93 115.524 114.297 1.227 1
1 40 . 19 1 1 A 5 5 ILE H H 94 8.080 7.499 0.581 1
1 41 . 19 1 1 A 5 5 ILE HA H 94 3.530 3.629 -0.099 1
1 51 . 19 1 1 A 5 5 ILE C C 94 177.778 177.619 0.159 1
1 52 . 19 1 1 A 5 5 ILE CA C 94 65.710 65.265 0.445 1
1 53 . 19 1 1 A 5 5 ILE CB C 94 37.800 37.455 0.345 1
1 57 . 19 1 1 A 5 5 ILE N N 94 124.148 122.036 2.112 1
1 58 . 19 1 1 A 6 6 GLN H H 95 8.374 8.173 0.201 1
1 59 . 19 1 1 A 6 6 GLN HA H 95 4.125 3.945 0.180 1
1 66 . 19 1 1 A 6 6 GLN C C 95 179.726 179.239 0.487 1
1 67 . 19 1 1 A 6 6 GLN CA C 95 59.190 58.950 0.240 1
1 68 . 19 1 1 A 6 6 GLN CB C 95 27.060 28.445 -1.385 1
1 70 . 19 1 1 A 6 6 GLN N N 95 118.257 118.453 -0.196 1
1 72 . 19 1 1 A 7 7 ASN H H 96 8.456 8.141 0.315 1
1 73 . 19 1 1 A 7 7 ASN HA H 96 4.446 4.555 -0.109 1
1 78 . 19 1 1 A 7 7 ASN C C 96 177.257 177.619 -0.362 1
1 79 . 19 1 1 A 7 7 ASN CA C 96 56.020 56.105 -0.085 1
1 80 . 19 1 1 A 7 7 ASN CB C 96 38.126 37.863 0.263 1
1 81 . 19 1 1 A 7 7 ASN N N 96 118.597 118.442 0.155 1
1 83 . 19 1 1 A 8 8 LYS H H 97 7.732 7.949 -0.217 1
1 84 . 19 1 1 A 8 8 LYS HA H 97 4.129 4.084 0.045 1
1 93 . 19 1 1 A 8 8 LYS C C 97 179.143 179.399 -0.256 1
1 94 . 19 1 1 A 8 8 LYS CA C 97 59.126 59.878 -0.752 1
1 95 . 19 1 1 A 8 8 LYS CB C 97 32.070 32.230 -0.160 1
1 99 . 19 1 1 A 8 8 LYS N N 97 122.381 120.536 1.845 1
1 100 . 19 1 1 A 9 9 ILE H H 98 8.452 7.829 0.623 1
1 101 . 19 1 1 A 9 9 ILE HA H 98 3.480 3.992 -0.512 1
1 111 . 19 1 1 A 9 9 ILE C C 98 177.406 178.283 -0.877 1
1 112 . 19 1 1 A 9 9 ILE CA C 98 66.430 63.670 2.760 1
1 113 . 19 1 1 A 9 9 ILE CB C 98 37.980 37.365 0.615 1
1 117 . 19 1 1 A 9 9 ILE N N 98 119.950 120.224 -0.274 1
1 118 . 19 1 1 A 10 10 SER H H 99 7.924 7.709 0.215 1
1 119 . 19 1 1 A 10 10 SER HA H 99 3.983 4.245 -0.262 1
1 122 . 19 1 1 A 10 10 SER C C 99 176.327 176.363 -0.036 1
1 123 . 19 1 1 A 10 10 SER CA C 99 61.990 61.281 0.709 1
1 124 . 19 1 1 A 10 10 SER CB C 99 62.790 63.004 -0.214 1
1 125 . 19 1 1 A 10 10 SER N N 99 113.568 117.933 -4.365 1
1 126 . 19 1 1 A 11 11 GLN H H 100 7.832 7.888 -0.056 1
1 127 . 19 1 1 A 11 11 GLN HA H 100 4.238 4.259 -0.021 1
1 134 . 19 1 1 A 11 11 GLN C C 100 178.088 177.857 0.231 1
1 135 . 19 1 1 A 11 11 GLN CA C 100 57.900 58.629 -0.729 1
1 136 . 19 1 1 A 11 11 GLN CB C 100 29.790 29.025 0.765 1
1 138 . 19 1 1 A 11 11 GLN N N 100 117.487 118.520 -1.033 1
1 140 . 19 1 1 A 12 12 CYS H H 101 7.920 8.416 -0.496 1
1 141 . 19 1 1 A 12 12 CYS HA H 101 4.657 4.503 0.154 1
1 144 . 19 1 1 A 12 12 CYS C C 101 175.439 174.847 0.592 1
1 145 . 19 1 1 A 12 12 CYS CA C 101 60.654 61.021 -0.367 1
1 146 . 19 1 1 A 12 12 CYS CB C 101 29.310 26.984 2.326 1
1 147 . 19 1 1 A 12 12 CYS N N 101 114.221 117.858 -3.637 1
1 148 . 19 1 1 A 13 13 LYS H H 102 7.993 7.478 0.515 1
1 149 . 19 1 1 A 13 13 LYS HA H 102 5.038 4.575 0.463 1
1 158 . 19 1 1 A 13 13 LYS C C 102 174.757 176.321 -1.564 1
1 159 . 19 1 1 A 13 13 LYS CA C 102 56.660 56.196 0.464 1
1 160 . 19 1 1 A 13 13 LYS CB C 102 32.970 33.264 -0.294 1
1 164 . 19 1 1 A 13 13 LYS N N 102 123.841 119.524 4.317 1
1 165 . 19 1 1 A 14 14 PHE H H 103 8.822 8.719 0.103 1
1 166 . 19 1 1 A 14 14 PHE HA H 103 5.058 5.096 -0.038 1
1 174 . 19 1 1 A 14 14 PHE C C 103 173.560 173.582 -0.022 1
1 175 . 19 1 1 A 14 14 PHE CA C 103 55.470 55.978 -0.508 1
1 176 . 19 1 1 A 14 14 PHE CB C 103 41.760 40.923 0.837 1
1 180 . 19 1 1 A 14 14 PHE N N 103 118.421 116.585 1.836 1
1 181 . 19 1 1 A 15 15 SER H H 104 8.826 8.566 0.260 1
1 182 . 19 1 1 A 15 15 SER HA H 104 4.602 4.823 -0.221 1
1 185 . 19 1 1 A 15 15 SER C C 104 173.851 173.704 0.147 1
1 186 . 19 1 1 A 15 15 SER CA C 104 58.610 57.812 0.798 1
1 187 . 19 1 1 A 15 15 SER CB C 104 62.690 62.608 0.082 1
1 188 . 19 1 1 A 15 15 SER N N 104 117.781 114.953 2.828 1
1 189 . 19 1 1 A 16 16 VAL H H 105 7.839 8.130 -0.291 1
1 190 . 19 1 1 A 16 16 VAL HA H 105 3.390 4.322 -0.932 1
1 198 . 19 1 1 A 16 16 VAL C C 105 174.987 175.563 -0.576 1
1 199 . 19 1 1 A 16 16 VAL CA C 105 63.650 62.590 1.060 1
1 200 . 19 1 1 A 16 16 VAL CB C 105 31.410 30.547 0.863 1
1 203 . 19 1 1 A 16 16 VAL N N 105 129.036 125.992 3.044 1
1 204 . 19 1 1 A 17 17 CYS H H 106 8.536 8.417 0.119 1
1 205 . 19 1 1 A 17 17 CYS HA H 106 5.011 4.941 0.070 1
1 208 . 19 1 1 A 17 17 CYS CA C 106 55.260 56.639 -1.379 1
1 209 . 19 1 1 A 17 17 CYS CB C 106 28.210 30.970 -2.760 1
1 210 . 19 1 1 A 17 17 CYS N N 106 130.045 126.995 3.050 1
1 211 . 19 1 1 A 18 18 PRO HA H 107 3.991 4.392 -0.401 1
1 218 . 19 1 1 A 18 18 PRO C C 107 178.188 178.039 0.149 1
1 219 . 19 1 1 A 18 18 PRO CA C 107 65.940 64.571 1.369 1
1 220 . 19 1 1 A 18 18 PRO CB C 107 32.000 32.089 -0.089 1
1 223 . 19 1 1 A 19 19 GLU H H 108 9.260 9.078 0.182 1
1 224 . 19 1 1 A 19 19 GLU HA H 108 4.119 4.115 0.004 1
1 229 . 19 1 1 A 19 19 GLU C C 108 178.721 179.021 -0.300 1
1 230 . 19 1 1 A 19 19 GLU CA C 108 59.300 59.175 0.125 1
1 231 . 19 1 1 A 19 19 GLU CB C 108 28.920 28.262 0.658 1
1 233 . 19 1 1 A 19 19 GLU N N 108 118.270 116.180 2.090 1
1 234 . 19 1 1 A 20 20 ARG H H 109 7.672 7.751 -0.079 1
1 235 . 19 1 1 A 20 20 ARG HA H 109 4.331 4.299 0.032 1
1 242 . 19 1 1 A 20 20 ARG C C 109 177.977 178.216 -0.239 1
1 243 . 19 1 1 A 20 20 ARG CA C 109 57.350 58.580 -1.230 1
1 244 . 19 1 1 A 20 20 ARG CB C 109 30.820 31.047 -0.227 1
1 247 . 19 1 1 A 20 20 ARG N N 109 118.357 119.398 -1.041 1
1 248 . 19 1 1 A 21 21 LEU H H 110 7.601 7.786 -0.185 1
1 249 . 19 1 1 A 21 21 LEU HA H 110 4.380 4.350 0.030 1
1 259 . 19 1 1 A 21 21 LEU C C 110 176.562 176.316 0.246 1
1 260 . 19 1 1 A 21 21 LEU CA C 110 56.096 55.490 0.606 1
1 261 . 19 1 1 A 21 21 LEU CB C 110 44.016 42.205 1.811 1
1 265 . 19 1 1 A 21 21 LEU N N 110 118.626 118.548 0.078 1
1 266 . 19 1 1 A 22 22 GLN H H 111 7.750 7.602 0.148 1
1 267 . 19 1 1 A 22 22 GLN HA H 111 3.870 3.988 -0.118 1
1 274 . 19 1 1 A 22 22 GLN C C 111 173.336 174.449 -1.113 1
1 275 . 19 1 1 A 22 22 GLN CA C 111 56.510 57.423 -0.913 1
1 276 . 19 1 1 A 22 22 GLN CB C 111 26.800 26.784 0.016 1
1 278 . 19 1 1 A 22 22 GLN N N 111 113.926 115.741 -1.815 1
1 280 . 19 1 1 A 23 23 CYS H H 112 7.407 7.777 -0.370 1
1 281 . 19 1 1 A 23 23 CYS HA H 112 4.469 4.787 -0.318 1
1 284 . 19 1 1 A 23 23 CYS CA C 112 52.650 56.693 -4.043 1
1 285 . 19 1 1 A 23 23 CYS CB C 112 29.750 28.169 1.581 1
1 286 . 19 1 1 A 23 23 CYS N N 112 112.681 117.661 -4.980 1
1 287 . 19 1 1 A 24 24 PRO HA H 113 4.408 4.452 -0.044 1
1 294 . 19 1 1 A 24 24 PRO C C 113 178.175 177.463 0.712 1
1 295 . 19 1 1 A 24 24 PRO CA C 113 62.040 62.408 -0.368 1
1 296 . 19 1 1 A 24 24 PRO CB C 113 31.920 33.029 -1.109 1
1 299 . 19 1 1 A 25 25 LEU H H 114 8.593 8.816 -0.223 1
1 300 . 19 1 1 A 25 25 LEU HA H 114 3.765 4.064 -0.299 1
1 310 . 19 1 1 A 25 25 LEU C C 114 179.950 178.622 1.328 1
1 311 . 19 1 1 A 25 25 LEU CA C 114 57.674 57.919 -0.245 1
1 312 . 19 1 1 A 25 25 LEU CB C 114 40.690 41.445 -0.755 1
1 316 . 19 1 1 A 25 25 LEU N N 114 123.729 123.660 0.069 1
1 317 . 19 1 1 A 26 26 GLU H H 115 9.108 8.397 0.711 1
1 318 . 19 1 1 A 26 26 GLU HA H 115 3.876 3.989 -0.113 1
1 323 . 19 1 1 A 26 26 GLU C C 115 177.505 179.262 -1.757 1
1 324 . 19 1 1 A 26 26 GLU CA C 115 59.410 59.549 -0.139 1
1 325 . 19 1 1 A 26 26 GLU CB C 115 28.460 29.279 -0.819 1
1 327 . 19 1 1 A 26 26 GLU N N 115 116.817 118.072 -1.255 1
1 328 . 19 1 1 A 27 27 ALA H H 116 7.360 7.798 -0.438 1
1 329 . 19 1 1 A 27 27 ALA HA H 116 4.408 4.038 0.370 1
1 333 . 19 1 1 A 27 27 ALA C C 116 177.046 178.865 -1.819 1
1 334 . 19 1 1 A 27 27 ALA CA C 116 52.970 54.836 -1.866 1
1 335 . 19 1 1 A 27 27 ALA CB C 116 19.916 18.220 1.696 1
1 336 . 19 1 1 A 27 27 ALA N N 116 118.966 121.836 -2.870 1
1 337 . 19 1 1 A 28 28 ILE H H 117 7.168 7.129 0.039 1
1 338 . 19 1 1 A 28 28 ILE HA H 117 4.432 4.652 -0.220 1
1 348 . 19 1 1 A 28 28 ILE C C 117 172.641 175.698 -3.057 1
1 349 . 19 1 1 A 28 28 ILE CA C 117 59.980 60.715 -0.735 1
1 350 . 19 1 1 A 28 28 ILE CB C 117 37.350 37.812 -0.462 1
1 354 . 19 1 1 A 28 28 ILE N N 117 108.913 109.273 -0.360 1
1 355 . 19 1 1 A 29 29 GLN H H 118 6.562 7.395 -0.833 1
1 356 . 19 1 1 A 29 29 GLN HA H 118 3.922 4.211 -0.289 1
1 363 . 19 1 1 A 29 29 GLN C C 118 175.049 175.570 -0.521 1
1 364 . 19 1 1 A 29 29 GLN CA C 118 54.596 56.152 -1.556 1
1 365 . 19 1 1 A 29 29 GLN CB C 118 29.570 29.069 0.501 1
1 367 . 19 1 1 A 29 29 GLN N N 118 116.455 123.325 -6.870 1
1 369 . 19 1 1 A 30 30 CYS H H 119 8.138 8.504 -0.366 1
1 370 . 19 1 1 A 30 30 CYS HA H 119 4.580 4.552 0.028 1
1 373 . 19 1 1 A 30 30 CYS CA C 119 57.810 57.509 0.301 1
1 374 . 19 1 1 A 30 30 CYS CB C 119 30.200 28.780 1.420 1
1 375 . 19 1 1 A 30 30 CYS N N 119 134.136 125.264 8.872 1
1 376 . 19 1 1 A 31 31 PRO HA H 120 4.424 4.399 0.025 1
1 383 . 19 1 1 A 31 31 PRO C C 120 177.431 178.399 -0.968 1
1 384 . 19 1 1 A 31 31 PRO CA C 120 64.060 64.489 -0.429 1
1 385 . 19 1 1 A 31 31 PRO CB C 120 32.776 32.127 0.649 1
1 388 . 19 1 1 A 32 32 ILE H H 121 11.318 7.596 3.722 1
1 389 . 19 1 1 A 32 32 ILE HA H 121 4.038 3.948 0.090 1
1 399 . 19 1 1 A 32 32 ILE C C 121 178.485 177.697 0.788 1
1 400 . 19 1 1 A 32 32 ILE CA C 121 64.060 64.185 -0.125 1
1 401 . 19 1 1 A 32 32 ILE CB C 121 39.340 38.333 1.007 1
1 405 . 19 1 1 A 32 32 ILE N N 121 124.500 116.728 7.772 1
1 406 . 19 1 1 A 33 33 THR H H 122 9.928 7.345 2.583 1
1 407 . 19 1 1 A 33 33 THR HA H 122 4.048 4.473 -0.425 1
1 412 . 19 1 1 A 33 33 THR C C 122 175.793 174.408 1.385 1
1 413 . 19 1 1 A 33 33 THR CA C 122 62.990 61.335 1.655 1
1 414 . 19 1 1 A 33 33 THR CB C 122 70.300 68.971 1.329 1
1 416 . 19 1 1 A 33 33 THR N N 122 115.136 108.612 6.524 1
1 417 . 19 1 1 A 34 34 LEU H H 123 8.439 7.751 0.688 1
1 418 . 19 1 1 A 34 34 LEU HA H 123 3.912 4.010 -0.098 1
1 428 . 19 1 1 A 34 34 LEU C C 123 175.495 175.432 0.063 1
1 429 . 19 1 1 A 34 34 LEU CA C 123 56.290 55.754 0.536 1
1 430 . 19 1 1 A 34 34 LEU CB C 123 38.500 39.729 -1.229 1
1 434 . 19 1 1 A 34 34 LEU N N 123 117.230 121.134 -3.904 1
1 435 . 19 1 1 A 35 35 GLU H H 124 7.816 7.507 0.309 1
1 436 . 19 1 1 A 35 35 GLU HA H 124 4.634 4.743 -0.109 1
1 441 . 19 1 1 A 35 35 GLU C C 124 174.838 174.061 0.777 1
1 442 . 19 1 1 A 35 35 GLU CA C 124 53.780 54.661 -0.881 1
1 443 . 19 1 1 A 35 35 GLU CB C 124 33.710 32.316 1.394 1
1 445 . 19 1 1 A 35 35 GLU N N 124 116.577 116.456 0.121 1
1 446 . 19 1 1 A 36 36 GLN H H 125 8.532 8.575 -0.043 1
1 447 . 19 1 1 A 36 36 GLN HA H 125 4.958 4.387 0.571 1
1 454 . 19 1 1 A 36 36 GLN CA C 125 53.350 53.879 -0.529 1
1 455 . 19 1 1 A 36 36 GLN CB C 125 29.950 29.921 0.029 1
1 457 . 19 1 1 A 36 36 GLN N N 125 123.034 121.493 1.541 1
1 459 . 19 1 1 A 37 37 PRO HA H 126 4.458 4.262 0.196 1
1 466 . 19 1 1 A 37 37 PRO C C 126 176.314 177.287 -0.973 1
1 467 . 19 1 1 A 37 37 PRO CA C 126 62.816 65.718 -2.902 1
1 468 . 19 1 1 A 37 37 PRO CB C 126 33.070 31.557 1.513 1
1 471 . 19 1 1 A 38 38 GLU H H 127 8.626 8.058 0.568 1
1 472 . 19 1 1 A 38 38 GLU HA H 127 4.274 4.543 -0.269 1
1 477 . 19 1 1 A 38 38 GLU C C 127 177.809 175.005 2.804 1
1 478 . 19 1 1 A 38 38 GLU CA C 127 58.730 58.339 0.391 1
1 479 . 19 1 1 A 38 38 GLU CB C 127 30.340 29.446 0.894 1
1 481 . 19 1 1 A 38 38 GLU N N 127 120.691 119.284 1.407 1
1 482 . 19 1 1 A 39 39 LYS H H 128 7.891 7.876 0.015 1
1 483 . 19 1 1 A 39 39 LYS HA H 128 4.870 4.746 0.124 1
1 492 . 19 1 1 A 39 39 LYS C C 128 175.452 175.730 -0.278 1
1 493 . 19 1 1 A 39 39 LYS CA C 128 53.540 54.853 -1.313 1
1 494 . 19 1 1 A 39 39 LYS CB C 128 33.630 34.607 -0.977 1
1 498 . 19 1 1 A 39 39 LYS N N 128 118.149 118.027 0.122 1
1 499 . 19 1 1 A 40 40 GLY H H 129 8.524 7.985 0.539 1
1 500 . 19 1 1 A 40 40 GLY HA2 H 129 4.973 4.039 0.934 1
1 501 . 19 1 1 A 40 40 GLY HA3 H 129 2.459 4.183 -1.724 1
1 502 . 19 1 1 A 40 40 GLY C C 129 169.943 171.894 -1.951 1
1 503 . 19 1 1 A 40 40 GLY CA C 129 42.910 45.001 -2.091 1
1 504 . 19 1 1 A 40 40 GLY N N 129 112.845 110.480 2.365 1
1 505 . 19 1 1 A 41 41 ILE H H 130 8.659 8.136 0.523 1
1 506 . 19 1 1 A 41 41 ILE HA H 130 4.591 4.762 -0.171 1
1 516 . 19 1 1 A 41 41 ILE C C 130 172.586 173.966 -1.380 1
1 517 . 19 1 1 A 41 41 ILE CA C 130 58.090 59.255 -1.165 1
1 518 . 19 1 1 A 41 41 ILE CB C 130 43.320 41.848 1.472 1
1 522 . 19 1 1 A 41 41 ILE N N 130 114.060 119.285 -5.225 1
1 523 . 19 1 1 A 42 42 PHE H H 131 9.206 8.833 0.373 1
1 524 . 19 1 1 A 42 42 PHE HA H 131 5.159 4.729 0.430 1
1 532 . 19 1 1 A 42 42 PHE C C 131 174.931 175.728 -0.797 1
1 533 . 19 1 1 A 42 42 PHE CA C 131 57.790 57.860 -0.070 1
1 534 . 19 1 1 A 42 42 PHE CB C 131 42.220 39.066 3.154 1
1 538 . 19 1 1 A 42 42 PHE N N 131 126.002 128.248 -2.246 1
1 539 . 19 1 1 A 43 43 VAL H H 132 8.502 8.985 -0.483 1
1 540 . 19 1 1 A 43 43 VAL HA H 132 4.921 4.744 0.177 1
1 548 . 19 1 1 A 43 43 VAL C C 132 178.219 175.343 2.876 1
1 549 . 19 1 1 A 43 43 VAL CA C 132 59.600 60.009 -0.409 1
1 550 . 19 1 1 A 43 43 VAL CB C 132 35.920 35.642 0.278 1
1 553 . 19 1 1 A 43 43 VAL N N 132 119.068 123.202 -4.134 1
1 554 . 19 1 1 A 44 44 LYS H H 133 10.036 8.820 1.216 1
1 555 . 19 1 1 A 44 44 LYS HA H 133 5.070 4.341 0.729 1
1 564 . 19 1 1 A 44 44 LYS C C 133 177.276 177.793 -0.517 1
1 565 . 19 1 1 A 44 44 LYS CA C 133 56.720 57.072 -0.352 1
1 566 . 19 1 1 A 44 44 LYS CB C 133 34.410 32.792 1.618 1
1 570 . 19 1 1 A 44 44 LYS N N 133 130.934 125.083 5.851 1
1 571 . 19 1 1 A 45 45 ASN H H 134 8.093 8.939 -0.846 1
1 572 . 19 1 1 A 45 45 ASN HA H 134 4.152 4.567 -0.415 1
1 577 . 19 1 1 A 45 45 ASN C C 134 174.087 175.203 -1.116 1
1 578 . 19 1 1 A 45 45 ASN CA C 134 55.360 55.774 -0.414 1
1 579 . 19 1 1 A 45 45 ASN CB C 134 37.530 39.115 -1.585 1
1 580 . 19 1 1 A 45 45 ASN N N 134 117.963 122.918 -4.955 1
1 582 . 19 1 1 A 46 46 SER H H 135 7.524 7.863 -0.339 1
1 583 . 19 1 1 A 46 46 SER HA H 135 4.219 4.747 -0.528 1
1 586 . 19 1 1 A 46 46 SER C C 135 174.490 174.334 0.156 1
1 587 . 19 1 1 A 46 46 SER CA C 135 57.090 55.661 1.429 1
1 588 . 19 1 1 A 46 46 SER CB C 135 63.860 66.564 -2.704 1
1 589 . 19 1 1 A 46 46 SER N N 135 105.939 108.827 -2.888 1
1 590 . 19 1 1 A 47 47 ASP H H 136 9.113 9.039 0.074 1
1 591 . 19 1 1 A 47 47 ASP HA H 136 4.220 4.252 -0.032 1
1 594 . 19 1 1 A 47 47 ASP CA C 136 57.610 57.170 0.440 1
1 595 . 19 1 1 A 47 47 ASP CB C 136 40.810 40.676 0.134 1
1 596 . 19 1 1 A 47 47 ASP N N 136 120.995 123.340 -2.345 1
1 597 . 19 1 1 A 48 48 GLY H H 137 8.181 8.064 0.117 1
1 598 . 19 1 1 A 48 48 GLY HA2 H 137 4.120 3.863 0.257 1
1 599 . 19 1 1 A 48 48 GLY HA3 H 137 3.659 3.864 -0.205 1
1 600 . 19 1 1 A 48 48 GLY C C 137 174.062 174.804 -0.742 1
1 601 . 19 1 1 A 48 48 GLY CA C 137 45.130 47.271 -2.141 1
1 602 . 19 1 1 A 48 48 GLY N N 137 106.197 107.491 -1.294 1
1 603 . 19 1 1 A 49 49 SER H H 138 7.179 7.965 -0.786 1
1 604 . 19 1 1 A 49 49 SER HA H 138 4.383 4.513 -0.130 1
1 607 . 19 1 1 A 49 49 SER C C 138 173.864 174.502 -0.638 1
1 608 . 19 1 1 A 49 49 SER CA C 138 57.614 58.976 -1.362 1
1 609 . 19 1 1 A 49 49 SER CB C 138 65.100 64.446 0.654 1
1 610 . 19 1 1 A 49 49 SER N N 138 115.015 116.174 -1.159 1
1 611 . 19 1 1 A 50 50 ASP H H 139 8.078 9.123 -1.045 1
1 612 . 19 1 1 A 50 50 ASP HA H 139 4.642 4.774 -0.132 1
1 615 . 19 1 1 A 50 50 ASP C C 139 174.261 174.746 -0.485 1
1 616 . 19 1 1 A 50 50 ASP CA C 139 52.406 54.018 -1.612 1
1 617 . 19 1 1 A 50 50 ASP CB C 139 40.254 39.635 0.619 1
1 618 . 19 1 1 A 50 50 ASP N N 139 122.400 122.995 -0.595 1
1 619 . 19 1 1 A 51 51 VAL H H 140 8.111 7.549 0.562 1
1 620 . 19 1 1 A 51 51 VAL HA H 140 4.360 4.656 -0.296 1
1 628 . 19 1 1 A 51 51 VAL C C 140 176.147 173.739 2.408 1
1 629 . 19 1 1 A 51 51 VAL CA C 140 62.670 60.669 2.001 1
1 630 . 19 1 1 A 51 51 VAL CB C 140 33.930 33.704 0.226 1
1 632 . 19 1 1 A 51 51 VAL N N 140 120.374 119.816 0.558 1
1 633 . 19 1 1 A 52 52 CYS H H 141 8.358 9.276 -0.918 1
1 634 . 19 1 1 A 52 52 CYS HA H 141 4.957 5.505 -0.548 1
1 637 . 19 1 1 A 52 52 CYS C C 141 173.070 172.933 0.137 1
1 638 . 19 1 1 A 52 52 CYS CA C 141 53.380 54.468 -1.088 1
1 639 . 19 1 1 A 52 52 CYS CB C 141 46.110 45.423 0.687 1
1 640 . 19 1 1 A 52 52 CYS N N 141 121.305 129.189 -7.884 1
1 641 . 19 1 1 A 53 53 THR H H 142 8.929 8.777 0.152 1
1 642 . 19 1 1 A 53 53 THR HA H 142 4.498 5.049 -0.551 1
1 648 . 19 1 1 A 53 53 THR C C 142 172.151 172.288 -0.137 1
1 649 . 19 1 1 A 53 53 THR CA C 142 62.960 61.149 1.811 1
1 650 . 19 1 1 A 53 53 THR CB C 142 70.540 72.693 -2.153 1
1 652 . 19 1 1 A 53 53 THR N N 142 120.105 118.966 1.139 1
1 653 . 19 1 1 A 54 54 LEU H H 143 8.448 8.699 -0.251 1
1 654 . 19 1 1 A 54 54 LEU HA H 143 4.322 4.664 -0.342 1
1 664 . 19 1 1 A 54 54 LEU C C 143 174.484 174.328 0.156 1
1 665 . 19 1 1 A 54 54 LEU CA C 143 54.596 53.360 1.236 1
1 666 . 19 1 1 A 54 54 LEU CB C 143 42.396 43.684 -1.288 1
1 670 . 19 1 1 A 54 54 LEU N N 143 128.819 128.054 0.765 1
1 671 . 19 1 1 A 55 55 PHE H H 144 8.661 8.629 0.032 1
1 672 . 19 1 1 A 55 55 PHE HA H 144 5.459 4.995 0.464 1
1 680 . 19 1 1 A 55 55 PHE C C 144 176.035 174.711 1.324 1
1 681 . 19 1 1 A 55 55 PHE CA C 144 55.020 56.518 -1.498 1
1 682 . 19 1 1 A 55 55 PHE CB C 144 44.100 42.700 1.400 1
1 686 . 19 1 1 A 55 55 PHE N N 144 121.897 125.989 -4.092 1
1 687 . 19 1 1 A 56 56 ASP H H 145 11.616 8.562 3.054 1
1 688 . 19 1 1 A 56 56 ASP HA H 145 4.417 4.639 -0.222 1
1 691 . 19 1 1 A 56 56 ASP C C 145 176.748 177.331 -0.583 1
1 692 . 19 1 1 A 56 56 ASP CA C 145 55.844 54.269 1.575 1
1 693 . 19 1 1 A 56 56 ASP CB C 145 44.390 43.139 1.251 1
1 694 . 19 1 1 A 56 56 ASP N N 145 122.131 122.000 0.131 1
1 695 . 19 1 1 A 57 57 ALA H H 146 8.508 9.028 -0.520 1
1 696 . 19 1 1 A 57 57 ALA HA H 146 3.797 4.039 -0.242 1
1 700 . 19 1 1 A 57 57 ALA C C 146 178.696 180.106 -1.410 1
1 701 . 19 1 1 A 57 57 ALA CA C 146 55.990 55.331 0.659 1
1 702 . 19 1 1 A 57 57 ALA CB C 146 18.840 18.131 0.709 1
1 703 . 19 1 1 A 57 57 ALA N N 146 130.243 128.664 1.579 1
1 704 . 19 1 1 A 58 58 ALA H H 147 8.378 8.063 0.315 1
1 705 . 19 1 1 A 58 58 ALA HA H 147 4.078 4.160 -0.082 1
1 709 . 19 1 1 A 58 58 ALA C C 147 181.091 179.494 1.597 1
1 710 . 19 1 1 A 58 58 ALA CA C 147 54.770 55.075 -0.305 1
1 711 . 19 1 1 A 58 58 ALA CB C 147 17.700 18.592 -0.892 1
1 712 . 19 1 1 A 58 58 ALA N N 147 121.997 119.770 2.227 1
1 713 . 19 1 1 A 59 59 ALA H H 148 9.138 8.062 1.076 1
1 714 . 19 1 1 A 59 59 ALA HA H 148 3.975 4.052 -0.077 1
1 718 . 19 1 1 A 59 59 ALA C C 148 180.508 180.000 0.508 1
1 719 . 19 1 1 A 59 59 ALA CA C 148 54.840 55.035 -0.195 1
1 720 . 19 1 1 A 59 59 ALA CB C 148 18.600 18.570 0.030 1
1 721 . 19 1 1 A 59 59 ALA N N 148 123.595 120.868 2.727 1
1 722 . 19 1 1 A 60 60 PHE H H 149 8.814 8.120 0.694 1
1 723 . 19 1 1 A 60 60 PHE HA H 149 3.722 3.972 -0.250 1
1 731 . 19 1 1 A 60 60 PHE C C 149 176.773 177.446 -0.673 1
1 732 . 19 1 1 A 60 60 PHE CA C 149 62.030 61.491 0.539 1
1 733 . 19 1 1 A 60 60 PHE CB C 149 39.960 39.174 0.786 1
1 737 . 19 1 1 A 60 60 PHE N N 149 120.354 119.979 0.375 1
1 738 . 19 1 1 A 61 61 SER H H 150 8.276 8.217 0.059 1
1 739 . 19 1 1 A 61 61 SER HA H 150 3.880 3.991 -0.111 1
1 742 . 19 1 1 A 61 61 SER C C 150 177.691 176.468 1.223 1
1 743 . 19 1 1 A 61 61 SER CA C 150 62.190 61.579 0.611 1
1 744 . 19 1 1 A 61 61 SER CB C 150 63.016 62.893 0.123 1
1 745 . 19 1 1 A 61 61 SER N N 150 112.086 114.157 -2.071 1
1 746 . 19 1 1 A 62 62 ARG H H 151 7.829 7.846 -0.017 1
1 747 . 19 1 1 A 62 62 ARG HA H 151 3.971 4.076 -0.105 1
1 754 . 19 1 1 A 62 62 ARG C C 151 178.287 178.398 -0.111 1
1 755 . 19 1 1 A 62 62 ARG CA C 151 59.340 58.985 0.355 1
1 756 . 19 1 1 A 62 62 ARG CB C 151 29.760 29.675 0.085 1
1 759 . 19 1 1 A 62 62 ARG N N 151 121.090 119.407 1.683 1
1 760 . 19 1 1 A 63 63 LEU H H 152 7.390 7.533 -0.143 1
1 761 . 19 1 1 A 63 63 LEU HA H 152 3.791 3.908 -0.117 1
1 771 . 19 1 1 A 63 63 LEU C C 152 179.106 178.248 0.858 1
1 772 . 19 1 1 A 63 63 LEU CA C 152 58.900 58.267 0.633 1
1 773 . 19 1 1 A 63 63 LEU CB C 152 41.140 41.492 -0.352 1
1 777 . 19 1 1 A 63 63 LEU N N 152 121.129 122.337 -1.208 1
1 778 . 19 1 1 A 64 64 VAL H H 153 7.552 8.045 -0.493 1
1 779 . 19 1 1 A 64 64 VAL HA H 153 3.411 3.459 -0.048 1
1 787 . 19 1 1 A 64 64 VAL C C 153 180.595 178.170 2.425 1
1 788 . 19 1 1 A 64 64 VAL CA C 153 65.644 66.145 -0.501 1
1 789 . 19 1 1 A 64 64 VAL CB C 153 31.410 31.341 0.069 1
1 792 . 19 1 1 A 64 64 VAL N N 153 118.280 118.968 -0.688 1
1 793 . 19 1 1 A 65 65 GLY H H 154 8.061 8.156 -0.095 1
1 794 . 19 1 1 A 65 65 GLY HA2 H 154 3.846 3.727 0.119 1
1 795 . 19 1 1 A 65 65 GLY HA3 H 154 3.809 3.728 0.081 1
1 796 . 19 1 1 A 65 65 GLY C C 154 175.235 176.374 -1.139 1
1 797 . 19 1 1 A 65 65 GLY CA C 154 46.630 47.026 -0.396 1
1 798 . 19 1 1 A 65 65 GLY N N 154 108.622 107.938 0.684 1
1 799 . 19 1 1 A 66 66 GLU H H 155 7.528 7.630 -0.102 1
1 800 . 19 1 1 A 66 66 GLU HA H 155 4.228 4.305 -0.077 1
1 805 . 19 1 1 A 66 66 GLU C C 155 176.761 176.858 -0.097 1
1 806 . 19 1 1 A 66 66 GLU CA C 155 56.590 56.391 0.199 1
1 807 . 19 1 1 A 66 66 GLU CB C 155 30.490 30.080 0.410 1
1 809 . 19 1 1 A 66 66 GLU N N 155 118.361 119.345 -0.984 1
1 810 . 19 1 1 A 67 67 GLY H H 156 7.884 7.830 0.054 1
1 811 . 19 1 1 A 67 67 GLY HA2 H 156 3.918 3.862 0.056 1
1 812 . 19 1 1 A 67 67 GLY HA3 H 156 3.747 3.876 -0.129 1
1 813 . 19 1 1 A 67 67 GLY C C 156 174.788 174.582 0.206 1
1 814 . 19 1 1 A 67 67 GLY CA C 156 45.890 45.579 0.311 1
1 815 . 19 1 1 A 67 67 GLY N N 156 108.465 109.162 -0.697 1
1 816 . 19 1 1 A 68 68 LEU H H 157 7.332 7.490 -0.158 1
1 817 . 19 1 1 A 68 68 LEU HA H 157 4.361 4.386 -0.025 1
1 827 . 19 1 1 A 68 68 LEU CA C 157 53.060 52.998 0.062 1
1 828 . 19 1 1 A 68 68 LEU CB C 157 41.100 42.071 -0.971 1
1 832 . 19 1 1 A 68 68 LEU N N 157 121.920 121.796 0.124 1
1 833 . 19 1 1 A 69 69 PRO HA H 158 4.485 4.584 -0.099 1
1 840 . 19 1 1 A 69 69 PRO C C 158 174.602 176.355 -1.753 1
1 841 . 19 1 1 A 69 69 PRO CA C 158 61.556 62.252 -0.696 1
1 842 . 19 1 1 A 69 69 PRO CB C 158 32.370 32.385 -0.015 1
1 845 . 19 1 1 A 70 70 HIS H H 159 8.734 8.627 0.107 1
1 846 . 19 1 1 A 70 70 HIS HA H 159 3.947 4.457 -0.510 1
1 852 . 19 1 1 A 70 70 HIS CA C 159 56.250 55.241 1.009 1
1 853 . 19 1 1 A 70 70 HIS CB C 159 32.280 30.992 1.288 1
1 856 . 19 1 1 A 70 70 HIS N N 159 119.423 121.816 -2.393 1
1 857 . 19 1 1 A 71 71 PRO HA H 160 4.424 4.191 0.233 1
1 864 . 19 1 1 A 71 71 PRO C C 160 177.567 178.507 -0.940 1
1 865 . 19 1 1 A 71 71 PRO CA C 160 64.574 65.530 -0.956 1
1 866 . 19 1 1 A 71 71 PRO CB C 160 32.340 31.780 0.560 1
1 869 . 19 1 1 A 72 72 LEU H H 161 10.123 7.440 2.683 1
1 870 . 19 1 1 A 72 72 LEU HA H 161 4.778 4.298 0.480 1
1 880 . 19 1 1 A 72 72 LEU C C 161 178.721 178.005 0.716 1
1 881 . 19 1 1 A 72 72 LEU CA C 161 55.800 57.078 -1.278 1
1 882 . 19 1 1 A 72 72 LEU CB C 161 42.440 42.466 -0.026 1
1 886 . 19 1 1 A 72 72 LEU N N 161 117.374 117.380 -0.006 1
1 887 . 19 1 1 A 73 73 THR H H 162 7.523 7.687 -0.164 1
1 888 . 19 1 1 A 73 73 THR HA H 162 4.291 4.566 -0.275 1
1 893 . 19 1 1 A 73 73 THR C C 162 175.557 174.391 1.166 1
1 894 . 19 1 1 A 73 73 THR CA C 162 61.440 62.168 -0.728 1
1 895 . 19 1 1 A 73 73 THR CB C 162 70.500 69.634 0.866 1
1 897 . 19 1 1 A 73 73 THR N N 162 107.787 111.542 -3.755 1
1 898 . 19 1 1 A 74 74 ARG H H 163 8.361 7.970 0.391 1
1 899 . 19 1 1 A 74 74 ARG HA H 163 3.836 4.160 -0.324 1
1 906 . 19 1 1 A 74 74 ARG C C 163 174.701 175.316 -0.615 1
1 907 . 19 1 1 A 74 74 ARG CA C 163 57.980 57.470 0.510 1
1 908 . 19 1 1 A 74 74 ARG CB C 163 26.770 26.955 -0.185 1
1 911 . 19 1 1 A 74 74 ARG N N 163 115.130 118.390 -3.260 1
1 912 . 19 1 1 A 75 75 GLU H H 164 7.430 8.109 -0.679 1
1 913 . 19 1 1 A 75 75 GLU HA H 164 4.636 4.435 0.201 1
1 918 . 19 1 1 A 75 75 GLU CA C 164 53.699 55.113 -1.414 1
1 919 . 19 1 1 A 75 75 GLU CB C 164 29.550 28.729 0.821 1
1 921 . 19 1 1 A 75 75 GLU N N 164 120.076 118.912 1.164 1
1 922 . 19 1 1 A 76 76 PRO HA H 165 4.272 4.631 -0.359 1
1 929 . 19 1 1 A 76 76 PRO C C 165 176.649 176.936 -0.287 1
1 930 . 19 1 1 A 76 76 PRO CA C 165 63.204 62.934 0.270 1
1 931 . 19 1 1 A 76 76 PRO CB C 165 31.680 31.579 0.101 1
1 934 . 19 1 1 A 77 77 ILE H H 166 8.812 8.202 0.610 1
1 935 . 19 1 1 A 77 77 ILE HA H 166 3.838 4.350 -0.512 1
1 945 . 19 1 1 A 77 77 ILE C C 166 175.235 175.786 -0.551 1
1 946 . 19 1 1 A 77 77 ILE CA C 166 62.816 61.133 1.683 1
1 947 . 19 1 1 A 77 77 ILE CB C 166 37.750 37.549 0.201 1
1 951 . 19 1 1 A 77 77 ILE N N 166 123.831 124.126 -0.295 1
1 952 . 19 1 1 A 78 78 THR H H 167 6.625 8.627 -2.002 1
1 953 . 19 1 1 A 78 78 THR HA H 167 4.632 4.999 -0.367 1
1 958 . 19 1 1 A 78 78 THR C C 167 174.143 174.394 -0.251 1
1 959 . 19 1 1 A 78 78 THR CA C 167 58.750 59.892 -1.142 1
1 960 . 19 1 1 A 78 78 THR CB C 167 71.320 71.229 0.091 1
1 962 . 19 1 1 A 78 78 THR N N 167 115.293 118.098 -2.805 1
1 963 . 19 1 1 A 79 79 ALA H H 168 9.088 8.989 0.099 1
1 964 . 19 1 1 A 79 79 ALA HA H 168 3.916 4.129 -0.213 1
1 968 . 19 1 1 A 79 79 ALA C C 168 179.770 179.497 0.273 1
1 969 . 19 1 1 A 79 79 ALA CA C 168 55.480 55.049 0.431 1
1 970 . 19 1 1 A 79 79 ALA CB C 168 17.630 18.309 -0.679 1
1 971 . 19 1 1 A 79 79 ALA N N 168 122.102 127.414 -5.312 1
1 972 . 19 1 1 A 80 80 SER H H 169 7.988 7.907 0.081 1
1 973 . 19 1 1 A 80 80 SER HA H 169 4.091 4.228 -0.137 1
1 976 . 19 1 1 A 80 80 SER C C 169 175.836 176.436 -0.600 1
1 977 . 19 1 1 A 80 80 SER CA C 169 60.750 61.575 -0.825 1
1 978 . 19 1 1 A 80 80 SER CB C 169 62.510 63.035 -0.525 1
1 979 . 19 1 1 A 80 80 SER N N 169 109.660 113.480 -3.820 1
1 980 . 19 1 1 A 81 81 ILE H H 170 7.052 7.724 -0.672 1
1 981 . 19 1 1 A 81 81 ILE HA H 170 4.344 4.022 0.322 1
1 991 . 19 1 1 A 81 81 ILE C C 170 174.236 176.571 -2.335 1
1 992 . 19 1 1 A 81 81 ILE CA C 170 61.760 64.162 -2.402 1
1 993 . 19 1 1 A 81 81 ILE CB C 170 37.950 37.309 0.641 1
1 997 . 19 1 1 A 81 81 ILE N N 170 112.623 114.677 -2.054 1
1 998 . 19 1 1 A 82 82 ILE H H 171 7.345 7.631 -0.286 1
1 999 . 19 1 1 A 82 82 ILE HA H 171 4.288 4.034 0.254 1
1 1009 . 19 1 1 A 82 82 ILE C C 171 174.931 175.281 -0.350 1
1 1010 . 19 1 1 A 82 82 ILE CA C 171 61.420 61.811 -0.391 1
1 1011 . 19 1 1 A 82 82 ILE CB C 171 37.230 37.767 -0.537 1
1 1015 . 19 1 1 A 82 82 ILE N N 171 124.260 124.942 -0.682 1
1 1016 . 19 1 1 A 83 83 VAL H H 172 7.843 8.597 -0.754 1
1 1017 . 19 1 1 A 83 83 VAL HA H 172 4.818 5.008 -0.190 1
1 1025 . 19 1 1 A 83 83 VAL C C 172 174.918 175.547 -0.629 1
1 1026 . 19 1 1 A 83 83 VAL CA C 172 58.910 59.059 -0.149 1
1 1027 . 19 1 1 A 83 83 VAL CB C 172 34.570 35.368 -0.798 1
1 1030 . 19 1 1 A 83 83 VAL N N 172 118.856 121.843 -2.987 1
1 1031 . 19 1 1 A 84 84 LYS H H 173 8.347 8.691 -0.344 1
1 1032 . 19 1 1 A 84 84 LYS HA H 173 4.356 4.378 -0.022 1
1 1041 . 19 1 1 A 84 84 LYS C C 173 178.653 178.014 0.639 1
1 1042 . 19 1 1 A 84 84 LYS CA C 173 56.360 56.435 -0.075 1
1 1043 . 19 1 1 A 84 84 LYS CB C 173 33.366 33.145 0.221 1
1 1047 . 19 1 1 A 84 84 LYS N N 173 119.602 122.435 -2.833 1
1 1048 . 19 1 1 A 85 85 HIS H H 174 9.143 9.091 0.052 1
1 1049 . 19 1 1 A 85 85 HIS HA H 174 4.013 4.315 -0.302 1
1 1053 . 19 1 1 A 85 85 HIS C C 174 176.606 176.615 -0.009 1
1 1054 . 19 1 1 A 85 85 HIS CA C 174 58.820 60.513 -1.693 1
1 1055 . 19 1 1 A 85 85 HIS CB C 174 28.186 29.943 -1.757 1
1 1057 . 19 1 1 A 85 85 HIS N N 174 120.022 122.318 -2.296 1
1 1058 . 19 1 1 A 86 86 GLU H H 175 8.403 8.228 0.175 1
1 1059 . 19 1 1 A 86 86 GLU HA H 175 3.863 3.805 0.058 1
1 1064 . 19 1 1 A 86 86 GLU C C 175 177.040 179.201 -2.161 1
1 1065 . 19 1 1 A 86 86 GLU CA C 175 57.830 59.883 -2.053 1
1 1066 . 19 1 1 A 86 86 GLU CB C 175 28.690 29.575 -0.885 1
1 1068 . 19 1 1 A 86 86 GLU N N 175 116.124 118.824 -2.700 1
1 1069 . 19 1 1 A 87 87 GLU H H 176 7.669 7.977 -0.308 1
1 1070 . 19 1 1 A 87 87 GLU HA H 176 4.039 4.274 -0.235 1
1 1075 . 19 1 1 A 87 87 GLU C C 176 175.688 177.454 -1.766 1
1 1076 . 19 1 1 A 87 87 GLU CA C 176 57.906 59.175 -1.269 1
1 1077 . 19 1 1 A 87 87 GLU CB C 176 30.430 28.924 1.506 1
1 1079 . 19 1 1 A 87 87 GLU N N 176 116.183 119.761 -3.578 1
1 1080 . 19 1 1 A 88 88 CYS H H 177 6.750 7.096 -0.346 1
1 1081 . 19 1 1 A 88 88 CYS HA H 177 4.991 4.679 0.312 1
1 1084 . 19 1 1 A 88 88 CYS C C 177 172.325 173.533 -1.208 1
1 1085 . 19 1 1 A 88 88 CYS CA C 177 55.030 54.258 0.772 1
1 1086 . 19 1 1 A 88 88 CYS CB C 177 45.610 42.196 3.414 1
1 1087 . 19 1 1 A 88 88 CYS N N 177 114.838 117.736 -2.898 1
1 1088 . 19 1 1 A 89 89 ILE H H 178 9.128 8.970 0.158 1
1 1089 . 19 1 1 A 89 89 ILE HA H 178 4.536 4.864 -0.328 1
1 1099 . 19 1 1 A 89 89 ILE C C 178 174.893 174.542 0.351 1
1 1100 . 19 1 1 A 89 89 ILE CA C 178 59.160 59.115 0.045 1
1 1101 . 19 1 1 A 89 89 ILE CB C 178 41.840 40.864 0.976 1
1 1105 . 19 1 1 A 89 89 ILE N N 178 120.564 120.941 -0.377 1
1 1106 . 19 1 1 A 90 90 TYR H H 179 9.349 9.075 0.274 1
1 1107 . 19 1 1 A 90 90 TYR HA H 179 3.568 4.492 -0.924 1
1 1112 . 19 1 1 A 90 90 TYR C C 179 173.950 174.156 -0.206 1
1 1113 . 19 1 1 A 90 90 TYR CA C 179 61.180 58.674 2.506 1
1 1114 . 19 1 1 A 90 90 TYR CB C 179 37.530 39.075 -1.545 1
1 1116 . 19 1 1 A 90 90 TYR N N 179 129.033 126.302 2.731 1
1 1117 . 19 1 1 A 91 91 ASP H H 180 7.367 8.235 -0.868 1
1 1118 . 19 1 1 A 91 91 ASP HA H 180 4.662 4.653 0.009 1
1 1121 . 19 1 1 A 91 91 ASP C C 180 175.291 175.387 -0.096 1
1 1122 . 19 1 1 A 91 91 ASP CA C 180 52.230 52.160 0.070 1
1 1123 . 19 1 1 A 91 91 ASP CB C 180 43.650 42.334 1.316 1
1 1124 . 19 1 1 A 91 91 ASP N N 180 129.305 127.952 1.353 1
1 1125 . 19 1 1 A 92 92 ASP H H 181 8.783 8.390 0.393 1
1 1126 . 19 1 1 A 92 92 ASP HA H 181 4.114 3.820 0.294 1
1 1129 . 19 1 1 A 92 92 ASP C C 181 177.573 177.511 0.062 1
1 1130 . 19 1 1 A 92 92 ASP CA C 181 56.390 56.774 -0.384 1
1 1131 . 19 1 1 A 92 92 ASP CB C 181 41.330 40.279 1.051 1
1 1132 . 19 1 1 A 92 92 ASP N N 181 125.665 125.937 -0.272 1
1 1133 . 19 1 1 A 93 93 THR H H 182 8.284 7.805 0.479 1
1 1134 . 19 1 1 A 93 93 THR HA H 182 4.037 3.882 0.155 1
1 1139 . 19 1 1 A 93 93 THR C C 182 176.333 176.084 0.249 1
1 1140 . 19 1 1 A 93 93 THR CA C 182 65.320 66.546 -1.226 1
1 1141 . 19 1 1 A 93 93 THR CB C 182 68.560 68.130 0.430 1
1 1143 . 19 1 1 A 93 93 THR N N 182 114.688 116.207 -1.519 1
1 1144 . 19 1 1 A 94 94 ARG H H 183 7.784 7.439 0.345 1
1 1145 . 19 1 1 A 94 94 ARG HA H 183 4.142 4.253 -0.111 1
1 1152 . 19 1 1 A 94 94 ARG C C 183 177.015 177.000 0.015 1
1 1153 . 19 1 1 A 94 94 ARG CA C 183 55.350 56.077 -0.727 1
1 1154 . 19 1 1 A 94 94 ARG CB C 183 30.930 31.015 -0.085 1
1 1157 . 19 1 1 A 94 94 ARG N N 183 120.156 118.466 1.690 1
1 1158 . 19 1 1 A 95 95 GLY H H 184 8.144 8.994 -0.850 1
1 1159 . 19 1 1 A 95 95 GLY HA2 H 184 3.839 3.858 -0.019 1
1 1160 . 19 1 1 A 95 95 GLY HA3 H 184 3.681 3.862 -0.181 1
1 1161 . 19 1 1 A 95 95 GLY C C 184 173.653 173.203 0.450 1
1 1162 . 19 1 1 A 95 95 GLY CA C 184 46.160 46.103 0.057 1
1 1163 . 19 1 1 A 95 95 GLY N N 184 107.879 109.064 -1.185 1
1 1164 . 19 1 1 A 96 96 ASN H H 185 6.855 7.313 -0.458 1
1 1165 . 19 1 1 A 96 96 ASN HA H 185 4.909 4.843 0.066 1
1 1170 . 19 1 1 A 96 96 ASN C C 185 174.223 173.270 0.953 1
1 1171 . 19 1 1 A 96 96 ASN CA C 185 52.720 52.052 0.668 1
1 1172 . 19 1 1 A 96 96 ASN CB C 185 45.620 41.840 3.780 1
1 1173 . 19 1 1 A 96 96 ASN N N 185 113.382 116.757 -3.375 1
1 1175 . 19 1 1 A 97 97 PHE H H 186 9.228 8.319 0.909 1
1 1176 . 19 1 1 A 97 97 PHE HA H 186 4.579 5.400 -0.821 1
1 1183 . 19 1 1 A 97 97 PHE C C 186 174.794 175.317 -0.523 1
1 1184 . 19 1 1 A 97 97 PHE CA C 186 59.384 57.367 2.017 1
1 1185 . 19 1 1 A 97 97 PHE CB C 186 40.450 40.253 0.197 1
1 1188 . 19 1 1 A 97 97 PHE N N 186 118.661 119.063 -0.402 1
1 1189 . 19 1 1 A 98 98 ILE H H 187 8.908 9.265 -0.357 1
1 1190 . 19 1 1 A 98 98 ILE HA H 187 5.440 5.032 0.408 1
1 1200 . 19 1 1 A 98 98 ILE C C 187 176.171 174.235 1.936 1
1 1201 . 19 1 1 A 98 98 ILE CA C 187 57.610 59.793 -2.183 1
1 1202 . 19 1 1 A 98 98 ILE CB C 187 41.280 40.917 0.363 1
1 1206 . 19 1 1 A 98 98 ILE N N 187 120.585 122.772 -2.187 1
1 1207 . 19 1 1 A 99 99 ILE H H 188 8.602 8.344 0.258 1
1 1208 . 19 1 1 A 99 99 ILE HA H 188 4.546 4.968 -0.422 1
1 1218 . 19 1 1 A 99 99 ILE C C 188 176.668 175.289 1.379 1
1 1219 . 19 1 1 A 99 99 ILE CA C 188 58.920 60.396 -1.476 1
1 1220 . 19 1 1 A 99 99 ILE CB C 188 37.960 39.148 -1.188 1
1 1224 . 19 1 1 A 99 99 ILE N N 188 124.500 125.678 -1.178 1
1 1225 . 19 1 1 A 100 100 LYS H H 189 8.449 8.535 -0.086 1
1 1226 . 19 1 1 A 100 100 LYS HA H 189 4.108 4.760 -0.652 1
1 1235 . 19 1 1 A 100 100 LYS C C 189 176.866 175.412 1.454 1
1 1236 . 19 1 1 A 100 100 LYS CA C 189 56.800 55.479 1.321 1
1 1237 . 19 1 1 A 100 100 LYS CB C 189 33.400 35.308 -1.908 1
1 1241 . 19 1 1 A 100 100 LYS N N 189 128.581 127.101 1.480 1
1 1242 . 19 1 1 A 101 101 GLY H H 190 8.381 8.332 0.049 1
1 1243 . 19 1 1 A 101 101 GLY HA2 H 190 3.946 4.037 -0.091 1
1 1244 . 19 1 1 A 101 101 GLY HA3 H 190 3.828 4.040 -0.212 1
1 1245 . 19 1 1 A 101 101 GLY C C 190 172.902 174.621 -1.719 1
1 1246 . 19 1 1 A 101 101 GLY CA C 190 44.920 45.934 -1.014 1
1 1247 . 19 1 1 A 101 101 GLY N N 190 111.183 112.620 -1.437 1
1 7 . 20 1 1 A 2 2 GLN H H 91 8.786 8.894 -0.108 1
1 8 . 20 1 1 A 2 2 GLN HA H 91 4.005 3.959 0.046 1
1 15 . 20 1 1 A 2 2 GLN C C 91 177.270 177.349 -0.079 1
1 16 . 20 1 1 A 2 2 GLN CA C 91 58.220 59.284 -1.064 1
1 17 . 20 1 1 A 2 2 GLN CB C 91 28.650 28.155 0.495 1
1 19 . 20 1 1 A 2 2 GLN N N 91 121.993 121.801 0.192 1
1 21 . 20 1 1 A 3 3 GLU H H 92 8.430 8.493 -0.063 1
1 22 . 20 1 1 A 3 3 GLU HA H 92 4.007 4.067 -0.060 1
1 27 . 20 1 1 A 3 3 GLU C C 92 178.287 178.744 -0.457 1
1 28 . 20 1 1 A 3 3 GLU CA C 92 59.490 59.664 -0.174 1
1 29 . 20 1 1 A 3 3 GLU CB C 92 29.506 29.268 0.238 1
1 31 . 20 1 1 A 3 3 GLU N N 92 120.195 120.021 0.174 1
1 32 . 20 1 1 A 4 4 SER H H 93 8.209 7.501 0.708 1
1 33 . 20 1 1 A 4 4 SER HA H 93 4.272 4.271 0.001 1
1 36 . 20 1 1 A 4 4 SER C C 93 177.369 177.435 -0.066 1
1 37 . 20 1 1 A 4 4 SER CA C 93 61.044 61.262 -0.218 1
1 38 . 20 1 1 A 4 4 SER CB C 93 62.950 62.782 0.168 1
1 39 . 20 1 1 A 4 4 SER N N 93 115.524 114.320 1.204 1
1 40 . 20 1 1 A 5 5 ILE H H 94 8.080 7.609 0.471 1
1 41 . 20 1 1 A 5 5 ILE HA H 94 3.530 3.633 -0.103 1
1 51 . 20 1 1 A 5 5 ILE C C 94 177.778 177.607 0.171 1
1 52 . 20 1 1 A 5 5 ILE CA C 94 65.710 65.330 0.380 1
1 53 . 20 1 1 A 5 5 ILE CB C 94 37.800 37.365 0.435 1
1 57 . 20 1 1 A 5 5 ILE N N 94 124.148 122.080 2.068 1
1 58 . 20 1 1 A 6 6 GLN H H 95 8.374 8.088 0.286 1
1 59 . 20 1 1 A 6 6 GLN HA H 95 4.125 3.907 0.218 1
1 66 . 20 1 1 A 6 6 GLN C C 95 179.726 179.322 0.404 1
1 67 . 20 1 1 A 6 6 GLN CA C 95 59.190 58.960 0.230 1
1 68 . 20 1 1 A 6 6 GLN CB C 95 27.060 28.494 -1.434 1
1 70 . 20 1 1 A 6 6 GLN N N 95 118.257 118.981 -0.724 1
1 72 . 20 1 1 A 7 7 ASN H H 96 8.456 8.197 0.259 1
1 73 . 20 1 1 A 7 7 ASN HA H 96 4.446 4.572 -0.126 1
1 78 . 20 1 1 A 7 7 ASN C C 96 177.257 177.647 -0.390 1
1 79 . 20 1 1 A 7 7 ASN CA C 96 56.020 56.048 -0.028 1
1 80 . 20 1 1 A 7 7 ASN CB C 96 38.126 37.877 0.249 1
1 81 . 20 1 1 A 7 7 ASN N N 96 118.597 118.453 0.144 1
1 83 . 20 1 1 A 8 8 LYS H H 97 7.732 7.884 -0.152 1
1 84 . 20 1 1 A 8 8 LYS HA H 97 4.129 4.109 0.020 1
1 93 . 20 1 1 A 8 8 LYS C C 97 179.143 179.290 -0.147 1
1 94 . 20 1 1 A 8 8 LYS CA C 97 59.126 59.726 -0.600 1
1 95 . 20 1 1 A 8 8 LYS CB C 97 32.070 32.232 -0.162 1
1 99 . 20 1 1 A 8 8 LYS N N 97 122.381 120.065 2.316 1
1 100 . 20 1 1 A 9 9 ILE H H 98 8.452 8.039 0.413 1
1 101 . 20 1 1 A 9 9 ILE HA H 98 3.480 3.972 -0.492 1
1 111 . 20 1 1 A 9 9 ILE C C 98 177.406 178.864 -1.458 1
1 112 . 20 1 1 A 9 9 ILE CA C 98 66.430 63.907 2.523 1
1 113 . 20 1 1 A 9 9 ILE CB C 98 37.980 37.350 0.630 1
1 117 . 20 1 1 A 9 9 ILE N N 98 119.950 120.237 -0.287 1
1 118 . 20 1 1 A 10 10 SER H H 99 7.924 7.793 0.131 1
1 119 . 20 1 1 A 10 10 SER HA H 99 3.983 4.387 -0.404 1
1 122 . 20 1 1 A 10 10 SER C C 99 176.327 176.167 0.160 1
1 123 . 20 1 1 A 10 10 SER CA C 99 61.990 61.096 0.894 1
1 124 . 20 1 1 A 10 10 SER CB C 99 62.790 63.538 -0.748 1
1 125 . 20 1 1 A 10 10 SER N N 99 113.568 118.900 -5.332 1
1 126 . 20 1 1 A 11 11 GLN H H 100 7.832 7.812 0.020 1
1 127 . 20 1 1 A 11 11 GLN HA H 100 4.238 4.455 -0.217 1
1 134 . 20 1 1 A 11 11 GLN C C 100 178.088 178.236 -0.148 1
1 135 . 20 1 1 A 11 11 GLN CA C 100 57.900 57.045 0.855 1
1 136 . 20 1 1 A 11 11 GLN CB C 100 29.790 29.904 -0.114 1
1 138 . 20 1 1 A 11 11 GLN N N 100 117.487 117.626 -0.139 1
1 140 . 20 1 1 A 12 12 CYS H H 101 7.920 7.889 0.031 1
1 141 . 20 1 1 A 12 12 CYS HA H 101 4.657 4.539 0.118 1
1 144 . 20 1 1 A 12 12 CYS C C 101 175.439 174.491 0.948 1
1 145 . 20 1 1 A 12 12 CYS CA C 101 60.654 59.196 1.458 1
1 146 . 20 1 1 A 12 12 CYS CB C 101 29.310 28.161 1.149 1
1 147 . 20 1 1 A 12 12 CYS N N 101 114.221 118.664 -4.443 1
1 148 . 20 1 1 A 13 13 LYS H H 102 7.993 7.415 0.578 1
1 149 . 20 1 1 A 13 13 LYS HA H 102 5.038 4.462 0.576 1
1 158 . 20 1 1 A 13 13 LYS C C 102 174.757 176.144 -1.387 1
1 159 . 20 1 1 A 13 13 LYS CA C 102 56.660 55.929 0.731 1
1 160 . 20 1 1 A 13 13 LYS CB C 102 32.970 33.464 -0.494 1
1 164 . 20 1 1 A 13 13 LYS N N 102 123.841 119.012 4.829 1
1 165 . 20 1 1 A 14 14 PHE H H 103 8.822 8.637 0.185 1
1 166 . 20 1 1 A 14 14 PHE HA H 103 5.058 5.082 -0.024 1
1 174 . 20 1 1 A 14 14 PHE C C 103 173.560 172.773 0.787 1
1 175 . 20 1 1 A 14 14 PHE CA C 103 55.470 56.064 -0.594 1
1 176 . 20 1 1 A 14 14 PHE CB C 103 41.760 40.700 1.060 1
1 180 . 20 1 1 A 14 14 PHE N N 103 118.421 116.078 2.343 1
1 181 . 20 1 1 A 15 15 SER H H 104 8.826 8.790 0.036 1
1 182 . 20 1 1 A 15 15 SER HA H 104 4.602 4.649 -0.047 1
1 185 . 20 1 1 A 15 15 SER C C 104 173.851 173.504 0.347 1
1 186 . 20 1 1 A 15 15 SER CA C 104 58.610 58.774 -0.164 1
1 187 . 20 1 1 A 15 15 SER CB C 104 62.690 62.660 0.030 1
1 188 . 20 1 1 A 15 15 SER N N 104 117.781 116.675 1.106 1
1 189 . 20 1 1 A 16 16 VAL H H 105 7.839 8.271 -0.432 1
1 190 . 20 1 1 A 16 16 VAL HA H 105 3.390 4.302 -0.912 1
1 198 . 20 1 1 A 16 16 VAL C C 105 174.987 175.311 -0.324 1
1 199 . 20 1 1 A 16 16 VAL CA C 105 63.650 62.303 1.347 1
1 200 . 20 1 1 A 16 16 VAL CB C 105 31.410 30.566 0.844 1
1 203 . 20 1 1 A 16 16 VAL N N 105 129.036 126.829 2.207 1
1 204 . 20 1 1 A 17 17 CYS H H 106 8.536 8.538 -0.002 1
1 205 . 20 1 1 A 17 17 CYS HA H 106 5.011 4.918 0.093 1
1 208 . 20 1 1 A 17 17 CYS CA C 106 55.260 56.483 -1.223 1
1 209 . 20 1 1 A 17 17 CYS CB C 106 28.210 30.989 -2.779 1
1 210 . 20 1 1 A 17 17 CYS N N 106 130.045 127.233 2.812 1
1 211 . 20 1 1 A 18 18 PRO HA H 107 3.991 4.328 -0.337 1
1 218 . 20 1 1 A 18 18 PRO C C 107 178.188 178.405 -0.217 1
1 219 . 20 1 1 A 18 18 PRO CA C 107 65.940 65.792 0.148 1
1 220 . 20 1 1 A 18 18 PRO CB C 107 32.000 31.740 0.260 1
1 223 . 20 1 1 A 19 19 GLU H H 108 9.260 9.041 0.219 1
1 224 . 20 1 1 A 19 19 GLU HA H 108 4.119 4.059 0.060 1
1 229 . 20 1 1 A 19 19 GLU C C 108 178.721 179.204 -0.483 1
1 230 . 20 1 1 A 19 19 GLU CA C 108 59.300 59.480 -0.180 1
1 231 . 20 1 1 A 19 19 GLU CB C 108 28.920 28.720 0.200 1
1 233 . 20 1 1 A 19 19 GLU N N 108 118.270 116.715 1.555 1
1 234 . 20 1 1 A 20 20 ARG H H 109 7.672 7.844 -0.172 1
1 235 . 20 1 1 A 20 20 ARG HA H 109 4.331 4.120 0.211 1
1 242 . 20 1 1 A 20 20 ARG C C 109 177.977 178.792 -0.815 1
1 243 . 20 1 1 A 20 20 ARG CA C 109 57.350 59.176 -1.826 1
1 244 . 20 1 1 A 20 20 ARG CB C 109 30.820 30.291 0.529 1
1 247 . 20 1 1 A 20 20 ARG N N 109 118.357 119.644 -1.287 1
1 248 . 20 1 1 A 21 21 LEU H H 110 7.601 7.882 -0.281 1
1 249 . 20 1 1 A 21 21 LEU HA H 110 4.380 4.349 0.031 1
1 259 . 20 1 1 A 21 21 LEU C C 110 176.562 176.295 0.267 1
1 260 . 20 1 1 A 21 21 LEU CA C 110 56.096 55.415 0.681 1
1 261 . 20 1 1 A 21 21 LEU CB C 110 44.016 42.341 1.675 1
1 265 . 20 1 1 A 21 21 LEU N N 110 118.626 118.872 -0.246 1
1 266 . 20 1 1 A 22 22 GLN H H 111 7.750 7.712 0.038 1
1 267 . 20 1 1 A 22 22 GLN HA H 111 3.870 3.978 -0.108 1
1 274 . 20 1 1 A 22 22 GLN C C 111 173.336 174.714 -1.378 1
1 275 . 20 1 1 A 22 22 GLN CA C 111 56.510 57.669 -1.159 1
1 276 . 20 1 1 A 22 22 GLN CB C 111 26.800 26.479 0.321 1
1 278 . 20 1 1 A 22 22 GLN N N 111 113.926 115.832 -1.906 1
1 280 . 20 1 1 A 23 23 CYS H H 112 7.407 7.551 -0.144 1
1 281 . 20 1 1 A 23 23 CYS HA H 112 4.469 4.865 -0.396 1
1 284 . 20 1 1 A 23 23 CYS CA C 112 52.650 56.976 -4.326 1
1 285 . 20 1 1 A 23 23 CYS CB C 112 29.750 28.654 1.096 1
1 286 . 20 1 1 A 23 23 CYS N N 112 112.681 118.054 -5.373 1
1 287 . 20 1 1 A 24 24 PRO HA H 113 4.408 4.483 -0.075 1
1 294 . 20 1 1 A 24 24 PRO C C 113 178.175 177.522 0.653 1
1 295 . 20 1 1 A 24 24 PRO CA C 113 62.040 62.327 -0.287 1
1 296 . 20 1 1 A 24 24 PRO CB C 113 31.920 32.534 -0.614 1
1 299 . 20 1 1 A 25 25 LEU H H 114 8.593 8.741 -0.148 1
1 300 . 20 1 1 A 25 25 LEU HA H 114 3.765 4.062 -0.297 1
1 310 . 20 1 1 A 25 25 LEU C C 114 179.950 178.583 1.367 1
1 311 . 20 1 1 A 25 25 LEU CA C 114 57.674 57.952 -0.278 1
1 312 . 20 1 1 A 25 25 LEU CB C 114 40.690 41.506 -0.816 1
1 316 . 20 1 1 A 25 25 LEU N N 114 123.729 124.079 -0.350 1
1 317 . 20 1 1 A 26 26 GLU H H 115 9.108 8.291 0.817 1
1 318 . 20 1 1 A 26 26 GLU HA H 115 3.876 4.206 -0.330 1
1 323 . 20 1 1 A 26 26 GLU C C 115 177.505 179.214 -1.709 1
1 324 . 20 1 1 A 26 26 GLU CA C 115 59.410 59.572 -0.162 1
1 325 . 20 1 1 A 26 26 GLU CB C 115 28.460 29.251 -0.791 1
1 327 . 20 1 1 A 26 26 GLU N N 115 116.817 117.933 -1.116 1
1 328 . 20 1 1 A 27 27 ALA H H 116 7.360 7.793 -0.433 1
1 329 . 20 1 1 A 27 27 ALA HA H 116 4.408 3.986 0.422 1
1 333 . 20 1 1 A 27 27 ALA C C 116 177.046 178.442 -1.396 1
1 334 . 20 1 1 A 27 27 ALA CA C 116 52.970 54.763 -1.793 1
1 335 . 20 1 1 A 27 27 ALA CB C 116 19.916 18.078 1.838 1
1 336 . 20 1 1 A 27 27 ALA N N 116 118.966 121.800 -2.834 1
1 337 . 20 1 1 A 28 28 ILE H H 117 7.168 7.295 -0.127 1
1 338 . 20 1 1 A 28 28 ILE HA H 117 4.432 4.806 -0.374 1
1 348 . 20 1 1 A 28 28 ILE C C 117 172.641 175.560 -2.919 1
1 349 . 20 1 1 A 28 28 ILE CA C 117 59.980 60.453 -0.473 1
1 350 . 20 1 1 A 28 28 ILE CB C 117 37.350 38.006 -0.656 1
1 354 . 20 1 1 A 28 28 ILE N N 117 108.913 109.326 -0.413 1
1 355 . 20 1 1 A 29 29 GLN H H 118 6.562 7.782 -1.220 1
1 356 . 20 1 1 A 29 29 GLN HA H 118 3.922 4.252 -0.330 1
1 363 . 20 1 1 A 29 29 GLN C C 118 175.049 175.697 -0.648 1
1 364 . 20 1 1 A 29 29 GLN CA C 118 54.596 55.948 -1.352 1
1 365 . 20 1 1 A 29 29 GLN CB C 118 29.570 29.285 0.285 1
1 367 . 20 1 1 A 29 29 GLN N N 118 116.455 123.267 -6.812 1
1 369 . 20 1 1 A 30 30 CYS H H 119 8.138 8.519 -0.381 1
1 370 . 20 1 1 A 30 30 CYS HA H 119 4.580 4.498 0.082 1
1 373 . 20 1 1 A 30 30 CYS CA C 119 57.810 57.693 0.117 1
1 374 . 20 1 1 A 30 30 CYS CB C 119 30.200 28.740 1.460 1
1 375 . 20 1 1 A 30 30 CYS N N 119 134.136 125.293 8.843 1
1 376 . 20 1 1 A 31 31 PRO HA H 120 4.424 4.411 0.013 1
1 383 . 20 1 1 A 31 31 PRO C C 120 177.431 178.399 -0.968 1
1 384 . 20 1 1 A 31 31 PRO CA C 120 64.060 64.501 -0.441 1
1 385 . 20 1 1 A 31 31 PRO CB C 120 32.776 32.168 0.608 1
1 388 . 20 1 1 A 32 32 ILE H H 121 11.318 7.212 4.106 1
1 389 . 20 1 1 A 32 32 ILE HA H 121 4.038 3.988 0.050 1
1 399 . 20 1 1 A 32 32 ILE C C 121 178.485 177.749 0.736 1
1 400 . 20 1 1 A 32 32 ILE CA C 121 64.060 64.105 -0.045 1
1 401 . 20 1 1 A 32 32 ILE CB C 121 39.340 38.668 0.672 1
1 405 . 20 1 1 A 32 32 ILE N N 121 124.500 116.594 7.906 1
1 406 . 20 1 1 A 33 33 THR H H 122 9.928 7.445 2.483 1
1 407 . 20 1 1 A 33 33 THR HA H 122 4.048 4.473 -0.425 1
1 412 . 20 1 1 A 33 33 THR C C 122 175.793 174.372 1.421 1
1 413 . 20 1 1 A 33 33 THR CA C 122 62.990 61.231 1.759 1
1 414 . 20 1 1 A 33 33 THR CB C 122 70.300 68.887 1.413 1
1 416 . 20 1 1 A 33 33 THR N N 122 115.136 108.660 6.476 1
1 417 . 20 1 1 A 34 34 LEU H H 123 8.439 7.732 0.707 1
1 418 . 20 1 1 A 34 34 LEU HA H 123 3.912 4.077 -0.165 1
1 428 . 20 1 1 A 34 34 LEU C C 123 175.495 175.556 -0.061 1
1 429 . 20 1 1 A 34 34 LEU CA C 123 56.290 55.742 0.548 1
1 430 . 20 1 1 A 34 34 LEU CB C 123 38.500 39.721 -1.221 1
1 434 . 20 1 1 A 34 34 LEU N N 123 117.230 120.934 -3.704 1
1 435 . 20 1 1 A 35 35 GLU H H 124 7.816 7.457 0.359 1
1 436 . 20 1 1 A 35 35 GLU HA H 124 4.634 4.614 0.020 1
1 441 . 20 1 1 A 35 35 GLU C C 124 174.838 174.003 0.835 1
1 442 . 20 1 1 A 35 35 GLU CA C 124 53.780 54.875 -1.095 1
1 443 . 20 1 1 A 35 35 GLU CB C 124 33.710 31.493 2.217 1
1 445 . 20 1 1 A 35 35 GLU N N 124 116.577 116.119 0.458 1
1 446 . 20 1 1 A 36 36 GLN H H 125 8.532 8.594 -0.062 1
1 447 . 20 1 1 A 36 36 GLN HA H 125 4.958 4.406 0.552 1
1 454 . 20 1 1 A 36 36 GLN CA C 125 53.350 53.769 -0.419 1
1 455 . 20 1 1 A 36 36 GLN CB C 125 29.950 29.846 0.104 1
1 457 . 20 1 1 A 36 36 GLN N N 125 123.034 121.447 1.587 1
1 459 . 20 1 1 A 37 37 PRO HA H 126 4.458 4.279 0.179 1
1 466 . 20 1 1 A 37 37 PRO C C 126 176.314 177.342 -1.028 1
1 467 . 20 1 1 A 37 37 PRO CA C 126 62.816 65.775 -2.959 1
1 468 . 20 1 1 A 37 37 PRO CB C 126 33.070 31.574 1.496 1
1 471 . 20 1 1 A 38 38 GLU H H 127 8.626 7.664 0.962 1
1 472 . 20 1 1 A 38 38 GLU HA H 127 4.274 4.548 -0.274 1
1 477 . 20 1 1 A 38 38 GLU C C 127 177.809 175.042 2.767 1
1 478 . 20 1 1 A 38 38 GLU CA C 127 58.730 58.312 0.418 1
1 479 . 20 1 1 A 38 38 GLU CB C 127 30.340 29.453 0.887 1
1 481 . 20 1 1 A 38 38 GLU N N 127 120.691 119.299 1.392 1
1 482 . 20 1 1 A 39 39 LYS H H 128 7.891 7.869 0.022 1
1 483 . 20 1 1 A 39 39 LYS HA H 128 4.870 4.766 0.104 1
1 492 . 20 1 1 A 39 39 LYS C C 128 175.452 175.716 -0.264 1
1 493 . 20 1 1 A 39 39 LYS CA C 128 53.540 54.787 -1.247 1
1 494 . 20 1 1 A 39 39 LYS CB C 128 33.630 34.700 -1.070 1
1 498 . 20 1 1 A 39 39 LYS N N 128 118.149 118.012 0.137 1
1 499 . 20 1 1 A 40 40 GLY H H 129 8.524 8.099 0.425 1
1 500 . 20 1 1 A 40 40 GLY HA2 H 129 4.973 4.049 0.924 1
1 501 . 20 1 1 A 40 40 GLY HA3 H 129 2.459 4.183 -1.724 1
1 502 . 20 1 1 A 40 40 GLY C C 129 169.943 171.929 -1.986 1
1 503 . 20 1 1 A 40 40 GLY CA C 129 42.910 44.931 -2.021 1
1 504 . 20 1 1 A 40 40 GLY N N 129 112.845 110.546 2.299 1
1 505 . 20 1 1 A 41 41 ILE H H 130 8.659 8.162 0.497 1
1 506 . 20 1 1 A 41 41 ILE HA H 130 4.591 4.785 -0.194 1
1 516 . 20 1 1 A 41 41 ILE C C 130 172.586 174.007 -1.421 1
1 517 . 20 1 1 A 41 41 ILE CA C 130 58.090 58.949 -0.859 1
1 518 . 20 1 1 A 41 41 ILE CB C 130 43.320 41.831 1.489 1
1 522 . 20 1 1 A 41 41 ILE N N 130 114.060 119.252 -5.192 1
1 523 . 20 1 1 A 42 42 PHE H H 131 9.206 8.801 0.405 1
1 524 . 20 1 1 A 42 42 PHE HA H 131 5.159 4.744 0.415 1
1 532 . 20 1 1 A 42 42 PHE C C 131 174.931 175.758 -0.827 1
1 533 . 20 1 1 A 42 42 PHE CA C 131 57.790 57.988 -0.198 1
1 534 . 20 1 1 A 42 42 PHE CB C 131 42.220 39.033 3.187 1
1 538 . 20 1 1 A 42 42 PHE N N 131 126.002 128.303 -2.301 1
1 539 . 20 1 1 A 43 43 VAL H H 132 8.502 9.085 -0.583 1
1 540 . 20 1 1 A 43 43 VAL HA H 132 4.921 4.733 0.188 1
1 548 . 20 1 1 A 43 43 VAL C C 132 178.219 175.360 2.859 1
1 549 . 20 1 1 A 43 43 VAL CA C 132 59.600 60.198 -0.598 1
1 550 . 20 1 1 A 43 43 VAL CB C 132 35.920 35.398 0.522 1
1 553 . 20 1 1 A 43 43 VAL N N 132 119.068 123.243 -4.175 1
1 554 . 20 1 1 A 44 44 LYS H H 133 10.036 8.683 1.353 1
1 555 . 20 1 1 A 44 44 LYS HA H 133 5.070 4.320 0.750 1
1 564 . 20 1 1 A 44 44 LYS C C 133 177.276 177.786 -0.510 1
1 565 . 20 1 1 A 44 44 LYS CA C 133 56.720 57.081 -0.361 1
1 566 . 20 1 1 A 44 44 LYS CB C 133 34.410 32.785 1.625 1
1 570 . 20 1 1 A 44 44 LYS N N 133 130.934 125.517 5.417 1
1 571 . 20 1 1 A 45 45 ASN H H 134 8.093 8.654 -0.561 1
1 572 . 20 1 1 A 45 45 ASN HA H 134 4.152 4.680 -0.528 1
1 577 . 20 1 1 A 45 45 ASN C C 134 174.087 175.159 -1.072 1
1 578 . 20 1 1 A 45 45 ASN CA C 134 55.360 55.964 -0.604 1
1 579 . 20 1 1 A 45 45 ASN CB C 134 37.530 39.127 -1.597 1
1 580 . 20 1 1 A 45 45 ASN N N 134 117.963 122.717 -4.754 1
1 582 . 20 1 1 A 46 46 SER H H 135 7.524 7.790 -0.266 1
1 583 . 20 1 1 A 46 46 SER HA H 135 4.219 4.732 -0.513 1
1 586 . 20 1 1 A 46 46 SER C C 135 174.490 174.332 0.158 1
1 587 . 20 1 1 A 46 46 SER CA C 135 57.090 55.855 1.235 1
1 588 . 20 1 1 A 46 46 SER CB C 135 63.860 66.597 -2.737 1
1 589 . 20 1 1 A 46 46 SER N N 135 105.939 108.893 -2.954 1
1 590 . 20 1 1 A 47 47 ASP H H 136 9.113 9.035 0.078 1
1 591 . 20 1 1 A 47 47 ASP HA H 136 4.220 4.228 -0.008 1
1 594 . 20 1 1 A 47 47 ASP CA C 136 57.610 57.202 0.408 1
1 595 . 20 1 1 A 47 47 ASP CB C 136 40.810 40.907 -0.097 1
1 596 . 20 1 1 A 47 47 ASP N N 136 120.995 123.914 -2.919 1
1 597 . 20 1 1 A 48 48 GLY H H 137 8.181 8.117 0.064 1
1 598 . 20 1 1 A 48 48 GLY HA2 H 137 4.120 3.881 0.239 1
1 599 . 20 1 1 A 48 48 GLY HA3 H 137 3.659 3.882 -0.223 1
1 600 . 20 1 1 A 48 48 GLY C C 137 174.062 173.515 0.547 1
1 601 . 20 1 1 A 48 48 GLY CA C 137 45.130 45.857 -0.727 1
1 602 . 20 1 1 A 48 48 GLY N N 137 106.197 106.792 -0.595 1
1 603 . 20 1 1 A 49 49 SER H H 138 7.179 7.694 -0.515 1
1 604 . 20 1 1 A 49 49 SER HA H 138 4.383 4.917 -0.534 1
1 607 . 20 1 1 A 49 49 SER C C 138 173.864 173.391 0.473 1
1 608 . 20 1 1 A 49 49 SER CA C 138 57.614 57.096 0.518 1
1 609 . 20 1 1 A 49 49 SER CB C 138 65.100 67.093 -1.993 1
1 610 . 20 1 1 A 49 49 SER N N 138 115.015 114.460 0.555 1
1 611 . 20 1 1 A 50 50 ASP H H 139 8.078 8.522 -0.444 1
1 612 . 20 1 1 A 50 50 ASP HA H 139 4.642 4.944 -0.302 1
1 615 . 20 1 1 A 50 50 ASP C C 139 174.261 175.424 -1.163 1
1 616 . 20 1 1 A 50 50 ASP CA C 139 52.406 53.964 -1.558 1
1 617 . 20 1 1 A 50 50 ASP CB C 139 40.254 41.511 -1.257 1
1 618 . 20 1 1 A 50 50 ASP N N 139 122.400 120.563 1.837 1
1 619 . 20 1 1 A 51 51 VAL H H 140 8.111 7.535 0.576 1
1 620 . 20 1 1 A 51 51 VAL HA H 140 4.360 4.392 -0.032 1
1 628 . 20 1 1 A 51 51 VAL C C 140 176.147 174.342 1.805 1
1 629 . 20 1 1 A 51 51 VAL CA C 140 62.670 61.190 1.480 1
1 630 . 20 1 1 A 51 51 VAL CB C 140 33.930 32.629 1.301 1
1 632 . 20 1 1 A 51 51 VAL N N 140 120.374 120.166 0.208 1
1 633 . 20 1 1 A 52 52 CYS H H 141 8.358 9.099 -0.741 1
1 634 . 20 1 1 A 52 52 CYS HA H 141 4.957 5.447 -0.490 1
1 637 . 20 1 1 A 52 52 CYS C C 141 173.070 172.825 0.245 1
1 638 . 20 1 1 A 52 52 CYS CA C 141 53.380 54.410 -1.030 1
1 639 . 20 1 1 A 52 52 CYS CB C 141 46.110 45.639 0.471 1
1 640 . 20 1 1 A 52 52 CYS N N 141 121.305 129.206 -7.901 1
1 641 . 20 1 1 A 53 53 THR H H 142 8.929 8.749 0.180 1
1 642 . 20 1 1 A 53 53 THR HA H 142 4.498 5.011 -0.513 1
1 648 . 20 1 1 A 53 53 THR C C 142 172.151 172.325 -0.174 1
1 649 . 20 1 1 A 53 53 THR CA C 142 62.960 61.203 1.757 1
1 650 . 20 1 1 A 53 53 THR CB C 142 70.540 73.117 -2.577 1
1 652 . 20 1 1 A 53 53 THR N N 142 120.105 119.825 0.280 1
1 653 . 20 1 1 A 54 54 LEU H H 143 8.448 8.877 -0.429 1
1 654 . 20 1 1 A 54 54 LEU HA H 143 4.322 4.833 -0.511 1
1 664 . 20 1 1 A 54 54 LEU C C 143 174.484 174.390 0.094 1
1 665 . 20 1 1 A 54 54 LEU CA C 143 54.596 53.461 1.135 1
1 666 . 20 1 1 A 54 54 LEU CB C 143 42.396 43.752 -1.356 1
1 670 . 20 1 1 A 54 54 LEU N N 143 128.819 128.883 -0.064 1
1 671 . 20 1 1 A 55 55 PHE H H 144 8.661 8.800 -0.139 1
1 672 . 20 1 1 A 55 55 PHE HA H 144 5.459 5.027 0.432 1
1 680 . 20 1 1 A 55 55 PHE C C 144 176.035 174.801 1.234 1
1 681 . 20 1 1 A 55 55 PHE CA C 144 55.020 56.657 -1.637 1
1 682 . 20 1 1 A 55 55 PHE CB C 144 44.100 42.773 1.327 1
1 686 . 20 1 1 A 55 55 PHE N N 144 121.897 126.030 -4.133 1
1 687 . 20 1 1 A 56 56 ASP H H 145 11.616 8.591 3.025 1
1 688 . 20 1 1 A 56 56 ASP HA H 145 4.417 4.677 -0.260 1
1 691 . 20 1 1 A 56 56 ASP C C 145 176.748 177.361 -0.613 1
1 692 . 20 1 1 A 56 56 ASP CA C 145 55.844 54.407 1.437 1
1 693 . 20 1 1 A 56 56 ASP CB C 145 44.390 43.145 1.245 1
1 694 . 20 1 1 A 56 56 ASP N N 145 122.131 121.702 0.429 1
1 695 . 20 1 1 A 57 57 ALA H H 146 8.508 9.027 -0.519 1
1 696 . 20 1 1 A 57 57 ALA HA H 146 3.797 4.085 -0.288 1
1 700 . 20 1 1 A 57 57 ALA C C 146 178.696 180.045 -1.349 1
1 701 . 20 1 1 A 57 57 ALA CA C 146 55.990 55.309 0.681 1
1 702 . 20 1 1 A 57 57 ALA CB C 146 18.840 18.103 0.737 1
1 703 . 20 1 1 A 57 57 ALA N N 146 130.243 128.666 1.577 1
1 704 . 20 1 1 A 58 58 ALA H H 147 8.378 8.150 0.228 1
1 705 . 20 1 1 A 58 58 ALA HA H 147 4.078 4.186 -0.108 1
1 709 . 20 1 1 A 58 58 ALA C C 147 181.091 179.820 1.271 1
1 710 . 20 1 1 A 58 58 ALA CA C 147 54.770 54.816 -0.046 1
1 711 . 20 1 1 A 58 58 ALA CB C 147 17.700 18.369 -0.669 1
1 712 . 20 1 1 A 58 58 ALA N N 147 121.997 119.796 2.201 1
1 713 . 20 1 1 A 59 59 ALA H H 148 9.138 7.981 1.157 1
1 714 . 20 1 1 A 59 59 ALA HA H 148 3.975 4.096 -0.121 1
1 718 . 20 1 1 A 59 59 ALA C C 148 180.508 179.622 0.886 1
1 719 . 20 1 1 A 59 59 ALA CA C 148 54.840 55.020 -0.180 1
1 720 . 20 1 1 A 59 59 ALA CB C 148 18.600 18.704 -0.104 1
1 721 . 20 1 1 A 59 59 ALA N N 148 123.595 120.480 3.115 1
1 722 . 20 1 1 A 60 60 PHE H H 149 8.814 8.069 0.745 1
1 723 . 20 1 1 A 60 60 PHE HA H 149 3.722 4.057 -0.335 1
1 731 . 20 1 1 A 60 60 PHE C C 149 176.773 177.657 -0.884 1
1 732 . 20 1 1 A 60 60 PHE CA C 149 62.030 61.457 0.573 1
1 733 . 20 1 1 A 60 60 PHE CB C 149 39.960 38.807 1.153 1
1 737 . 20 1 1 A 60 60 PHE N N 149 120.354 119.932 0.422 1
1 738 . 20 1 1 A 61 61 SER H H 150 8.276 8.169 0.107 1
1 739 . 20 1 1 A 61 61 SER HA H 150 3.880 4.082 -0.202 1
1 742 . 20 1 1 A 61 61 SER C C 150 177.691 176.602 1.089 1
1 743 . 20 1 1 A 61 61 SER CA C 150 62.190 61.622 0.568 1
1 744 . 20 1 1 A 61 61 SER CB C 150 63.016 62.992 0.024 1
1 745 . 20 1 1 A 61 61 SER N N 150 112.086 114.248 -2.162 1
1 746 . 20 1 1 A 62 62 ARG H H 151 7.829 7.835 -0.006 1
1 747 . 20 1 1 A 62 62 ARG HA H 151 3.971 4.029 -0.058 1
1 754 . 20 1 1 A 62 62 ARG C C 151 178.287 178.307 -0.020 1
1 755 . 20 1 1 A 62 62 ARG CA C 151 59.340 58.746 0.594 1
1 756 . 20 1 1 A 62 62 ARG CB C 151 29.760 30.259 -0.499 1
1 759 . 20 1 1 A 62 62 ARG N N 151 121.090 119.336 1.754 1
1 760 . 20 1 1 A 63 63 LEU H H 152 7.390 7.703 -0.313 1
1 761 . 20 1 1 A 63 63 LEU HA H 152 3.791 3.871 -0.080 1
1 771 . 20 1 1 A 63 63 LEU C C 152 179.106 178.246 0.860 1
1 772 . 20 1 1 A 63 63 LEU CA C 152 58.900 58.191 0.709 1
1 773 . 20 1 1 A 63 63 LEU CB C 152 41.140 41.413 -0.273 1
1 777 . 20 1 1 A 63 63 LEU N N 152 121.129 122.173 -1.044 1
1 778 . 20 1 1 A 64 64 VAL H H 153 7.552 7.756 -0.204 1
1 779 . 20 1 1 A 64 64 VAL HA H 153 3.411 3.462 -0.051 1
1 787 . 20 1 1 A 64 64 VAL C C 153 180.595 178.655 1.940 1
1 788 . 20 1 1 A 64 64 VAL CA C 153 65.644 66.198 -0.554 1
1 789 . 20 1 1 A 64 64 VAL CB C 153 31.410 31.424 -0.014 1
1 792 . 20 1 1 A 64 64 VAL N N 153 118.280 118.888 -0.608 1
1 793 . 20 1 1 A 65 65 GLY H H 154 8.061 8.114 -0.053 1
1 794 . 20 1 1 A 65 65 GLY HA2 H 154 3.846 3.774 0.072 1
1 795 . 20 1 1 A 65 65 GLY HA3 H 154 3.809 3.775 0.034 1
1 796 . 20 1 1 A 65 65 GLY C C 154 175.235 176.146 -0.911 1
1 797 . 20 1 1 A 65 65 GLY CA C 154 46.630 46.807 -0.177 1
1 798 . 20 1 1 A 65 65 GLY N N 154 108.622 107.638 0.984 1
1 799 . 20 1 1 A 66 66 GLU H H 155 7.528 7.644 -0.116 1
1 800 . 20 1 1 A 66 66 GLU HA H 155 4.228 4.303 -0.075 1
1 805 . 20 1 1 A 66 66 GLU C C 155 176.761 176.824 -0.063 1
1 806 . 20 1 1 A 66 66 GLU CA C 155 56.590 56.407 0.183 1
1 807 . 20 1 1 A 66 66 GLU CB C 155 30.490 30.117 0.373 1
1 809 . 20 1 1 A 66 66 GLU N N 155 118.361 119.087 -0.726 1
1 810 . 20 1 1 A 67 67 GLY H H 156 7.884 7.743 0.141 1
1 811 . 20 1 1 A 67 67 GLY HA2 H 156 3.918 3.847 0.071 1
1 812 . 20 1 1 A 67 67 GLY HA3 H 156 3.747 3.859 -0.112 1
1 813 . 20 1 1 A 67 67 GLY C C 156 174.788 174.614 0.174 1
1 814 . 20 1 1 A 67 67 GLY CA C 156 45.890 45.894 -0.004 1
1 815 . 20 1 1 A 67 67 GLY N N 156 108.465 109.130 -0.665 1
1 816 . 20 1 1 A 68 68 LEU H H 157 7.332 7.784 -0.452 1
1 817 . 20 1 1 A 68 68 LEU HA H 157 4.361 4.614 -0.253 1
1 827 . 20 1 1 A 68 68 LEU CA C 157 53.060 52.209 0.851 1
1 828 . 20 1 1 A 68 68 LEU CB C 157 41.100 41.837 -0.737 1
1 832 . 20 1 1 A 68 68 LEU N N 157 121.920 121.544 0.376 1
1 833 . 20 1 1 A 69 69 PRO HA H 158 4.485 4.582 -0.097 1
1 840 . 20 1 1 A 69 69 PRO C C 158 174.602 176.234 -1.632 1
1 841 . 20 1 1 A 69 69 PRO CA C 158 61.556 62.291 -0.735 1
1 842 . 20 1 1 A 69 69 PRO CB C 158 32.370 32.647 -0.277 1
1 845 . 20 1 1 A 70 70 HIS H H 159 8.734 8.520 0.214 1
1 846 . 20 1 1 A 70 70 HIS HA H 159 3.947 4.562 -0.615 1
1 852 . 20 1 1 A 70 70 HIS CA C 159 56.250 55.229 1.021 1
1 853 . 20 1 1 A 70 70 HIS CB C 159 32.280 31.102 1.178 1
1 856 . 20 1 1 A 70 70 HIS N N 159 119.423 120.792 -1.369 1
1 857 . 20 1 1 A 71 71 PRO HA H 160 4.424 4.171 0.253 1
1 864 . 20 1 1 A 71 71 PRO C C 160 177.567 178.782 -1.215 1
1 865 . 20 1 1 A 71 71 PRO CA C 160 64.574 65.545 -0.971 1
1 866 . 20 1 1 A 71 71 PRO CB C 160 32.340 31.749 0.591 1
1 869 . 20 1 1 A 72 72 LEU H H 161 10.123 7.623 2.500 1
1 870 . 20 1 1 A 72 72 LEU HA H 161 4.778 4.249 0.529 1
1 880 . 20 1 1 A 72 72 LEU C C 161 178.721 177.840 0.881 1
1 881 . 20 1 1 A 72 72 LEU CA C 161 55.800 57.525 -1.725 1
1 882 . 20 1 1 A 72 72 LEU CB C 161 42.440 42.447 -0.007 1
1 886 . 20 1 1 A 72 72 LEU N N 161 117.374 117.448 -0.074 1
1 887 . 20 1 1 A 73 73 THR H H 162 7.523 7.648 -0.125 1
1 888 . 20 1 1 A 73 73 THR HA H 162 4.291 4.573 -0.282 1
1 893 . 20 1 1 A 73 73 THR C C 162 175.557 174.473 1.084 1
1 894 . 20 1 1 A 73 73 THR CA C 162 61.440 62.043 -0.603 1
1 895 . 20 1 1 A 73 73 THR CB C 162 70.500 70.172 0.328 1
1 897 . 20 1 1 A 73 73 THR N N 162 107.787 110.739 -2.952 1
1 898 . 20 1 1 A 74 74 ARG H H 163 8.361 7.943 0.418 1
1 899 . 20 1 1 A 74 74 ARG HA H 163 3.836 4.135 -0.299 1
1 906 . 20 1 1 A 74 74 ARG C C 163 174.701 175.433 -0.732 1
1 907 . 20 1 1 A 74 74 ARG CA C 163 57.980 57.215 0.765 1
1 908 . 20 1 1 A 74 74 ARG CB C 163 26.770 27.295 -0.525 1
1 911 . 20 1 1 A 74 74 ARG N N 163 115.130 118.729 -3.599 1
1 912 . 20 1 1 A 75 75 GLU H H 164 7.430 7.988 -0.558 1
1 913 . 20 1 1 A 75 75 GLU HA H 164 4.636 4.405 0.231 1
1 918 . 20 1 1 A 75 75 GLU CA C 164 53.699 55.036 -1.337 1
1 919 . 20 1 1 A 75 75 GLU CB C 164 29.550 28.953 0.597 1
1 921 . 20 1 1 A 75 75 GLU N N 164 120.076 118.278 1.798 1
1 922 . 20 1 1 A 76 76 PRO HA H 165 4.272 4.665 -0.393 1
1 929 . 20 1 1 A 76 76 PRO C C 165 176.649 176.771 -0.122 1
1 930 . 20 1 1 A 76 76 PRO CA C 165 63.204 62.808 0.396 1
1 931 . 20 1 1 A 76 76 PRO CB C 165 31.680 31.357 0.323 1
1 934 . 20 1 1 A 77 77 ILE H H 166 8.812 8.103 0.709 1
1 935 . 20 1 1 A 77 77 ILE HA H 166 3.838 4.332 -0.494 1
1 945 . 20 1 1 A 77 77 ILE C C 166 175.235 176.043 -0.808 1
1 946 . 20 1 1 A 77 77 ILE CA C 166 62.816 61.302 1.514 1
1 947 . 20 1 1 A 77 77 ILE CB C 166 37.750 37.383 0.367 1
1 951 . 20 1 1 A 77 77 ILE N N 166 123.831 124.136 -0.305 1
1 952 . 20 1 1 A 78 78 THR H H 167 6.625 8.585 -1.960 1
1 953 . 20 1 1 A 78 78 THR HA H 167 4.632 5.028 -0.396 1
1 958 . 20 1 1 A 78 78 THR C C 167 174.143 174.380 -0.237 1
1 959 . 20 1 1 A 78 78 THR CA C 167 58.750 60.124 -1.374 1
1 960 . 20 1 1 A 78 78 THR CB C 167 71.320 70.935 0.385 1
1 962 . 20 1 1 A 78 78 THR N N 167 115.293 118.620 -3.327 1
1 963 . 20 1 1 A 79 79 ALA H H 168 9.088 8.979 0.109 1
1 964 . 20 1 1 A 79 79 ALA HA H 168 3.916 4.109 -0.193 1
1 968 . 20 1 1 A 79 79 ALA C C 168 179.770 179.471 0.299 1
1 969 . 20 1 1 A 79 79 ALA CA C 168 55.480 55.090 0.390 1
1 970 . 20 1 1 A 79 79 ALA CB C 168 17.630 18.451 -0.821 1
1 971 . 20 1 1 A 79 79 ALA N N 168 122.102 127.537 -5.435 1
1 972 . 20 1 1 A 80 80 SER H H 169 7.988 7.565 0.423 1
1 973 . 20 1 1 A 80 80 SER HA H 169 4.091 4.214 -0.123 1
1 976 . 20 1 1 A 80 80 SER C C 169 175.836 176.562 -0.726 1
1 977 . 20 1 1 A 80 80 SER CA C 169 60.750 61.376 -0.626 1
1 978 . 20 1 1 A 80 80 SER CB C 169 62.510 62.965 -0.455 1
1 979 . 20 1 1 A 80 80 SER N N 169 109.660 113.546 -3.886 1
1 980 . 20 1 1 A 81 81 ILE H H 170 7.052 7.666 -0.614 1
1 981 . 20 1 1 A 81 81 ILE HA H 170 4.344 4.134 0.210 1
1 991 . 20 1 1 A 81 81 ILE C C 170 174.236 176.518 -2.282 1
1 992 . 20 1 1 A 81 81 ILE CA C 170 61.760 63.935 -2.175 1
1 993 . 20 1 1 A 81 81 ILE CB C 170 37.950 37.756 0.194 1
1 997 . 20 1 1 A 81 81 ILE N N 170 112.623 113.742 -1.119 1
1 998 . 20 1 1 A 82 82 ILE H H 171 7.345 7.081 0.264 1
1 999 . 20 1 1 A 82 82 ILE HA H 171 4.288 4.043 0.245 1
1 1009 . 20 1 1 A 82 82 ILE C C 171 174.931 175.515 -0.584 1
1 1010 . 20 1 1 A 82 82 ILE CA C 171 61.420 62.127 -0.707 1
1 1011 . 20 1 1 A 82 82 ILE CB C 171 37.230 37.720 -0.490 1
1 1015 . 20 1 1 A 82 82 ILE N N 171 124.260 124.621 -0.361 1
1 1016 . 20 1 1 A 83 83 VAL H H 172 7.843 8.726 -0.883 1
1 1017 . 20 1 1 A 83 83 VAL HA H 172 4.818 5.064 -0.246 1
1 1025 . 20 1 1 A 83 83 VAL C C 172 174.918 175.349 -0.431 1
1 1026 . 20 1 1 A 83 83 VAL CA C 172 58.910 58.948 -0.038 1
1 1027 . 20 1 1 A 83 83 VAL CB C 172 34.570 35.377 -0.807 1
1 1030 . 20 1 1 A 83 83 VAL N N 172 118.856 121.716 -2.860 1
1 1031 . 20 1 1 A 84 84 LYS H H 173 8.347 8.681 -0.334 1
1 1032 . 20 1 1 A 84 84 LYS HA H 173 4.356 4.611 -0.255 1
1 1041 . 20 1 1 A 84 84 LYS C C 173 178.653 178.632 0.021 1
1 1042 . 20 1 1 A 84 84 LYS CA C 173 56.360 55.054 1.306 1
1 1043 . 20 1 1 A 84 84 LYS CB C 173 33.366 34.024 -0.658 1
1 1047 . 20 1 1 A 84 84 LYS N N 173 119.602 120.981 -1.379 1
1 1048 . 20 1 1 A 85 85 HIS H H 174 9.143 9.002 0.141 1
1 1049 . 20 1 1 A 85 85 HIS HA H 174 4.013 4.227 -0.214 1
1 1053 . 20 1 1 A 85 85 HIS C C 174 176.606 177.130 -0.524 1
1 1054 . 20 1 1 A 85 85 HIS CA C 174 58.820 60.398 -1.578 1
1 1055 . 20 1 1 A 85 85 HIS CB C 174 28.186 29.790 -1.604 1
1 1057 . 20 1 1 A 85 85 HIS N N 174 120.022 122.584 -2.562 1
1 1058 . 20 1 1 A 86 86 GLU H H 175 8.403 8.513 -0.110 1
1 1059 . 20 1 1 A 86 86 GLU HA H 175 3.863 3.988 -0.125 1
1 1064 . 20 1 1 A 86 86 GLU C C 175 177.040 178.628 -1.588 1
1 1065 . 20 1 1 A 86 86 GLU CA C 175 57.830 59.799 -1.969 1
1 1066 . 20 1 1 A 86 86 GLU CB C 175 28.690 29.195 -0.505 1
1 1068 . 20 1 1 A 86 86 GLU N N 175 116.124 117.927 -1.803 1
1 1069 . 20 1 1 A 87 87 GLU H H 176 7.669 7.862 -0.193 1
1 1070 . 20 1 1 A 87 87 GLU HA H 176 4.039 4.534 -0.495 1
1 1075 . 20 1 1 A 87 87 GLU C C 176 175.688 175.652 0.036 1
1 1076 . 20 1 1 A 87 87 GLU CA C 176 57.906 57.775 0.131 1
1 1077 . 20 1 1 A 87 87 GLU CB C 176 30.430 28.920 1.510 1
1 1079 . 20 1 1 A 87 87 GLU N N 176 116.183 117.431 -1.248 1
1 1080 . 20 1 1 A 88 88 CYS H H 177 6.750 6.995 -0.245 1
1 1081 . 20 1 1 A 88 88 CYS HA H 177 4.991 5.101 -0.110 1
1 1084 . 20 1 1 A 88 88 CYS C C 177 172.325 172.113 0.212 1
1 1085 . 20 1 1 A 88 88 CYS CA C 177 55.030 55.201 -0.171 1
1 1086 . 20 1 1 A 88 88 CYS CB C 177 45.610 44.936 0.674 1
1 1087 . 20 1 1 A 88 88 CYS N N 177 114.838 115.907 -1.069 1
1 1088 . 20 1 1 A 89 89 ILE H H 178 9.128 8.852 0.276 1
1 1089 . 20 1 1 A 89 89 ILE HA H 178 4.536 4.890 -0.354 1
1 1099 . 20 1 1 A 89 89 ILE C C 178 174.893 174.444 0.449 1
1 1100 . 20 1 1 A 89 89 ILE CA C 178 59.160 59.117 0.043 1
1 1101 . 20 1 1 A 89 89 ILE CB C 178 41.840 40.962 0.878 1
1 1105 . 20 1 1 A 89 89 ILE N N 178 120.564 121.588 -1.024 1
1 1106 . 20 1 1 A 90 90 TYR H H 179 9.349 9.112 0.237 1
1 1107 . 20 1 1 A 90 90 TYR HA H 179 3.568 4.241 -0.673 1
1 1112 . 20 1 1 A 90 90 TYR C C 179 173.950 174.062 -0.112 1
1 1113 . 20 1 1 A 90 90 TYR CA C 179 61.180 57.903 3.277 1
1 1114 . 20 1 1 A 90 90 TYR CB C 179 37.530 38.429 -0.899 1
1 1116 . 20 1 1 A 90 90 TYR N N 179 129.033 126.236 2.797 1
1 1117 . 20 1 1 A 91 91 ASP H H 180 7.367 8.332 -0.965 1
1 1118 . 20 1 1 A 91 91 ASP HA H 180 4.662 4.537 0.125 1
1 1121 . 20 1 1 A 91 91 ASP C C 180 175.291 175.390 -0.099 1
1 1122 . 20 1 1 A 91 91 ASP CA C 180 52.230 52.785 -0.555 1
1 1123 . 20 1 1 A 91 91 ASP CB C 180 43.650 41.617 2.033 1
1 1124 . 20 1 1 A 91 91 ASP N N 180 129.305 128.864 0.441 1
1 1125 . 20 1 1 A 92 92 ASP H H 181 8.783 8.691 0.092 1
1 1126 . 20 1 1 A 92 92 ASP HA H 181 4.114 3.596 0.518 1
1 1129 . 20 1 1 A 92 92 ASP C C 181 177.573 177.481 0.092 1
1 1130 . 20 1 1 A 92 92 ASP CA C 181 56.390 56.852 -0.462 1
1 1131 . 20 1 1 A 92 92 ASP CB C 181 41.330 40.298 1.032 1
1 1132 . 20 1 1 A 92 92 ASP N N 181 125.665 128.017 -2.352 1
1 1133 . 20 1 1 A 93 93 THR H H 182 8.284 7.409 0.875 1
1 1134 . 20 1 1 A 93 93 THR HA H 182 4.037 3.999 0.038 1
1 1139 . 20 1 1 A 93 93 THR C C 182 176.333 176.377 -0.044 1
1 1140 . 20 1 1 A 93 93 THR CA C 182 65.320 66.516 -1.196 1
1 1141 . 20 1 1 A 93 93 THR CB C 182 68.560 68.362 0.198 1
1 1143 . 20 1 1 A 93 93 THR N N 182 114.688 116.168 -1.480 1
1 1144 . 20 1 1 A 94 94 ARG H H 183 7.784 7.455 0.329 1
1 1145 . 20 1 1 A 94 94 ARG HA H 183 4.142 4.247 -0.105 1
1 1152 . 20 1 1 A 94 94 ARG C C 183 177.015 177.041 -0.026 1
1 1153 . 20 1 1 A 94 94 ARG CA C 183 55.350 56.245 -0.895 1
1 1154 . 20 1 1 A 94 94 ARG CB C 183 30.930 30.969 -0.039 1
1 1157 . 20 1 1 A 94 94 ARG N N 183 120.156 118.476 1.680 1
1 1158 . 20 1 1 A 95 95 GLY H H 184 8.144 8.909 -0.765 1
1 1159 . 20 1 1 A 95 95 GLY HA2 H 184 3.839 3.880 -0.041 1
1 1160 . 20 1 1 A 95 95 GLY HA3 H 184 3.681 3.910 -0.229 1
1 1161 . 20 1 1 A 95 95 GLY C C 184 173.653 173.344 0.309 1
1 1162 . 20 1 1 A 95 95 GLY CA C 184 46.160 45.868 0.292 1
1 1163 . 20 1 1 A 95 95 GLY N N 184 107.879 108.834 -0.955 1
1 1164 . 20 1 1 A 96 96 ASN H H 185 6.855 7.238 -0.383 1
1 1165 . 20 1 1 A 96 96 ASN HA H 185 4.909 4.952 -0.043 1
1 1170 . 20 1 1 A 96 96 ASN C C 185 174.223 173.300 0.923 1
1 1171 . 20 1 1 A 96 96 ASN CA C 185 52.720 52.106 0.614 1
1 1172 . 20 1 1 A 96 96 ASN CB C 185 45.620 41.927 3.693 1
1 1173 . 20 1 1 A 96 96 ASN N N 185 113.382 116.762 -3.380 1
1 1175 . 20 1 1 A 97 97 PHE H H 186 9.228 8.554 0.674 1
1 1176 . 20 1 1 A 97 97 PHE HA H 186 4.579 4.916 -0.337 1
1 1183 . 20 1 1 A 97 97 PHE C C 186 174.794 175.669 -0.875 1
1 1184 . 20 1 1 A 97 97 PHE CA C 186 59.384 58.312 1.072 1
1 1185 . 20 1 1 A 97 97 PHE CB C 186 40.450 39.549 0.901 1
1 1188 . 20 1 1 A 97 97 PHE N N 186 118.661 119.367 -0.706 1
1 1189 . 20 1 1 A 98 98 ILE H H 187 8.908 8.967 -0.059 1
1 1190 . 20 1 1 A 98 98 ILE HA H 187 5.440 4.850 0.590 1
1 1200 . 20 1 1 A 98 98 ILE C C 187 176.171 175.484 0.687 1
1 1201 . 20 1 1 A 98 98 ILE CA C 187 57.610 59.731 -2.121 1
1 1202 . 20 1 1 A 98 98 ILE CB C 187 41.280 41.165 0.115 1
1 1206 . 20 1 1 A 98 98 ILE N N 187 120.585 123.451 -2.866 1
1 1207 . 20 1 1 A 99 99 ILE H H 188 8.602 8.268 0.334 1
1 1208 . 20 1 1 A 99 99 ILE HA H 188 4.546 4.555 -0.009 1
1 1218 . 20 1 1 A 99 99 ILE C C 188 176.668 174.805 1.863 1
1 1219 . 20 1 1 A 99 99 ILE CA C 188 58.920 62.051 -3.131 1
1 1220 . 20 1 1 A 99 99 ILE CB C 188 37.960 37.991 -0.031 1
1 1224 . 20 1 1 A 99 99 ILE N N 188 124.500 125.860 -1.360 1
1 1225 . 20 1 1 A 100 100 LYS H H 189 8.449 8.478 -0.029 1
1 1226 . 20 1 1 A 100 100 LYS HA H 189 4.108 4.646 -0.538 1
1 1235 . 20 1 1 A 100 100 LYS C C 189 176.866 176.509 0.357 1
1 1236 . 20 1 1 A 100 100 LYS CA C 189 56.800 54.764 2.036 1
1 1237 . 20 1 1 A 100 100 LYS CB C 189 33.400 32.789 0.611 1
1 1241 . 20 1 1 A 100 100 LYS N N 189 128.581 128.578 0.003 1
1 1242 . 20 1 1 A 101 101 GLY H H 190 8.381 8.788 -0.407 1
1 1243 . 20 1 1 A 101 101 GLY HA2 H 190 3.946 3.928 0.018 1
1 1244 . 20 1 1 A 101 101 GLY HA3 H 190 3.828 3.929 -0.101 1
1 1245 . 20 1 1 A 101 101 GLY C C 190 172.902 173.894 -0.992 1
1 1246 . 20 1 1 A 101 101 GLY CA C 190 44.920 45.430 -0.510 1
1 1247 . 20 1 1 A 101 101 GLY N N 190 111.183 113.610 -2.427 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 92 1.066 1
2 1 1 1 "RMS(OBS, PRED)" CA 100 1.184 1
3 1 1 1 "RMS(OBS, PRED)" CB 94 1.207 1
4 1 1 1 "RMS(OBS, PRED)" H 93 0.819 1
5 1 1 1 "RMS(OBS, PRED)" HA 106 0.359 1
6 1 1 1 "RMS(OBS, PRED)" N 93 2.890 1
7 1 2 1 "RMS(OBS, PRED)" C 92 1.053 1
8 1 2 1 "RMS(OBS, PRED)" CA 100 1.129 1
9 1 2 1 "RMS(OBS, PRED)" CB 94 1.161 1
10 1 2 1 "RMS(OBS, PRED)" H 93 0.796 1
11 1 2 1 "RMS(OBS, PRED)" HA 106 0.347 1
12 1 2 1 "RMS(OBS, PRED)" N 93 2.924 1
13 1 3 1 "RMS(OBS, PRED)" C 92 1.089 1
14 1 3 1 "RMS(OBS, PRED)" CA 100 1.184 1
15 1 3 1 "RMS(OBS, PRED)" CB 94 1.216 1
16 1 3 1 "RMS(OBS, PRED)" H 93 0.812 1
17 1 3 1 "RMS(OBS, PRED)" HA 106 0.362 1
18 1 3 1 "RMS(OBS, PRED)" N 93 2.994 1
19 1 4 1 "RMS(OBS, PRED)" C 92 1.054 1
20 1 4 1 "RMS(OBS, PRED)" CA 100 1.225 1
21 1 4 1 "RMS(OBS, PRED)" CB 94 1.147 1
22 1 4 1 "RMS(OBS, PRED)" H 93 0.792 1
23 1 4 1 "RMS(OBS, PRED)" HA 106 0.346 1
24 1 4 1 "RMS(OBS, PRED)" N 93 3.038 1
25 1 5 1 "RMS(OBS, PRED)" C 92 1.045 1
26 1 5 1 "RMS(OBS, PRED)" CA 100 1.187 1
27 1 5 1 "RMS(OBS, PRED)" CB 94 1.176 1
28 1 5 1 "RMS(OBS, PRED)" H 93 0.841 1
29 1 5 1 "RMS(OBS, PRED)" HA 106 0.363 1
30 1 5 1 "RMS(OBS, PRED)" N 93 2.901 1
31 1 6 1 "RMS(OBS, PRED)" C 92 1.072 1
32 1 6 1 "RMS(OBS, PRED)" CA 100 1.205 1
33 1 6 1 "RMS(OBS, PRED)" CB 94 1.107 1
34 1 6 1 "RMS(OBS, PRED)" H 93 0.781 1
35 1 6 1 "RMS(OBS, PRED)" HA 106 0.369 1
36 1 6 1 "RMS(OBS, PRED)" N 93 3.032 1
37 1 7 1 "RMS(OBS, PRED)" C 92 1.063 1
38 1 7 1 "RMS(OBS, PRED)" CA 100 1.249 1
39 1 7 1 "RMS(OBS, PRED)" CB 94 1.112 1
40 1 7 1 "RMS(OBS, PRED)" H 93 0.828 1
41 1 7 1 "RMS(OBS, PRED)" HA 106 0.350 1
42 1 7 1 "RMS(OBS, PRED)" N 93 2.947 1
43 1 8 1 "RMS(OBS, PRED)" C 92 1.077 1
44 1 8 1 "RMS(OBS, PRED)" CA 100 1.193 1
45 1 8 1 "RMS(OBS, PRED)" CB 94 1.186 1
46 1 8 1 "RMS(OBS, PRED)" H 93 0.822 1
47 1 8 1 "RMS(OBS, PRED)" HA 106 0.354 1
48 1 8 1 "RMS(OBS, PRED)" N 93 2.944 1
49 1 9 1 "RMS(OBS, PRED)" C 92 1.049 1
50 1 9 1 "RMS(OBS, PRED)" CA 100 1.197 1
51 1 9 1 "RMS(OBS, PRED)" CB 94 1.139 1
52 1 9 1 "RMS(OBS, PRED)" H 93 0.777 1
53 1 9 1 "RMS(OBS, PRED)" HA 106 0.354 1
54 1 9 1 "RMS(OBS, PRED)" N 93 2.972 1
55 1 10 1 "RMS(OBS, PRED)" C 92 1.081 1
56 1 10 1 "RMS(OBS, PRED)" CA 100 1.146 1
57 1 10 1 "RMS(OBS, PRED)" CB 94 1.119 1
58 1 10 1 "RMS(OBS, PRED)" H 93 0.836 1
59 1 10 1 "RMS(OBS, PRED)" HA 106 0.340 1
60 1 10 1 "RMS(OBS, PRED)" N 93 2.918 1
61 1 11 1 "RMS(OBS, PRED)" C 92 1.083 1
62 1 11 1 "RMS(OBS, PRED)" CA 100 1.220 1
63 1 11 1 "RMS(OBS, PRED)" CB 94 1.215 1
64 1 11 1 "RMS(OBS, PRED)" H 93 0.834 1
65 1 11 1 "RMS(OBS, PRED)" HA 106 0.358 1
66 1 11 1 "RMS(OBS, PRED)" N 93 2.874 1
67 1 12 1 "RMS(OBS, PRED)" C 92 1.069 1
68 1 12 1 "RMS(OBS, PRED)" CA 100 1.187 1
69 1 12 1 "RMS(OBS, PRED)" CB 94 1.161 1
70 1 12 1 "RMS(OBS, PRED)" H 93 0.805 1
71 1 12 1 "RMS(OBS, PRED)" HA 106 0.365 1
72 1 12 1 "RMS(OBS, PRED)" N 93 2.960 1
73 1 13 1 "RMS(OBS, PRED)" C 92 1.065 1
74 1 13 1 "RMS(OBS, PRED)" CA 100 1.175 1
75 1 13 1 "RMS(OBS, PRED)" CB 94 1.165 1
76 1 13 1 "RMS(OBS, PRED)" H 93 0.816 1
77 1 13 1 "RMS(OBS, PRED)" HA 106 0.364 1
78 1 13 1 "RMS(OBS, PRED)" N 93 2.974 1
79 1 14 1 "RMS(OBS, PRED)" C 92 1.065 1
80 1 14 1 "RMS(OBS, PRED)" CA 100 1.195 1
81 1 14 1 "RMS(OBS, PRED)" CB 94 1.160 1
82 1 14 1 "RMS(OBS, PRED)" H 93 0.804 1
83 1 14 1 "RMS(OBS, PRED)" HA 106 0.352 1
84 1 14 1 "RMS(OBS, PRED)" N 93 2.985 1
85 1 15 1 "RMS(OBS, PRED)" C 92 1.031 1
86 1 15 1 "RMS(OBS, PRED)" CA 100 1.172 1
87 1 15 1 "RMS(OBS, PRED)" CB 94 1.181 1
88 1 15 1 "RMS(OBS, PRED)" H 93 0.828 1
89 1 15 1 "RMS(OBS, PRED)" HA 106 0.364 1
90 1 15 1 "RMS(OBS, PRED)" N 93 2.945 1
91 1 16 1 "RMS(OBS, PRED)" C 92 1.114 1
92 1 16 1 "RMS(OBS, PRED)" CA 100 1.199 1
93 1 16 1 "RMS(OBS, PRED)" CB 94 1.206 1
94 1 16 1 "RMS(OBS, PRED)" H 93 0.830 1
95 1 16 1 "RMS(OBS, PRED)" HA 106 0.352 1
96 1 16 1 "RMS(OBS, PRED)" N 93 2.914 1
97 1 17 1 "RMS(OBS, PRED)" C 92 1.023 1
98 1 17 1 "RMS(OBS, PRED)" CA 100 1.205 1
99 1 17 1 "RMS(OBS, PRED)" CB 94 1.062 1
100 1 17 1 "RMS(OBS, PRED)" H 93 0.819 1
101 1 17 1 "RMS(OBS, PRED)" HA 106 0.361 1
102 1 17 1 "RMS(OBS, PRED)" N 93 3.008 1
103 1 18 1 "RMS(OBS, PRED)" C 92 1.089 1
104 1 18 1 "RMS(OBS, PRED)" CA 100 1.149 1
105 1 18 1 "RMS(OBS, PRED)" CB 94 1.137 1
106 1 18 1 "RMS(OBS, PRED)" H 93 0.804 1
107 1 18 1 "RMS(OBS, PRED)" HA 106 0.346 1
108 1 18 1 "RMS(OBS, PRED)" N 93 2.956 1
109 1 19 1 "RMS(OBS, PRED)" C 92 1.112 1
110 1 19 1 "RMS(OBS, PRED)" CA 100 1.195 1
111 1 19 1 "RMS(OBS, PRED)" CB 94 1.186 1
112 1 19 1 "RMS(OBS, PRED)" H 93 0.809 1
113 1 19 1 "RMS(OBS, PRED)" HA 106 0.353 1
114 1 19 1 "RMS(OBS, PRED)" N 93 2.960 1
115 1 20 1 "RMS(OBS, PRED)" C 92 1.032 1
116 1 20 1 "RMS(OBS, PRED)" CA 100 1.219 1
117 1 20 1 "RMS(OBS, PRED)" CB 94 1.139 1
118 1 20 1 "RMS(OBS, PRED)" H 93 0.819 1
119 1 20 1 "RMS(OBS, PRED)" HA 106 0.358 1
120 1 20 1 "RMS(OBS, PRED)" N 93 2.926 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 7 . 1 1 A 2 2 GLN H H 91 8.786 8.482 0.304 2
1 8 . 1 1 A 2 2 GLN HA H 91 4.005 3.946 0.058 2
1 15 . 1 1 A 2 2 GLN C C 91 177.270 177.769 -0.499 2
1 16 . 1 1 A 2 2 GLN CA C 91 58.220 59.172 -0.953 2
1 17 . 1 1 A 2 2 GLN CB C 91 28.650 28.322 0.328 2
1 19 . 1 1 A 2 2 GLN N N 91 121.993 123.329 -1.336 2
1 21 . 1 1 A 3 3 GLU H H 92 8.430 8.346 0.084 2
1 22 . 1 1 A 3 3 GLU HA H 92 4.007 4.077 -0.070 2
1 27 . 1 1 A 3 3 GLU C C 92 178.287 178.912 -0.625 2
1 28 . 1 1 A 3 3 GLU CA C 92 59.490 59.454 0.036 2
1 29 . 1 1 A 3 3 GLU CB C 92 29.506 29.285 0.221 2
1 31 . 1 1 A 3 3 GLU N N 92 120.195 119.983 0.212 2
1 32 . 1 1 A 4 4 SER H H 93 8.209 7.786 0.423 2
1 33 . 1 1 A 4 4 SER HA H 93 4.272 4.245 0.027 2
1 36 . 1 1 A 4 4 SER C C 93 177.369 177.050 0.319 2
1 37 . 1 1 A 4 4 SER CA C 93 61.044 61.771 -0.727 2
1 38 . 1 1 A 4 4 SER CB C 93 62.950 62.899 0.051 2
1 39 . 1 1 A 4 4 SER N N 93 115.524 115.525 -0.001 2
1 40 . 1 1 A 5 5 ILE H H 94 8.080 7.721 0.359 2
1 41 . 1 1 A 5 5 ILE HA H 94 3.530 3.634 -0.104 2
1 51 . 1 1 A 5 5 ILE C C 94 177.778 177.589 0.189 2
1 52 . 1 1 A 5 5 ILE CA C 94 65.710 65.309 0.401 2
1 53 . 1 1 A 5 5 ILE CB C 94 37.800 37.458 0.342 2
1 57 . 1 1 A 5 5 ILE N N 94 124.148 121.833 2.315 2
1 58 . 1 1 A 6 6 GLN H H 95 8.374 8.234 0.140 2
1 59 . 1 1 A 6 6 GLN HA H 95 4.125 3.959 0.166 2
1 66 . 1 1 A 6 6 GLN C C 95 179.726 179.241 0.485 2
1 67 . 1 1 A 6 6 GLN CA C 95 59.190 58.989 0.201 2
1 68 . 1 1 A 6 6 GLN CB C 95 27.060 28.394 -1.334 2
1 70 . 1 1 A 6 6 GLN N N 95 118.257 118.715 -0.458 2
1 72 . 1 1 A 7 7 ASN H H 96 8.456 8.155 0.301 2
1 73 . 1 1 A 7 7 ASN HA H 96 4.446 4.537 -0.091 2
1 78 . 1 1 A 7 7 ASN C C 96 177.257 177.846 -0.589 2
1 79 . 1 1 A 7 7 ASN CA C 96 56.020 56.140 -0.120 2
1 80 . 1 1 A 7 7 ASN CB C 96 38.126 37.825 0.301 2
1 81 . 1 1 A 7 7 ASN N N 96 118.597 118.417 0.180 2
1 83 . 1 1 A 8 8 LYS H H 97 7.732 7.824 -0.092 2
1 84 . 1 1 A 8 8 LYS HA H 97 4.129 4.089 0.040 2
1 93 . 1 1 A 8 8 LYS C C 97 179.143 179.340 -0.197 2
1 94 . 1 1 A 8 8 LYS CA C 97 59.126 59.736 -0.610 2
1 95 . 1 1 A 8 8 LYS CB C 97 32.070 32.330 -0.260 2
1 99 . 1 1 A 8 8 LYS N N 97 122.381 120.126 2.255 2
1 100 . 1 1 A 9 9 ILE H H 98 8.452 8.025 0.427 2
1 101 . 1 1 A 9 9 ILE HA H 98 3.480 3.926 -0.446 2
1 111 . 1 1 A 9 9 ILE C C 98 177.406 178.531 -1.125 2
1 112 . 1 1 A 9 9 ILE CA C 98 66.430 64.306 2.124 2
1 113 . 1 1 A 9 9 ILE CB C 98 37.980 37.165 0.815 2
1 117 . 1 1 A 9 9 ILE N N 98 119.950 120.402 -0.452 2
1 118 . 1 1 A 10 10 SER H H 99 7.924 7.799 0.125 2
1 119 . 1 1 A 10 10 SER HA H 99 3.983 4.288 -0.305 2
1 122 . 1 1 A 10 10 SER C C 99 176.327 176.252 0.075 2
1 123 . 1 1 A 10 10 SER CA C 99 61.990 61.265 0.725 2
1 124 . 1 1 A 10 10 SER CB C 99 62.790 63.282 -0.492 2
1 125 . 1 1 A 10 10 SER N N 99 113.568 117.717 -4.149 2
1 126 . 1 1 A 11 11 GLN H H 100 7.832 7.891 -0.059 2
1 127 . 1 1 A 11 11 GLN HA H 100 4.238 4.380 -0.142 2
1 134 . 1 1 A 11 11 GLN C C 100 178.088 177.980 0.108 2
1 135 . 1 1 A 11 11 GLN CA C 100 57.900 57.627 0.273 2
1 136 . 1 1 A 11 11 GLN CB C 100 29.790 29.588 0.202 2
1 138 . 1 1 A 11 11 GLN N N 100 117.487 117.819 -0.332 2
1 140 . 1 1 A 12 12 CYS H H 101 7.920 8.140 -0.220 2
1 141 . 1 1 A 12 12 CYS HA H 101 4.657 4.519 0.138 2
1 144 . 1 1 A 12 12 CYS C C 101 175.439 174.723 0.716 2
1 145 . 1 1 A 12 12 CYS CA C 101 60.654 60.154 0.500 2
1 146 . 1 1 A 12 12 CYS CB C 101 29.310 27.608 1.702 2
1 147 . 1 1 A 12 12 CYS N N 101 114.221 118.004 -3.783 2
1 148 . 1 1 A 13 13 LYS H H 102 7.993 7.442 0.551 2
1 149 . 1 1 A 13 13 LYS HA H 102 5.038 4.519 0.519 2
1 158 . 1 1 A 13 13 LYS C C 102 174.757 176.245 -1.488 2
1 159 . 1 1 A 13 13 LYS CA C 102 56.660 56.064 0.596 2
1 160 . 1 1 A 13 13 LYS CB C 102 32.970 33.420 -0.450 2
1 164 . 1 1 A 13 13 LYS N N 102 123.841 119.187 4.654 2
1 165 . 1 1 A 14 14 PHE H H 103 8.822 8.628 0.194 2
1 166 . 1 1 A 14 14 PHE HA H 103 5.058 5.090 -0.032 2
1 174 . 1 1 A 14 14 PHE C C 103 173.560 173.119 0.441 2
1 175 . 1 1 A 14 14 PHE CA C 103 55.470 55.993 -0.523 2
1 176 . 1 1 A 14 14 PHE CB C 103 41.760 40.710 1.050 2
1 180 . 1 1 A 14 14 PHE N N 103 118.421 116.398 2.023 2
1 181 . 1 1 A 15 15 SER H H 104 8.826 8.630 0.196 2
1 182 . 1 1 A 15 15 SER HA H 104 4.602 4.736 -0.134 2
1 185 . 1 1 A 15 15 SER C C 104 173.851 173.510 0.341 2
1 186 . 1 1 A 15 15 SER CA C 104 58.610 58.143 0.467 2
1 187 . 1 1 A 15 15 SER CB C 104 62.690 62.587 0.103 2
1 188 . 1 1 A 15 15 SER N N 104 117.781 115.669 2.112 2
1 189 . 1 1 A 16 16 VAL H H 105 7.839 8.150 -0.311 2
1 190 . 1 1 A 16 16 VAL HA H 105 3.390 4.321 -0.931 2
1 198 . 1 1 A 16 16 VAL C C 105 174.987 175.174 -0.187 2
1 199 . 1 1 A 16 16 VAL CA C 105 63.650 62.414 1.236 2
1 200 . 1 1 A 16 16 VAL CB C 105 31.410 30.369 1.041 2
1 203 . 1 1 A 16 16 VAL N N 105 129.036 126.413 2.623 2
1 204 . 1 1 A 17 17 CYS H H 106 8.536 8.227 0.309 2
1 205 . 1 1 A 17 17 CYS HA H 106 5.011 4.950 0.061 2
1 208 . 1 1 A 17 17 CYS CA C 106 55.260 56.492 -1.232 2
1 209 . 1 1 A 17 17 CYS CB C 106 28.210 30.365 -2.155 2
1 210 . 1 1 A 17 17 CYS N N 106 130.045 127.131 2.914 2
1 211 . 1 1 A 18 18 PRO HA H 107 3.991 4.399 -0.408 2
1 218 . 1 1 A 18 18 PRO C C 107 178.188 178.198 -0.010 2
1 219 . 1 1 A 18 18 PRO CA C 107 65.940 64.790 1.150 2
1 220 . 1 1 A 18 18 PRO CB C 107 32.000 32.032 -0.032 2
1 223 . 1 1 A 19 19 GLU H H 108 9.260 8.982 0.278 2
1 224 . 1 1 A 19 19 GLU HA H 108 4.119 4.096 0.023 2
1 229 . 1 1 A 19 19 GLU C C 108 178.721 179.128 -0.407 2
1 230 . 1 1 A 19 19 GLU CA C 108 59.300 59.357 -0.057 2
1 231 . 1 1 A 19 19 GLU CB C 108 28.920 28.761 0.159 2
1 233 . 1 1 A 19 19 GLU N N 108 118.270 116.519 1.751 2
1 234 . 1 1 A 20 20 ARG H H 109 7.672 7.807 -0.135 2
1 235 . 1 1 A 20 20 ARG HA H 109 4.331 4.176 0.155 2
1 242 . 1 1 A 20 20 ARG C C 109 177.977 178.380 -0.403 2
1 243 . 1 1 A 20 20 ARG CA C 109 57.350 58.925 -1.575 2
1 244 . 1 1 A 20 20 ARG CB C 109 30.820 30.628 0.192 2
1 247 . 1 1 A 20 20 ARG N N 109 118.357 119.484 -1.127 2
1 248 . 1 1 A 21 21 LEU H H 110 7.601 7.803 -0.202 2
1 249 . 1 1 A 21 21 LEU HA H 110 4.380 4.354 0.026 2
1 259 . 1 1 A 21 21 LEU C C 110 176.562 176.322 0.240 2
1 260 . 1 1 A 21 21 LEU CA C 110 56.096 55.483 0.613 2
1 261 . 1 1 A 21 21 LEU CB C 110 44.016 42.259 1.757 2
1 265 . 1 1 A 21 21 LEU N N 110 118.626 118.619 0.007 2
1 266 . 1 1 A 22 22 GLN H H 111 7.750 7.669 0.081 2
1 267 . 1 1 A 22 22 GLN HA H 111 3.870 3.969 -0.099 2
1 274 . 1 1 A 22 22 GLN C C 111 173.336 174.205 -0.869 2
1 275 . 1 1 A 22 22 GLN CA C 111 56.510 57.281 -0.771 2
1 276 . 1 1 A 22 22 GLN CB C 111 26.800 26.507 0.293 2
1 278 . 1 1 A 22 22 GLN N N 111 113.926 115.749 -1.823 2
1 280 . 1 1 A 23 23 CYS H H 112 7.407 7.735 -0.328 2
1 281 . 1 1 A 23 23 CYS HA H 112 4.469 4.897 -0.428 2
1 284 . 1 1 A 23 23 CYS CA C 112 52.650 56.673 -4.023 2
1 285 . 1 1 A 23 23 CYS CB C 112 29.750 29.113 0.637 2
1 286 . 1 1 A 23 23 CYS N N 112 112.681 117.561 -4.880 2
1 287 . 1 1 A 24 24 PRO HA H 113 4.408 4.489 -0.081 2
1 294 . 1 1 A 24 24 PRO C C 113 178.175 177.547 0.628 2
1 295 . 1 1 A 24 24 PRO CA C 113 62.040 62.523 -0.483 2
1 296 . 1 1 A 24 24 PRO CB C 113 31.920 32.809 -0.889 2
1 299 . 1 1 A 25 25 LEU H H 114 8.593 8.820 -0.227 2
1 300 . 1 1 A 25 25 LEU HA H 114 3.765 4.053 -0.288 2
1 310 . 1 1 A 25 25 LEU C C 114 179.950 178.629 1.321 2
1 311 . 1 1 A 25 25 LEU CA C 114 57.674 58.000 -0.326 2
1 312 . 1 1 A 25 25 LEU CB C 114 40.690 41.436 -0.746 2
1 316 . 1 1 A 25 25 LEU N N 114 123.729 123.950 -0.221 2
1 317 . 1 1 A 26 26 GLU H H 115 9.108 8.318 0.790 2
1 318 . 1 1 A 26 26 GLU HA H 115 3.876 3.998 -0.122 2
1 323 . 1 1 A 26 26 GLU C C 115 177.505 179.166 -1.661 2
1 324 . 1 1 A 26 26 GLU CA C 115 59.410 59.548 -0.138 2
1 325 . 1 1 A 26 26 GLU CB C 115 28.460 29.207 -0.747 2
1 327 . 1 1 A 26 26 GLU N N 115 116.817 118.100 -1.283 2
1 328 . 1 1 A 27 27 ALA H H 116 7.360 7.727 -0.367 2
1 329 . 1 1 A 27 27 ALA HA H 116 4.408 3.884 0.524 2
1 333 . 1 1 A 27 27 ALA C C 116 177.046 178.376 -1.330 2
1 334 . 1 1 A 27 27 ALA CA C 116 52.970 54.597 -1.627 2
1 335 . 1 1 A 27 27 ALA CB C 116 19.916 17.943 1.973 2
1 336 . 1 1 A 27 27 ALA N N 116 118.966 121.516 -2.550 2
1 337 . 1 1 A 28 28 ILE H H 117 7.168 7.160 0.009 2
1 338 . 1 1 A 28 28 ILE HA H 117 4.432 4.741 -0.309 2
1 348 . 1 1 A 28 28 ILE C C 117 172.641 175.564 -2.923 2
1 349 . 1 1 A 28 28 ILE CA C 117 59.980 60.365 -0.385 2
1 350 . 1 1 A 28 28 ILE CB C 117 37.350 37.889 -0.539 2
1 354 . 1 1 A 28 28 ILE N N 117 108.913 109.054 -0.141 2
1 355 . 1 1 A 29 29 GLN H H 118 6.562 7.451 -0.889 2
1 356 . 1 1 A 29 29 GLN HA H 118 3.922 4.220 -0.297 2
1 363 . 1 1 A 29 29 GLN C C 118 175.049 175.609 -0.560 2
1 364 . 1 1 A 29 29 GLN CA C 118 54.596 56.010 -1.414 2
1 365 . 1 1 A 29 29 GLN CB C 118 29.570 29.182 0.388 2
1 367 . 1 1 A 29 29 GLN N N 118 116.455 123.244 -6.789 2
1 369 . 1 1 A 30 30 CYS H H 119 8.138 8.410 -0.272 2
1 370 . 1 1 A 30 30 CYS HA H 119 4.580 4.531 0.049 2
1 373 . 1 1 A 30 30 CYS CA C 119 57.810 57.476 0.334 2
1 374 . 1 1 A 30 30 CYS CB C 119 30.200 28.760 1.440 2
1 375 . 1 1 A 30 30 CYS N N 119 134.136 125.411 8.725 2
1 376 . 1 1 A 31 31 PRO HA H 120 4.424 4.397 0.027 2
1 383 . 1 1 A 31 31 PRO C C 120 177.431 178.479 -1.048 2
1 384 . 1 1 A 31 31 PRO CA C 120 64.060 64.663 -0.603 2
1 385 . 1 1 A 31 31 PRO CB C 120 32.776 32.103 0.673 2
1 388 . 1 1 A 32 32 ILE H H 121 11.318 7.364 3.954 2
1 389 . 1 1 A 32 32 ILE HA H 121 4.038 3.967 0.071 2
1 399 . 1 1 A 32 32 ILE C C 121 178.485 177.636 0.849 2
1 400 . 1 1 A 32 32 ILE CA C 121 64.060 64.047 0.013 2
1 401 . 1 1 A 32 32 ILE CB C 121 39.340 38.419 0.921 2
1 405 . 1 1 A 32 32 ILE N N 121 124.500 116.730 7.770 2
1 406 . 1 1 A 33 33 THR H H 122 9.928 7.398 2.530 2
1 407 . 1 1 A 33 33 THR HA H 122 4.048 4.462 -0.414 2
1 412 . 1 1 A 33 33 THR C C 122 175.793 174.496 1.297 2
1 413 . 1 1 A 33 33 THR CA C 122 62.990 61.454 1.536 2
1 414 . 1 1 A 33 33 THR CB C 122 70.300 69.142 1.158 2
1 416 . 1 1 A 33 33 THR N N 122 115.136 108.716 6.420 2
1 417 . 1 1 A 34 34 LEU H H 123 8.439 7.771 0.668 2
1 418 . 1 1 A 34 34 LEU HA H 123 3.912 4.039 -0.127 2
1 428 . 1 1 A 34 34 LEU C C 123 175.495 175.509 -0.014 2
1 429 . 1 1 A 34 34 LEU CA C 123 56.290 55.861 0.429 2
1 430 . 1 1 A 34 34 LEU CB C 123 38.500 39.722 -1.222 2
1 434 . 1 1 A 34 34 LEU N N 123 117.230 121.220 -3.990 2
1 435 . 1 1 A 35 35 GLU H H 124 7.816 7.480 0.336 2
1 436 . 1 1 A 35 35 GLU HA H 124 4.634 4.690 -0.056 2
1 441 . 1 1 A 35 35 GLU C C 124 174.838 174.098 0.740 2
1 442 . 1 1 A 35 35 GLU CA C 124 53.780 54.713 -0.933 2
1 443 . 1 1 A 35 35 GLU CB C 124 33.710 32.139 1.571 2
1 445 . 1 1 A 35 35 GLU N N 124 116.577 116.384 0.193 2
1 446 . 1 1 A 36 36 GLN H H 125 8.532 8.568 -0.036 2
1 447 . 1 1 A 36 36 GLN HA H 125 4.958 4.391 0.567 2
1 454 . 1 1 A 36 36 GLN CA C 125 53.350 53.797 -0.447 2
1 455 . 1 1 A 36 36 GLN CB C 125 29.950 29.878 0.072 2
1 457 . 1 1 A 36 36 GLN N N 125 123.034 121.475 1.559 2
1 459 . 1 1 A 37 37 PRO HA H 126 4.458 4.366 0.092 2
1 466 . 1 1 A 37 37 PRO C C 126 176.314 177.305 -0.991 2
1 467 . 1 1 A 37 37 PRO CA C 126 62.816 65.701 -2.885 2
1 468 . 1 1 A 37 37 PRO CB C 126 33.070 31.566 1.504 2
1 471 . 1 1 A 38 38 GLU H H 127 8.626 7.786 0.840 2
1 472 . 1 1 A 38 38 GLU HA H 127 4.274 4.491 -0.217 2
1 477 . 1 1 A 38 38 GLU C C 127 177.809 174.988 2.821 2
1 478 . 1 1 A 38 38 GLU CA C 127 58.730 58.323 0.407 2
1 479 . 1 1 A 38 38 GLU CB C 127 30.340 29.451 0.889 2
1 481 . 1 1 A 38 38 GLU N N 127 120.691 119.213 1.478 2
1 482 . 1 1 A 39 39 LYS H H 128 7.891 7.883 0.008 2
1 483 . 1 1 A 39 39 LYS HA H 128 4.870 4.751 0.119 2
1 492 . 1 1 A 39 39 LYS C C 128 175.452 175.765 -0.313 2
1 493 . 1 1 A 39 39 LYS CA C 128 53.540 54.722 -1.182 2
1 494 . 1 1 A 39 39 LYS CB C 128 33.630 34.571 -0.941 2
1 498 . 1 1 A 39 39 LYS N N 128 118.149 118.067 0.082 2
1 499 . 1 1 A 40 40 GLY H H 129 8.524 8.061 0.463 2
1 500 . 1 1 A 40 40 GLY HA2 H 129 4.973 4.045 0.928 2
1 501 . 1 1 A 40 40 GLY HA3 H 129 2.459 4.176 -1.717 2
1 502 . 1 1 A 40 40 GLY C C 129 169.943 171.913 -1.970 2
1 503 . 1 1 A 40 40 GLY CA C 129 42.910 44.930 -2.020 2
1 504 . 1 1 A 40 40 GLY N N 129 112.845 110.632 2.213 2
1 505 . 1 1 A 41 41 ILE H H 130 8.659 8.136 0.523 2
1 506 . 1 1 A 41 41 ILE HA H 130 4.591 4.761 -0.170 2
1 516 . 1 1 A 41 41 ILE C C 130 172.586 174.011 -1.425 2
1 517 . 1 1 A 41 41 ILE CA C 130 58.090 59.049 -0.959 2
1 518 . 1 1 A 41 41 ILE CB C 130 43.320 41.936 1.384 2
1 522 . 1 1 A 41 41 ILE N N 130 114.060 119.334 -5.274 2
1 523 . 1 1 A 42 42 PHE H H 131 9.206 8.785 0.421 2
1 524 . 1 1 A 42 42 PHE HA H 131 5.159 4.721 0.438 2
1 532 . 1 1 A 42 42 PHE C C 131 174.931 175.823 -0.892 2
1 533 . 1 1 A 42 42 PHE CA C 131 57.790 58.093 -0.303 2
1 534 . 1 1 A 42 42 PHE CB C 131 42.220 39.162 3.058 2
1 538 . 1 1 A 42 42 PHE N N 131 126.002 128.327 -2.325 2
1 539 . 1 1 A 43 43 VAL H H 132 8.502 8.914 -0.412 2
1 540 . 1 1 A 43 43 VAL HA H 132 4.921 4.700 0.221 2
1 548 . 1 1 A 43 43 VAL C C 132 178.219 175.456 2.763 2
1 549 . 1 1 A 43 43 VAL CA C 132 59.600 60.132 -0.532 2
1 550 . 1 1 A 43 43 VAL CB C 132 35.920 35.558 0.362 2
1 553 . 1 1 A 43 43 VAL N N 132 119.068 122.901 -3.833 2
1 554 . 1 1 A 44 44 LYS H H 133 10.036 8.740 1.296 2
1 555 . 1 1 A 44 44 LYS HA H 133 5.070 4.321 0.749 2
1 564 . 1 1 A 44 44 LYS C C 133 177.276 177.779 -0.503 2
1 565 . 1 1 A 44 44 LYS CA C 133 56.720 57.130 -0.410 2
1 566 . 1 1 A 44 44 LYS CB C 133 34.410 32.814 1.596 2
1 570 . 1 1 A 44 44 LYS N N 133 130.934 125.368 5.566 2
1 571 . 1 1 A 45 45 ASN H H 134 8.093 8.776 -0.683 2
1 572 . 1 1 A 45 45 ASN HA H 134 4.152 4.652 -0.500 2
1 577 . 1 1 A 45 45 ASN C C 134 174.087 175.076 -0.989 2
1 578 . 1 1 A 45 45 ASN CA C 134 55.360 55.717 -0.356 2
1 579 . 1 1 A 45 45 ASN CB C 134 37.530 39.174 -1.644 2
1 580 . 1 1 A 45 45 ASN N N 134 117.963 122.565 -4.602 2
1 582 . 1 1 A 46 46 SER H H 135 7.524 7.743 -0.219 2
1 583 . 1 1 A 46 46 SER HA H 135 4.219 4.692 -0.473 2
1 586 . 1 1 A 46 46 SER C C 135 174.490 174.171 0.319 2
1 587 . 1 1 A 46 46 SER CA C 135 57.090 56.294 0.796 2
1 588 . 1 1 A 46 46 SER CB C 135 63.860 66.240 -2.380 2
1 589 . 1 1 A 46 46 SER N N 135 105.939 109.252 -3.313 2
1 590 . 1 1 A 47 47 ASP H H 136 9.113 9.007 0.106 2
1 591 . 1 1 A 47 47 ASP HA H 136 4.220 4.256 -0.036 2
1 594 . 1 1 A 47 47 ASP CA C 136 57.610 57.163 0.447 2
1 595 . 1 1 A 47 47 ASP CB C 136 40.810 40.694 0.116 2
1 596 . 1 1 A 47 47 ASP N N 136 120.995 123.692 -2.697 2
1 597 . 1 1 A 48 48 GLY H H 137 8.181 8.121 0.060 2
1 598 . 1 1 A 48 48 GLY HA2 H 137 4.120 3.910 0.210 2
1 599 . 1 1 A 48 48 GLY HA3 H 137 3.659 3.910 -0.251 2
1 600 . 1 1 A 48 48 GLY C C 137 174.062 173.813 0.249 2
1 601 . 1 1 A 48 48 GLY CA C 137 45.130 46.199 -1.069 2
1 602 . 1 1 A 48 48 GLY N N 137 106.197 106.889 -0.692 2
1 603 . 1 1 A 49 49 SER H H 138 7.179 7.622 -0.443 2
1 604 . 1 1 A 49 49 SER HA H 138 4.383 4.819 -0.436 2
1 607 . 1 1 A 49 49 SER C C 138 173.864 173.659 0.205 2
1 608 . 1 1 A 49 49 SER CA C 138 57.614 57.835 -0.221 2
1 609 . 1 1 A 49 49 SER CB C 138 65.100 66.095 -0.995 2
1 610 . 1 1 A 49 49 SER N N 138 115.015 115.010 0.005 2
1 611 . 1 1 A 50 50 ASP H H 139 8.078 8.646 -0.568 2
1 612 . 1 1 A 50 50 ASP HA H 139 4.642 4.809 -0.167 2
1 615 . 1 1 A 50 50 ASP C C 139 174.261 175.269 -1.008 2
1 616 . 1 1 A 50 50 ASP CA C 139 52.406 54.394 -1.988 2
1 617 . 1 1 A 50 50 ASP CB C 139 40.254 40.889 -0.634 2
1 618 . 1 1 A 50 50 ASP N N 139 122.400 122.560 -0.160 2
1 619 . 1 1 A 51 51 VAL H H 140 8.111 7.500 0.611 2
1 620 . 1 1 A 51 51 VAL HA H 140 4.360 4.452 -0.092 2
1 628 . 1 1 A 51 51 VAL C C 140 176.147 174.134 2.013 2
1 629 . 1 1 A 51 51 VAL CA C 140 62.670 61.126 1.544 2
1 630 . 1 1 A 51 51 VAL CB C 140 33.930 32.930 1.000 2
1 632 . 1 1 A 51 51 VAL N N 140 120.374 120.087 0.287 2
1 633 . 1 1 A 52 52 CYS H H 141 8.358 9.031 -0.673 2
1 634 . 1 1 A 52 52 CYS HA H 141 4.957 5.428 -0.471 2
1 637 . 1 1 A 52 52 CYS C C 141 173.070 172.983 0.087 2
1 638 . 1 1 A 52 52 CYS CA C 141 53.380 54.577 -1.197 2
1 639 . 1 1 A 52 52 CYS CB C 141 46.110 45.467 0.643 2
1 640 . 1 1 A 52 52 CYS N N 141 121.305 129.079 -7.774 2
1 641 . 1 1 A 53 53 THR H H 142 8.929 8.781 0.148 2
1 642 . 1 1 A 53 53 THR HA H 142 4.498 4.965 -0.467 2
1 648 . 1 1 A 53 53 THR C C 142 172.151 172.401 -0.250 2
1 649 . 1 1 A 53 53 THR CA C 142 62.960 61.249 1.710 2
1 650 . 1 1 A 53 53 THR CB C 142 70.540 72.451 -1.911 2
1 652 . 1 1 A 53 53 THR N N 142 120.105 119.204 0.901 2
1 653 . 1 1 A 54 54 LEU H H 143 8.448 8.734 -0.286 2
1 654 . 1 1 A 54 54 LEU HA H 143 4.322 4.766 -0.444 2
1 664 . 1 1 A 54 54 LEU C C 143 174.484 174.449 0.035 2
1 665 . 1 1 A 54 54 LEU CA C 143 54.596 53.396 1.200 2
1 666 . 1 1 A 54 54 LEU CB C 143 42.396 43.667 -1.271 2
1 670 . 1 1 A 54 54 LEU N N 143 128.819 128.739 0.080 2
1 671 . 1 1 A 55 55 PHE H H 144 8.661 8.719 -0.058 2
1 672 . 1 1 A 55 55 PHE HA H 144 5.459 4.990 0.469 2
1 680 . 1 1 A 55 55 PHE C C 144 176.035 174.764 1.271 2
1 681 . 1 1 A 55 55 PHE CA C 144 55.020 56.694 -1.674 2
1 682 . 1 1 A 55 55 PHE CB C 144 44.100 42.603 1.497 2
1 686 . 1 1 A 55 55 PHE N N 144 121.897 126.114 -4.217 2
1 687 . 1 1 A 56 56 ASP H H 145 11.616 8.564 3.052 2
1 688 . 1 1 A 56 56 ASP HA H 145 4.417 4.655 -0.238 2
1 691 . 1 1 A 56 56 ASP C C 145 176.748 177.308 -0.560 2
1 692 . 1 1 A 56 56 ASP CA C 145 55.844 54.287 1.557 2
1 693 . 1 1 A 56 56 ASP CB C 145 44.390 42.948 1.442 2
1 694 . 1 1 A 56 56 ASP N N 145 122.131 121.672 0.459 2
1 695 . 1 1 A 57 57 ALA H H 146 8.508 8.972 -0.464 2
1 696 . 1 1 A 57 57 ALA HA H 146 3.797 4.059 -0.262 2
1 700 . 1 1 A 57 57 ALA C C 146 178.696 180.076 -1.380 2
1 701 . 1 1 A 57 57 ALA CA C 146 55.990 55.348 0.642 2
1 702 . 1 1 A 57 57 ALA CB C 146 18.840 18.109 0.731 2
1 703 . 1 1 A 57 57 ALA N N 146 130.243 128.701 1.542 2
1 704 . 1 1 A 58 58 ALA H H 147 8.378 7.821 0.557 2
1 705 . 1 1 A 58 58 ALA HA H 147 4.078 4.190 -0.112 2
1 709 . 1 1 A 58 58 ALA C C 147 181.091 179.612 1.479 2
1 710 . 1 1 A 58 58 ALA CA C 147 54.770 54.972 -0.202 2
1 711 . 1 1 A 58 58 ALA CB C 147 17.700 18.455 -0.755 2
1 712 . 1 1 A 58 58 ALA N N 147 121.997 119.741 2.256 2
1 713 . 1 1 A 59 59 ALA H H 148 9.138 8.019 1.119 2
1 714 . 1 1 A 59 59 ALA HA H 148 3.975 4.074 -0.100 2
1 718 . 1 1 A 59 59 ALA C C 148 180.508 179.820 0.688 2
1 719 . 1 1 A 59 59 ALA CA C 148 54.840 55.036 -0.196 2
1 720 . 1 1 A 59 59 ALA CB C 148 18.600 18.594 0.006 2
1 721 . 1 1 A 59 59 ALA N N 148 123.595 120.508 3.087 2
1 722 . 1 1 A 60 60 PHE H H 149 8.814 8.075 0.739 2
1 723 . 1 1 A 60 60 PHE HA H 149 3.722 3.987 -0.265 2
1 731 . 1 1 A 60 60 PHE C C 149 176.773 177.529 -0.756 2
1 732 . 1 1 A 60 60 PHE CA C 149 62.030 61.464 0.566 2
1 733 . 1 1 A 60 60 PHE CB C 149 39.960 38.894 1.066 2
1 737 . 1 1 A 60 60 PHE N N 149 120.354 119.936 0.418 2
1 738 . 1 1 A 61 61 SER H H 150 8.276 8.174 0.102 2
1 739 . 1 1 A 61 61 SER HA H 150 3.880 4.040 -0.160 2
1 742 . 1 1 A 61 61 SER C C 150 177.691 176.496 1.195 2
1 743 . 1 1 A 61 61 SER CA C 150 62.190 61.526 0.664 2
1 744 . 1 1 A 61 61 SER CB C 150 63.016 62.920 0.096 2
1 745 . 1 1 A 61 61 SER N N 150 112.086 114.183 -2.097 2
1 746 . 1 1 A 62 62 ARG H H 151 7.829 7.847 -0.018 2
1 747 . 1 1 A 62 62 ARG HA H 151 3.971 4.040 -0.069 2
1 754 . 1 1 A 62 62 ARG C C 151 178.287 178.371 -0.084 2
1 755 . 1 1 A 62 62 ARG CA C 151 59.340 58.857 0.483 2
1 756 . 1 1 A 62 62 ARG CB C 151 29.760 29.827 -0.067 2
1 759 . 1 1 A 62 62 ARG N N 151 121.090 119.283 1.807 2
1 760 . 1 1 A 63 63 LEU H H 152 7.390 7.539 -0.149 2
1 761 . 1 1 A 63 63 LEU HA H 152 3.791 3.919 -0.128 2
1 771 . 1 1 A 63 63 LEU C C 152 179.106 178.215 0.891 2
1 772 . 1 1 A 63 63 LEU CA C 152 58.900 58.205 0.695 2
1 773 . 1 1 A 63 63 LEU CB C 152 41.140 41.321 -0.181 2
1 777 . 1 1 A 63 63 LEU N N 152 121.129 122.134 -1.005 2
1 778 . 1 1 A 64 64 VAL H H 153 7.552 7.933 -0.381 2
1 779 . 1 1 A 64 64 VAL HA H 153 3.411 3.473 -0.062 2
1 787 . 1 1 A 64 64 VAL C C 153 180.595 178.531 2.063 2
1 788 . 1 1 A 64 64 VAL CA C 153 65.644 66.117 -0.473 2
1 789 . 1 1 A 64 64 VAL CB C 153 31.410 31.347 0.063 2
1 792 . 1 1 A 64 64 VAL N N 153 118.280 118.939 -0.659 2
1 793 . 1 1 A 65 65 GLY H H 154 8.061 8.206 -0.145 2
1 794 . 1 1 A 65 65 GLY HA2 H 154 3.846 3.764 0.081 2
1 795 . 1 1 A 65 65 GLY HA3 H 154 3.809 3.766 0.043 2
1 796 . 1 1 A 65 65 GLY C C 154 175.235 175.982 -0.747 2
1 797 . 1 1 A 65 65 GLY CA C 154 46.630 46.911 -0.281 2
1 798 . 1 1 A 65 65 GLY N N 154 108.622 107.721 0.901 2
1 799 . 1 1 A 66 66 GLU H H 155 7.528 7.559 -0.031 2
1 800 . 1 1 A 66 66 GLU HA H 155 4.228 4.284 -0.056 2
1 805 . 1 1 A 66 66 GLU C C 155 176.761 177.006 -0.245 2
1 806 . 1 1 A 66 66 GLU CA C 155 56.590 56.511 0.079 2
1 807 . 1 1 A 66 66 GLU CB C 155 30.490 30.132 0.358 2
1 809 . 1 1 A 66 66 GLU N N 155 118.361 119.175 -0.814 2
1 810 . 1 1 A 67 67 GLY H H 156 7.884 7.779 0.105 2
1 811 . 1 1 A 67 67 GLY HA2 H 156 3.918 3.874 0.044 2
1 812 . 1 1 A 67 67 GLY HA3 H 156 3.747 3.888 -0.141 2
1 813 . 1 1 A 67 67 GLY C C 156 174.788 174.579 0.209 2
1 814 . 1 1 A 67 67 GLY CA C 156 45.890 46.005 -0.115 2
1 815 . 1 1 A 67 67 GLY N N 156 108.465 108.828 -0.363 2
1 816 . 1 1 A 68 68 LEU H H 157 7.332 7.708 -0.376 2
1 817 . 1 1 A 68 68 LEU HA H 157 4.361 4.582 -0.221 2
1 827 . 1 1 A 68 68 LEU CA C 157 53.060 52.228 0.832 2
1 828 . 1 1 A 68 68 LEU CB C 157 41.100 41.811 -0.711 2
1 832 . 1 1 A 68 68 LEU N N 157 121.920 121.594 0.326 2
1 833 . 1 1 A 69 69 PRO HA H 158 4.485 4.588 -0.103 2
1 840 . 1 1 A 69 69 PRO C C 158 174.602 176.305 -1.703 2
1 841 . 1 1 A 69 69 PRO CA C 158 61.556 62.259 -0.703 2
1 842 . 1 1 A 69 69 PRO CB C 158 32.370 32.617 -0.247 2
1 845 . 1 1 A 70 70 HIS H H 159 8.734 8.585 0.149 2
1 846 . 1 1 A 70 70 HIS HA H 159 3.947 4.521 -0.574 2
1 852 . 1 1 A 70 70 HIS CA C 159 56.250 55.240 1.010 2
1 853 . 1 1 A 70 70 HIS CB C 159 32.280 31.033 1.247 2
1 856 . 1 1 A 70 70 HIS N N 159 119.423 121.472 -2.049 2
1 857 . 1 1 A 71 71 PRO HA H 160 4.424 4.186 0.238 2
1 864 . 1 1 A 71 71 PRO C C 160 177.567 178.568 -1.001 2
1 865 . 1 1 A 71 71 PRO CA C 160 64.574 65.462 -0.888 2
1 866 . 1 1 A 71 71 PRO CB C 160 32.340 31.799 0.541 2
1 869 . 1 1 A 72 72 LEU H H 161 10.123 7.520 2.603 2
1 870 . 1 1 A 72 72 LEU HA H 161 4.778 4.288 0.490 2
1 880 . 1 1 A 72 72 LEU C C 161 178.721 177.978 0.743 2
1 881 . 1 1 A 72 72 LEU CA C 161 55.800 57.248 -1.448 2
1 882 . 1 1 A 72 72 LEU CB C 161 42.440 42.616 -0.176 2
1 886 . 1 1 A 72 72 LEU N N 161 117.374 117.434 -0.060 2
1 887 . 1 1 A 73 73 THR H H 162 7.523 7.839 -0.316 2
1 888 . 1 1 A 73 73 THR HA H 162 4.291 4.555 -0.264 2
1 893 . 1 1 A 73 73 THR C C 162 175.557 174.386 1.171 2
1 894 . 1 1 A 73 73 THR CA C 162 61.440 62.385 -0.945 2
1 895 . 1 1 A 73 73 THR CB C 162 70.500 69.787 0.713 2
1 897 . 1 1 A 73 73 THR N N 162 107.787 111.692 -3.905 2
1 898 . 1 1 A 74 74 ARG H H 163 8.361 7.915 0.446 2
1 899 . 1 1 A 74 74 ARG HA H 163 3.836 4.213 -0.377 2
1 906 . 1 1 A 74 74 ARG C C 163 174.701 175.217 -0.516 2
1 907 . 1 1 A 74 74 ARG CA C 163 57.980 57.497 0.483 2
1 908 . 1 1 A 74 74 ARG CB C 163 26.770 26.991 -0.221 2
1 911 . 1 1 A 74 74 ARG N N 163 115.130 118.628 -3.498 2
1 912 . 1 1 A 75 75 GLU H H 164 7.430 8.076 -0.647 2
1 913 . 1 1 A 75 75 GLU HA H 164 4.636 4.477 0.159 2
1 918 . 1 1 A 75 75 GLU CA C 164 53.699 55.077 -1.378 2
1 919 . 1 1 A 75 75 GLU CB C 164 29.550 28.594 0.956 2
1 921 . 1 1 A 75 75 GLU N N 164 120.076 118.918 1.158 2
1 922 . 1 1 A 76 76 PRO HA H 165 4.272 4.563 -0.291 2
1 929 . 1 1 A 76 76 PRO C C 165 176.649 176.909 -0.260 2
1 930 . 1 1 A 76 76 PRO CA C 165 63.204 63.011 0.193 2
1 931 . 1 1 A 76 76 PRO CB C 165 31.680 31.576 0.104 2
1 934 . 1 1 A 77 77 ILE H H 166 8.812 8.205 0.607 2
1 935 . 1 1 A 77 77 ILE HA H 166 3.838 4.315 -0.477 2
1 945 . 1 1 A 77 77 ILE C C 166 175.235 175.757 -0.522 2
1 946 . 1 1 A 77 77 ILE CA C 166 62.816 61.127 1.689 2
1 947 . 1 1 A 77 77 ILE CB C 166 37.750 37.183 0.567 2
1 951 . 1 1 A 77 77 ILE N N 166 123.831 124.097 -0.266 2
1 952 . 1 1 A 78 78 THR H H 167 6.625 8.585 -1.960 2
1 953 . 1 1 A 78 78 THR HA H 167 4.632 5.012 -0.380 2
1 958 . 1 1 A 78 78 THR C C 167 174.143 174.621 -0.478 2
1 959 . 1 1 A 78 78 THR CA C 167 58.750 59.887 -1.137 2
1 960 . 1 1 A 78 78 THR CB C 167 71.320 71.182 0.138 2
1 962 . 1 1 A 78 78 THR N N 167 115.293 119.058 -3.765 2
1 963 . 1 1 A 79 79 ALA H H 168 9.088 9.017 0.071 2
1 964 . 1 1 A 79 79 ALA HA H 168 3.916 4.109 -0.193 2
1 968 . 1 1 A 79 79 ALA C C 168 179.770 179.487 0.283 2
1 969 . 1 1 A 79 79 ALA CA C 168 55.480 55.072 0.408 2
1 970 . 1 1 A 79 79 ALA CB C 168 17.630 18.377 -0.747 2
1 971 . 1 1 A 79 79 ALA N N 168 122.102 127.610 -5.508 2
1 972 . 1 1 A 80 80 SER H H 169 7.988 7.689 0.299 2
1 973 . 1 1 A 80 80 SER HA H 169 4.091 4.219 -0.128 2
1 976 . 1 1 A 80 80 SER C C 169 175.836 176.473 -0.637 2
1 977 . 1 1 A 80 80 SER CA C 169 60.750 61.438 -0.688 2
1 978 . 1 1 A 80 80 SER CB C 169 62.510 63.076 -0.566 2
1 979 . 1 1 A 80 80 SER N N 169 109.660 113.379 -3.719 2
1 980 . 1 1 A 81 81 ILE H H 170 7.052 7.622 -0.570 2
1 981 . 1 1 A 81 81 ILE HA H 170 4.344 4.113 0.231 2
1 991 . 1 1 A 81 81 ILE C C 170 174.236 176.462 -2.226 2
1 992 . 1 1 A 81 81 ILE CA C 170 61.760 63.716 -1.956 2
1 993 . 1 1 A 81 81 ILE CB C 170 37.950 37.699 0.251 2
1 997 . 1 1 A 81 81 ILE N N 170 112.623 114.068 -1.445 2
1 998 . 1 1 A 82 82 ILE H H 171 7.345 7.387 -0.042 2
1 999 . 1 1 A 82 82 ILE HA H 171 4.288 4.026 0.262 2
1 1009 . 1 1 A 82 82 ILE C C 171 174.931 175.332 -0.401 2
1 1010 . 1 1 A 82 82 ILE CA C 171 61.420 61.886 -0.466 2
1 1011 . 1 1 A 82 82 ILE CB C 171 37.230 37.782 -0.553 2
1 1015 . 1 1 A 82 82 ILE N N 171 124.260 124.831 -0.571 2
1 1016 . 1 1 A 83 83 VAL H H 172 7.843 8.726 -0.883 2
1 1017 . 1 1 A 83 83 VAL HA H 172 4.818 5.058 -0.240 2
1 1025 . 1 1 A 83 83 VAL C C 172 174.918 175.601 -0.683 2
1 1026 . 1 1 A 83 83 VAL CA C 172 58.910 59.192 -0.282 2
1 1027 . 1 1 A 83 83 VAL CB C 172 34.570 35.118 -0.548 2
1 1030 . 1 1 A 83 83 VAL N N 172 118.856 121.979 -3.123 2
1 1031 . 1 1 A 84 84 LYS H H 173 8.347 8.730 -0.383 2
1 1032 . 1 1 A 84 84 LYS HA H 173 4.356 4.597 -0.241 2
1 1041 . 1 1 A 84 84 LYS C C 173 178.653 178.400 0.253 2
1 1042 . 1 1 A 84 84 LYS CA C 173 56.360 55.395 0.965 2
1 1043 . 1 1 A 84 84 LYS CB C 173 33.366 33.647 -0.281 2
1 1047 . 1 1 A 84 84 LYS N N 173 119.602 121.620 -2.018 2
1 1048 . 1 1 A 85 85 HIS H H 174 9.143 8.965 0.178 2
1 1049 . 1 1 A 85 85 HIS HA H 174 4.013 4.286 -0.273 2
1 1053 . 1 1 A 85 85 HIS C C 174 176.606 177.066 -0.460 2
1 1054 . 1 1 A 85 85 HIS CA C 174 58.820 60.212 -1.392 2
1 1055 . 1 1 A 85 85 HIS CB C 174 28.186 29.818 -1.632 2
1 1057 . 1 1 A 85 85 HIS N N 174 120.022 122.326 -2.304 2
1 1058 . 1 1 A 86 86 GLU H H 175 8.403 8.316 0.086 2
1 1059 . 1 1 A 86 86 GLU HA H 175 3.863 3.824 0.039 2
1 1064 . 1 1 A 86 86 GLU C C 175 177.040 178.910 -1.870 2
1 1065 . 1 1 A 86 86 GLU CA C 175 57.830 59.774 -1.944 2
1 1066 . 1 1 A 86 86 GLU CB C 175 28.690 29.234 -0.544 2
1 1068 . 1 1 A 86 86 GLU N N 175 116.124 118.635 -2.512 2
1 1069 . 1 1 A 87 87 GLU H H 176 7.669 7.964 -0.295 2
1 1070 . 1 1 A 87 87 GLU HA H 176 4.039 4.285 -0.246 2
1 1075 . 1 1 A 87 87 GLU C C 176 175.688 176.884 -1.196 2
1 1076 . 1 1 A 87 87 GLU CA C 176 57.906 58.804 -0.898 2
1 1077 . 1 1 A 87 87 GLU CB C 176 30.430 29.062 1.368 2
1 1079 . 1 1 A 87 87 GLU N N 176 116.183 118.547 -2.364 2
1 1080 . 1 1 A 88 88 CYS H H 177 6.750 7.351 -0.601 2
1 1081 . 1 1 A 88 88 CYS HA H 177 4.991 4.787 0.204 2
1 1084 . 1 1 A 88 88 CYS C C 177 172.325 173.139 -0.814 2
1 1085 . 1 1 A 88 88 CYS CA C 177 55.030 54.426 0.604 2
1 1086 . 1 1 A 88 88 CYS CB C 177 45.610 42.638 2.972 2
1 1087 . 1 1 A 88 88 CYS N N 177 114.838 116.668 -1.830 2
1 1088 . 1 1 A 89 89 ILE H H 178 9.128 8.813 0.315 2
1 1089 . 1 1 A 89 89 ILE HA H 178 4.536 4.925 -0.389 2
1 1099 . 1 1 A 89 89 ILE C C 178 174.893 174.438 0.455 2
1 1100 . 1 1 A 89 89 ILE CA C 178 59.160 59.321 -0.161 2
1 1101 . 1 1 A 89 89 ILE CB C 178 41.840 40.785 1.055 2
1 1105 . 1 1 A 89 89 ILE N N 178 120.564 121.396 -0.832 2
1 1106 . 1 1 A 90 90 TYR H H 179 9.349 9.065 0.284 2
1 1107 . 1 1 A 90 90 TYR HA H 179 3.568 4.223 -0.655 2
1 1112 . 1 1 A 90 90 TYR C C 179 173.950 173.932 0.018 2
1 1113 . 1 1 A 90 90 TYR CA C 179 61.180 57.964 3.216 2
1 1114 . 1 1 A 90 90 TYR CB C 179 37.530 38.387 -0.857 2
1 1116 . 1 1 A 90 90 TYR N N 179 129.033 126.733 2.300 2
1 1117 . 1 1 A 91 91 ASP H H 180 7.367 8.239 -0.872 2
1 1118 . 1 1 A 91 91 ASP HA H 180 4.662 4.590 0.072 2
1 1121 . 1 1 A 91 91 ASP C C 180 175.291 175.603 -0.312 2
1 1122 . 1 1 A 91 91 ASP CA C 180 52.230 52.541 -0.311 2
1 1123 . 1 1 A 91 91 ASP CB C 180 43.650 41.833 1.817 2
1 1124 . 1 1 A 91 91 ASP N N 180 129.305 128.712 0.593 2
1 1125 . 1 1 A 92 92 ASP H H 181 8.783 8.651 0.132 2
1 1126 . 1 1 A 92 92 ASP HA H 181 4.114 3.839 0.275 2
1 1129 . 1 1 A 92 92 ASP C C 181 177.573 177.821 -0.248 2
1 1130 . 1 1 A 92 92 ASP CA C 181 56.390 57.023 -0.633 2
1 1131 . 1 1 A 92 92 ASP CB C 181 41.330 40.388 0.942 2
1 1132 . 1 1 A 92 92 ASP N N 181 125.665 126.528 -0.863 2
1 1133 . 1 1 A 93 93 THR H H 182 8.284 7.777 0.507 2
1 1134 . 1 1 A 93 93 THR HA H 182 4.037 3.888 0.149 2
1 1139 . 1 1 A 93 93 THR C C 182 176.333 176.208 0.125 2
1 1140 . 1 1 A 93 93 THR CA C 182 65.320 66.660 -1.340 2
1 1141 . 1 1 A 93 93 THR CB C 182 68.560 68.304 0.256 2
1 1143 . 1 1 A 93 93 THR N N 182 114.688 116.341 -1.653 2
1 1144 . 1 1 A 94 94 ARG H H 183 7.784 7.460 0.324 2
1 1145 . 1 1 A 94 94 ARG HA H 183 4.142 4.243 -0.101 2
1 1152 . 1 1 A 94 94 ARG C C 183 177.015 177.023 -0.008 2
1 1153 . 1 1 A 94 94 ARG CA C 183 55.350 56.144 -0.794 2
1 1154 . 1 1 A 94 94 ARG CB C 183 30.930 30.958 -0.028 2
1 1157 . 1 1 A 94 94 ARG N N 183 120.156 118.443 1.713 2
1 1158 . 1 1 A 95 95 GLY H H 184 8.144 8.873 -0.729 2
1 1159 . 1 1 A 95 95 GLY HA2 H 184 3.839 3.840 -0.001 2
1 1160 . 1 1 A 95 95 GLY HA3 H 184 3.681 3.898 -0.217 2
1 1161 . 1 1 A 95 95 GLY C C 184 173.653 173.306 0.347 2
1 1162 . 1 1 A 95 95 GLY CA C 184 46.160 45.987 0.173 2
1 1163 . 1 1 A 95 95 GLY N N 184 107.879 108.894 -1.015 2
1 1164 . 1 1 A 96 96 ASN H H 185 6.855 7.237 -0.382 2
1 1165 . 1 1 A 96 96 ASN HA H 185 4.909 5.064 -0.155 2
1 1170 . 1 1 A 96 96 ASN C C 185 174.223 173.342 0.881 2
1 1171 . 1 1 A 96 96 ASN CA C 185 52.720 52.192 0.528 2
1 1172 . 1 1 A 96 96 ASN CB C 185 45.620 41.884 3.736 2
1 1173 . 1 1 A 96 96 ASN N N 185 113.382 116.667 -3.285 2
1 1175 . 1 1 A 97 97 PHE H H 186 9.228 8.608 0.620 2
1 1176 . 1 1 A 97 97 PHE HA H 186 4.579 4.903 -0.324 2
1 1183 . 1 1 A 97 97 PHE C C 186 174.794 175.627 -0.833 2
1 1184 . 1 1 A 97 97 PHE CA C 186 59.384 58.641 0.743 2
1 1185 . 1 1 A 97 97 PHE CB C 186 40.450 39.598 0.852 2
1 1188 . 1 1 A 97 97 PHE N N 186 118.661 119.498 -0.837 2
1 1189 . 1 1 A 98 98 ILE H H 187 8.908 9.065 -0.157 2
1 1190 . 1 1 A 98 98 ILE HA H 187 5.440 4.855 0.585 2
1 1200 . 1 1 A 98 98 ILE C C 187 176.171 174.964 1.207 2
1 1201 . 1 1 A 98 98 ILE CA C 187 57.610 59.777 -2.167 2
1 1202 . 1 1 A 98 98 ILE CB C 187 41.280 40.853 0.427 2
1 1206 . 1 1 A 98 98 ILE N N 187 120.585 123.221 -2.636 2
1 1207 . 1 1 A 99 99 ILE H H 188 8.602 8.396 0.206 2
1 1208 . 1 1 A 99 99 ILE HA H 188 4.546 4.695 -0.149 2
1 1218 . 1 1 A 99 99 ILE C C 188 176.668 175.101 1.567 2
1 1219 . 1 1 A 99 99 ILE CA C 188 58.920 60.927 -2.007 2
1 1220 . 1 1 A 99 99 ILE CB C 188 37.960 38.308 -0.348 2
1 1224 . 1 1 A 99 99 ILE N N 188 124.500 125.837 -1.337 2
1 1225 . 1 1 A 100 100 LYS H H 189 8.449 8.497 -0.048 2
1 1226 . 1 1 A 100 100 LYS HA H 189 4.108 4.761 -0.653 2
1 1235 . 1 1 A 100 100 LYS C C 189 176.866 175.931 0.935 2
1 1236 . 1 1 A 100 100 LYS CA C 189 56.800 55.147 1.653 2
1 1237 . 1 1 A 100 100 LYS CB C 189 33.400 33.958 -0.558 2
1 1241 . 1 1 A 100 100 LYS N N 189 128.581 127.494 1.087 2
1 1242 . 1 1 A 101 101 GLY H H 190 8.381 8.516 -0.135 2
1 1243 . 1 1 A 101 101 GLY HA2 H 190 3.946 4.007 -0.061 2
1 1244 . 1 1 A 101 101 GLY HA3 H 190 3.828 4.010 -0.182 2
1 1245 . 1 1 A 101 101 GLY C C 190 172.902 173.980 -1.078 2
1 1246 . 1 1 A 101 101 GLY CA C 190 44.920 45.632 -0.712 2
1 1247 . 1 1 A 101 101 GLY N N 190 111.183 113.318 -2.135 2
stop_
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